#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fa3 s LYS 3 N 0.00 1.45 -1.42 0.00 1.02 -1.26 -4.78 119.74 114.74 2fa3 s LYS 3 Ca 0.00 -1.27 -0.06 0.00 0.02 0.00 0.00 55.97 54.65 2fa3 s LYS 3 Cb 0.00 -1.85 0.04 0.00 -0.52 0.00 0.00 37.83 35.50 2fa3 s LYS 3 CO 0.00 0.45 0.80 0.09 -0.92 0.00 0.00 175.35 175.77 2fa3 n ASN 4 N 1.12 -2.69 -4.75 2.83 3.02 -1.26 -1.05 115.26 112.49 2fa3 n ASN 4 Ca -0.18 -0.82 -0.41 0.00 -0.03 0.00 0.00 54.58 53.14 2fa3 n ASN 4 Cb 0.53 -3.87 -0.05 0.00 -0.61 0.00 0.00 39.78 35.78 2fa3 n ASN 4 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2fa3 s VAL 5 N -3.53 3.85 0.00 2.41 1.01 -1.26 -1.35 120.40 121.52 2fa3 s VAL 5 Ca 0.30 1.73 0.00 0.00 0.00 0.00 0.00 61.98 64.01 2fa3 s VAL 5 Cb -0.15 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.13 2fa3 s VAL 5 CO 0.83 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.90 2fa3 n GLY 6 N 1.66 0.63 3.55 4.51 0.00 -0.94 -2.26 105.19 112.34 2fa3 n GLY 6 Ca 0.00 0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 2fa3 n GLY 6 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fa3 s ILE 7 N 1.51 5.27 -0.03 -0.61 1.01 0.07 -2.06 121.20 126.36 2fa3 s ILE 7 Ca 0.00 -0.07 0.12 0.00 0.00 0.00 0.00 60.65 60.70 2fa3 s ILE 7 Cb 0.00 -3.70 -0.18 0.00 0.01 0.00 0.00 42.46 38.59 2fa3 s ILE 7 CO 0.00 0.03 0.92 -0.07 0.00 0.00 0.00 174.94 175.82 2fa3 h LEU 8 N 8.51 0.00 -7.00 2.97 3.38 0.26 -3.28 115.31 120.15 2fa3 h LEU 8 Ca -0.32 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.70 2fa3 h LEU 8 Cb 1.16 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.66 2fa3 h LEU 8 CO 0.63 0.88 0.44 0.00 0.09 0.00 0.00 178.44 180.47 2fa3 s ALA 9 N -2.72 -1.95 0.06 1.53 0.00 -1.22 -4.53 121.76 112.92 2fa3 s ALA 9 Ca -0.02 1.85 -0.05 0.00 0.00 0.00 0.00 51.96 53.74 2fa3 s ALA 9 Cb 0.09 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.87 2fa3 s ALA 9 CO 0.81 -0.25 0.08 0.00 0.00 0.00 0.00 175.76 176.40 2fa3 s MET 10 N 0.08 0.66 0.06 0.00 0.23 -1.26 -0.88 119.30 118.19 2fa3 s MET 10 Ca 0.02 -0.97 -0.13 0.00 -1.03 0.00 0.00 55.69 53.58 2fa3 s MET 10 Cb -0.04 0.25 0.02 0.00 -1.53 0.00 0.00 34.83 33.53 2fa3 s MET 10 CO -0.05 -0.17 0.30 0.34 -2.03 0.00 0.00 175.02 173.42 2fa3 s ASP 11 N -2.59 -0.11 0.05 -1.18 2.15 -0.40 -4.58 116.67 110.01 2fa3 s ASP 11 Ca 0.02 -0.27 0.03 0.00 0.43 0.00 0.00 52.55 52.75 2fa3 s ASP 11 Cb 0.03 0.37 -0.02 0.00 -0.30 0.00 0.00 42.92 43.00 2fa3 s ASP 11 CO -0.08 -0.67 -0.09 -0.51 -0.17 0.00 0.00 175.17 173.64 2fa3 s ILE 12 N -2.93 0.69 -0.00 4.11 2.07 -1.26 -1.24 121.20 122.63 2fa3 s ILE 12 Ca -0.02 -1.10 0.00 0.00 -1.41 0.00 0.00 60.65 58.12 2fa3 s ILE 12 Cb 0.00 -0.72 0.00 0.00 0.13 0.00 0.00 42.46 41.87 2fa3 s ILE 12 CO -0.06 -0.31 -0.01 -0.47 -1.91 0.00 0.00 174.94 172.18 2fa3 s TYR 13 N -1.29 0.12 -0.02 3.50 5.04 0.22 -4.89 117.35 120.03 2fa3 s TYR 13 Ca -0.07 -0.02 -0.04 0.00 -2.44 0.00 0.00 57.07 54.49 2fa3 s TYR 13 Cb -0.10 -0.09 0.00 0.00 0.35 0.00 0.00 41.96 42.13 2fa3 s TYR 13 CO 0.01 -0.01 0.10 -0.59 -1.34 0.00 0.00 175.55 173.72 2fa3 s PHE 14 N 0.01 -0.02 0.45 4.97 -0.12 -1.26 -0.43 117.98 121.58 2fa3 s PHE 14 Ca 0.00 0.05 -0.25 0.00 -0.05 0.00 0.00 56.93 56.68 2fa3 s PHE 14 Cb -0.01 -0.02 -0.09 0.00 -0.63 0.00 0.00 43.02 42.27 2fa3 s PHE 14 CO -0.00 -0.15 1.34 -0.35 -0.05 0.00 0.00 175.22 176.01 2fa3 n PRO 15 N 2.31 2.04 0.09 1.99 -0.04 -1.26 -4.83 135.00 135.29 2fa3 n PRO 15 Ca -0.17 0.73 0.12 0.00 -0.04 0.00 0.00 63.50 64.13 2fa3 n PRO 15 Cb 0.57 -2.50 0.45 0.00 -0.04 0.00 0.00 33.50 31.98 2fa3 n PRO 15 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2fa3 n PRO 16 N -0.17 0.16 -3.02 0.54 -0.05 -1.26 -4.66 135.00 126.55 2fa3 n PRO 16 Ca 0.06 0.30 -0.40 0.00 -0.05 0.00 0.00 63.50 63.41 2fa3 n PRO 16 Cb 0.41 -1.76 -0.05 0.00 -0.05 0.00 0.00 33.50 32.05 2fa3 n PRO 16 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 175.50 176.40 2fa3 s THR 17 N -3.18 4.98 0.18 0.52 -4.23 -1.26 -1.49 115.64 111.16 2fa3 s THR 17 Ca 0.07 1.40 -0.12 0.00 -1.18 0.00 0.00 61.69 61.87 2fa3 s THR 17 Cb 0.11 -4.03 0.00 0.00 1.34 0.00 0.00 72.50 69.92 2fa3 s THR 17 CO 0.44 0.11 0.38 0.00 -0.54 0.00 0.00 174.62 175.01 2fa3 s VAL 19 N -3.94 1.09 0.12 0.00 0.11 -0.53 -0.72 120.40 116.52 2fa3 s VAL 19 Ca 0.15 -0.71 -0.27 0.00 -2.93 0.00 0.00 61.98 58.22 2fa3 s VAL 19 Cb 0.02 -0.93 -0.07 0.00 -1.53 0.00 0.00 36.38 33.87 2fa3 s VAL 19 CO -0.00 0.21 0.84 -1.10 -3.33 0.00 0.00 175.10 171.72 2fa3 s GLN 20 N -0.58 4.61 0.11 1.54 -1.52 -1.26 -1.82 119.66 120.75 2fa3 s GLN 20 Ca 0.04 1.24 -0.18 0.00 -1.95 0.00 0.00 55.36 54.51 2fa3 s GLN 20 Cb -0.06 -3.33 -0.05 0.00 -0.22 0.00 0.00 33.01 29.35 2fa3 s GLN 20 CO 0.00 0.37 1.67 1.96 -0.25 0.00 0.00 175.29 179.04 2fa3 h GLN 21 N 5.12 0.43 -0.17 2.91 1.08 -1.70 -2.17 115.11 120.62 2fa3 h GLN 21 Ca -0.45 -0.07 0.05 0.00 -1.45 0.00 0.00 58.65 56.73 2fa3 h GLN 21 Cb 1.21 -0.07 -0.07 0.00 -0.05 0.00 0.00 27.48 28.49 2fa3 h GLN 21 CO 0.69 0.43 -0.41 0.93 -0.95 0.00 0.00 178.83 179.53 2fa3 h GLU 22 N 0.33 -0.45 -1.02 1.46 5.08 -1.89 0.63 114.58 118.72 2fa3 h GLU 22 Ca 0.10 0.03 0.26 0.00 -1.00 0.00 0.00 59.36 58.75 2fa3 h GLU 22 Cb 0.15 0.10 -0.12 0.00 0.50 0.00 0.00 28.75 29.39 2fa3 h GLU 22 CO -0.01 -0.30 0.62 0.00 -1.00 0.00 0.00 179.01 178.33 2fa3 h ALA 23 N 0.18 1.96 0.04 3.43 0.00 -1.95 -1.64 119.26 121.28 2fa3 h ALA 23 Ca 0.09 0.11 -0.26 0.00 0.00 0.00 0.00 54.91 54.85 2fa3 h ALA 23 Cb 0.61 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2fa3 h ALA 23 CO -0.42 -0.43 -1.06 1.25 0.00 0.00 0.00 179.25 178.59 2fa3 h LEU 24 N 0.50 0.69 -0.66 0.00 5.85 -0.60 -1.62 115.31 119.47 2fa3 h LEU 24 Ca 0.64 -0.58 0.11 0.00 0.84 0.00 0.00 57.88 58.89 2fa3 h LEU 24 Cb 1.37 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 2fa3 h LEU 24 CO -0.43 1.39 0.24 -0.33 -0.34 0.00 0.00 178.44 178.98 2fa3 h GLU 25 N 0.26 0.40 -0.65 1.25 5.08 -0.01 0.53 114.58 121.45 2fa3 h GLU 25 Ca -0.12 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2fa3 h GLU 25 Cb 1.72 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.85 2fa3 h GLU 25 CO 0.19 0.27 0.41 0.00 -1.00 0.00 0.00 179.01 178.88 2fa3 h ALA 26 N 1.46 0.83 -0.26 3.43 0.00 -1.17 -2.47 119.26 121.08 2fa3 h ALA 26 Ca 0.34 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.06 2fa3 h ALA 26 Cb 0.45 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2fa3 h ALA 26 CO -0.34 0.28 -0.31 1.25 0.00 0.00 0.00 179.25 180.13 2fa3 h HIS 27 N 0.88 0.81 -1.91 0.00 -0.00 -0.65 -3.41 115.15 110.87 2fa3 h HIS 27 Ca 0.23 -0.26 0.00 0.00 -0.00 0.00 0.00 60.37 60.35 2fa3 h HIS 27 Cb -0.06 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 27.19 2fa3 h HIS 27 CO -0.02 1.00 0.00 -0.25 -0.00 0.00 0.00 177.93 178.66 2fa3 n ASP 28 N -4.27 -0.16 -2.87 3.26 8.00 0.12 -4.95 116.55 115.68 2fa3 n ASP 28 Ca -0.04 -0.91 -0.34 0.00 0.71 0.00 0.00 54.79 54.20 2fa3 n ASP 28 Cb 0.48 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.59 2fa3 n ASP 28 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fa3 n GLY 29 N 4.60 5.80 3.79 0.44 0.00 -1.25 -4.84 105.19 113.73 2fa3 n GLY 29 Ca 0.00 -2.64 -0.35 0.00 0.00 0.00 0.00 46.02 43.02 2fa3 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fa3 s ALA 30 N -3.84 3.10 0.56 4.61 0.00 -0.94 -5.03 121.76 120.22 2fa3 s ALA 30 Ca 0.48 0.54 -0.21 0.00 0.00 0.00 0.00 51.96 52.77 2fa3 s ALA 30 Cb 0.37 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 2fa3 s ALA 30 CO -0.26 0.02 1.32 -1.54 0.00 0.00 0.00 175.76 175.30 2fa3 s SER 31 N -1.81 5.20 0.15 0.00 1.04 -1.26 -4.70 113.70 112.32 2fa3 s SER 31 Ca 0.57 2.67 -0.32 0.00 0.48 0.00 0.00 55.95 59.36 2fa3 s SER 31 Cb -0.16 -2.63 -0.11 0.00 0.10 0.00 0.00 66.02 63.22 2fa3 s SER 31 CO 0.21 -1.61 1.80 1.17 0.98 0.00 0.00 173.24 175.80 2fa3 n LYS 32 N -1.20 2.78 -0.93 4.02 4.81 -1.26 -1.49 118.16 124.89 2fa3 n LYS 32 Ca 0.11 1.01 0.00 0.00 -0.87 0.00 0.00 58.31 58.56 2fa3 n LYS 32 Cb 0.46 -2.89 0.00 0.00 0.02 0.00 0.00 35.03 32.62 2fa3 n LYS 32 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2fa3 n GLY 33 N 4.15 0.58 0.22 3.14 0.00 -1.26 -4.90 105.19 107.11 2fa3 n GLY 33 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 2fa3 n GLY 33 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2fa3 h LYS 34 N 1.40 0.00 0.05 1.61 3.64 -1.63 0.97 116.57 122.61 2fa3 h LYS 34 Ca 0.00 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.03 2fa3 h LYS 34 Cb 0.00 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 2fa3 h LYS 34 CO 0.00 0.26 -1.96 0.66 -2.27 0.00 0.00 179.45 176.15 2fa3 n TYR 35 N -3.72 0.80 0.14 1.91 0.53 -1.26 -2.64 117.16 112.92 2fa3 n TYR 35 Ca -0.01 0.23 0.00 0.00 -1.02 0.00 0.00 57.90 57.10 2fa3 n TYR 35 Cb 0.37 -1.10 0.28 0.00 -1.03 0.00 0.00 39.34 37.87 2fa3 n TYR 35 CO 0.00 0.00 0.00 1.79 -1.02 0.00 0.00 176.86 177.63 2fa3 h THR 36 N -0.38 1.30 0.00 -0.72 1.35 -1.64 -1.40 112.91 111.42 2fa3 h THR 36 Ca -0.47 -1.45 -0.15 0.00 -0.55 0.00 0.00 66.41 63.79 2fa3 h THR 36 Cb 1.75 1.72 -0.02 0.00 -1.73 0.00 0.00 68.15 69.87 2fa3 h THR 36 CO -0.10 0.42 -1.37 -0.38 -0.25 0.00 0.00 175.52 173.85 2fa3 n ILE 37 N -4.04 0.76 -0.35 6.82 2.08 0.24 -3.29 119.36 121.58 2fa3 n ILE 37 Ca -0.02 -0.06 -0.02 0.00 0.56 0.00 0.00 62.75 63.21 2fa3 n ILE 37 Cb 0.45 -1.70 0.11 0.00 -0.75 0.00 0.00 39.64 37.75 2fa3 n ILE 37 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2fa3 h GLY 38 N -0.40 1.34 0.39 7.39 0.00 -1.28 -2.85 103.07 107.67 2fa3 h GLY 38 Ca -0.22 -0.49 -0.28 0.00 0.00 0.00 0.00 47.33 46.34 2fa3 h GLY 38 CO -0.14 0.46 -2.03 1.04 0.00 0.00 0.00 176.54 175.88 2fa3 n LEU 39 N -4.44 0.34 0.00 3.11 4.77 -1.06 -4.76 117.00 114.97 2fa3 n LEU 39 Ca 0.11 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 2fa3 n LEU 39 Cb 0.04 0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2fa3 n LEU 39 CO 0.36 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 2fa3 n GLY 40 N 1.59 0.68 3.65 -0.72 0.00 -0.62 -0.59 105.19 109.18 2fa3 n GLY 40 Ca -0.22 -0.57 -0.33 0.00 0.00 0.00 0.00 46.02 44.90 2fa3 n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fa3 s GLN 41 N -1.04 2.79 -0.24 1.61 -1.52 -0.64 -4.56 119.66 116.06 2fa3 s GLN 41 Ca 0.00 -0.57 -0.09 0.00 -1.95 0.00 0.00 55.36 52.76 2fa3 s GLN 41 Cb 0.00 -2.65 -0.12 0.00 -0.22 0.00 0.00 33.01 30.02 2fa3 s GLN 41 CO 0.00 0.65 -0.29 -0.25 -0.25 0.00 0.00 175.29 175.15 2fa3 n ASP 42 N 1.77 1.85 -3.77 5.90 8.00 0.05 -3.75 116.55 126.61 2fa3 n ASP 42 Ca -0.16 0.19 -0.13 0.00 0.71 0.00 0.00 54.79 55.40 2fa3 n ASP 42 Cb 0.53 -0.63 -0.09 0.00 -0.02 0.00 0.00 41.12 40.92 2fa3 n ASP 42 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fa3 s LEU 44 N -1.46 0.99 -0.03 0.00 0.20 -0.75 -2.71 118.68 114.91 2fa3 s LEU 44 Ca -0.12 -0.37 -0.11 0.00 0.69 0.00 0.00 54.13 54.23 2fa3 s LEU 44 Cb -0.05 -0.63 -0.05 0.00 -0.43 0.00 0.00 46.19 45.03 2fa3 s LEU 44 CO 0.03 -0.20 0.30 0.00 -0.29 0.00 0.00 176.35 176.19 2fa3 s ALA 45 N 1.84 3.78 0.01 5.97 0.00 0.63 -1.46 121.76 132.53 2fa3 s ALA 45 Ca 0.03 -0.41 -0.03 0.00 0.00 0.00 0.00 51.96 51.55 2fa3 s ALA 45 Cb -0.14 -2.20 -0.01 0.00 0.00 0.00 0.00 23.12 20.77 2fa3 s ALA 45 CO -0.07 0.56 0.04 -0.59 0.00 0.00 0.00 175.76 175.70 2fa3 s PHE 46 N -1.12 0.14 -0.01 0.00 -0.12 -0.64 -2.90 117.98 113.31 2fa3 s PHE 46 Ca 0.22 -0.29 -0.30 0.00 -0.05 0.00 0.00 56.93 56.51 2fa3 s PHE 46 Cb -0.14 -0.11 -0.05 0.00 -0.63 0.00 0.00 43.02 42.09 2fa3 s PHE 46 CO 0.11 -0.20 1.30 0.00 -0.05 0.00 0.00 175.22 176.38 2fa3 n THR 48 N 4.53 0.00 0.25 0.00 -2.24 -1.26 -4.91 114.28 110.65 2fa3 n THR 48 Ca 0.12 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.02 2fa3 n THR 48 Cb 0.45 -1.95 0.59 0.00 -2.10 0.00 0.00 70.33 67.32 2fa3 n THR 48 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2fa3 h GLU 49 N 0.00 0.00 0.00 -0.78 4.81 -1.95 -2.30 114.58 114.36 2fa3 h GLU 49 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2fa3 h GLU 49 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2fa3 h GLU 49 CO 0.00 0.14 0.00 1.28 -0.73 0.00 0.00 179.01 179.70 2fa3 n LEU 50 N -3.35 0.53 -4.28 1.64 4.77 -1.26 -4.71 117.00 110.34 2fa3 n LEU 50 Ca -0.00 0.56 -0.19 0.00 -0.03 0.00 0.00 56.01 56.35 2fa3 n LEU 50 Cb 0.35 -0.40 -0.11 0.00 -2.33 0.00 0.00 43.42 40.93 2fa3 n LEU 50 CO 0.31 -0.16 -0.46 -1.61 -1.33 0.00 0.00 177.39 174.14 2fa3 s GLU 51 N -3.08 1.13 0.28 3.23 2.02 -0.87 -0.41 118.70 120.99 2fa3 s GLU 51 Ca 0.11 -1.33 -0.19 0.00 0.02 0.00 0.00 54.97 53.58 2fa3 s GLU 51 Cb 0.14 -1.05 0.07 0.00 0.10 0.00 0.00 34.13 33.39 2fa3 s GLU 51 CO 0.55 0.20 0.93 0.16 0.02 0.00 0.00 175.26 177.12 2fa3 s ASP 52 N -2.63 0.01 0.43 -0.19 1.47 -1.26 -4.58 116.67 109.93 2fa3 s ASP 52 Ca 0.13 -0.90 0.30 0.00 1.18 0.00 0.00 52.55 53.26 2fa3 s ASP 52 Cb -0.04 0.66 1.51 0.00 -0.34 0.00 0.00 42.92 44.71 2fa3 s ASP 52 CO 0.04 -1.31 1.91 -0.37 0.68 0.00 0.00 175.17 176.12 2fa3 h VAL 53 N 2.00 0.00 0.00 2.11 -1.51 -1.96 0.31 116.25 117.20 2fa3 h VAL 53 Ca -0.30 -0.11 -0.07 0.00 -1.23 0.00 0.00 66.70 65.00 2fa3 h VAL 53 Cb 1.23 0.84 -0.01 0.00 -2.13 0.00 0.00 31.29 31.22 2fa3 h VAL 53 CO 0.38 0.00 -0.47 0.40 -1.23 0.00 0.00 177.57 176.65 2fa3 h ILE 54 N 0.00 0.77 -0.63 7.19 2.04 -1.98 -2.81 117.51 122.09 2fa3 h ILE 54 Ca 0.00 -1.72 0.09 0.00 1.00 0.00 0.00 64.86 64.23 2fa3 h ILE 54 Cb 0.13 1.60 -0.07 0.00 -0.74 0.00 0.00 36.82 37.74 2fa3 h ILE 54 CO 0.00 0.26 0.26 0.77 0.00 0.00 0.00 178.15 179.44 2fa3 h SER 55 N -1.00 0.28 -0.74 1.72 4.64 -1.81 0.57 113.55 117.21 2fa3 h SER 55 Ca -0.10 0.07 0.06 0.00 -0.47 0.00 0.00 61.79 61.35 2fa3 h SER 55 Cb 0.77 0.04 -0.06 0.00 -0.31 0.00 0.00 62.40 62.84 2fa3 h SER 55 CO -0.06 0.16 0.43 0.24 -0.87 0.00 0.00 176.83 176.73 2fa3 h MET 56 N 0.45 0.77 -0.40 4.77 2.86 -0.51 -1.68 114.93 121.19 2fa3 h MET 56 Ca 0.32 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.83 2fa3 h MET 56 Cb 0.38 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 2fa3 h MET 56 CO -0.30 0.51 -0.07 0.77 1.06 0.00 0.00 176.91 178.88 2fa3 h SER 57 N 0.79 0.67 -0.27 1.22 0.02 -0.93 -1.07 113.55 113.97 2fa3 h SER 57 Ca 0.33 -0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 61.00 2fa3 h SER 57 Cb 0.19 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2fa3 h SER 57 CO -0.18 0.78 -0.22 -0.26 -1.14 0.00 0.00 176.83 175.81 2fa3 h PHE 58 N 0.63 0.74 -0.42 3.45 0.04 -0.53 -1.66 116.94 119.19 2fa3 h PHE 58 Ca 0.12 -0.21 0.08 0.00 2.80 0.00 0.00 57.97 60.76 2fa3 h PHE 58 Cb 0.51 -0.16 -0.08 0.00 2.20 0.00 0.00 35.95 38.42 2fa3 h PHE 58 CO 0.02 0.92 -0.06 -0.91 -0.60 0.00 0.00 178.31 177.68 2fa3 h ASN 59 N 0.36 -0.30 0.04 2.17 2.35 -0.76 -0.47 115.58 118.98 2fa3 h ASN 59 Ca 0.05 0.12 -0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2fa3 h ASN 59 Cb 0.77 0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.37 2fa3 h ASN 59 CO 0.06 -0.10 -0.02 0.00 -1.65 0.00 0.00 177.43 175.71 2fa3 h ALA 60 N 1.40 -0.06 -0.31 -0.83 0.00 -0.98 -2.66 119.26 115.83 2fa3 h ALA 60 Ca 0.21 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.95 2fa3 h ALA 60 Cb 0.31 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 2fa3 h ALA 60 CO -0.40 -0.28 -0.20 0.28 0.00 0.00 0.00 179.25 178.65 2fa3 h VAL 61 N -0.55 0.45 -0.32 0.00 2.07 -1.32 0.16 116.25 116.73 2fa3 h VAL 61 Ca -0.01 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.53 2fa3 h VAL 61 Cb 0.50 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 2fa3 h VAL 61 CO 0.01 0.00 0.22 0.74 0.02 0.00 0.00 177.57 178.56 2fa3 h THR 62 N -0.16 1.04 0.09 2.57 2.02 -1.07 -0.61 112.91 116.78 2fa3 h THR 62 Ca 0.16 -0.13 -0.13 0.00 0.77 0.00 0.00 66.41 67.09 2fa3 h THR 62 Cb 0.41 0.64 0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2fa3 h THR 62 CO -0.41 0.07 -0.56 -1.28 0.37 0.00 0.00 175.52 173.71 2fa3 h SER 63 N 0.38 0.30 -0.21 4.18 0.87 -1.04 -2.20 113.55 115.82 2fa3 h SER 63 Ca 0.13 -0.96 0.05 0.00 -1.23 0.00 0.00 61.79 59.78 2fa3 h SER 63 Cb 0.05 -0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 61.86 2fa3 h SER 63 CO -0.03 1.27 -0.12 0.25 -0.53 0.00 0.00 176.83 177.67 2fa3 h LEU 64 N -0.59 -0.39 0.69 2.23 6.46 -0.80 -2.03 115.31 120.88 2fa3 h LEU 64 Ca -0.10 0.09 -0.03 0.00 -0.12 0.00 0.00 57.88 57.72 2fa3 h LEU 64 Cb 1.42 0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.56 2fa3 h LEU 64 CO 0.09 -0.15 -0.45 -0.07 -0.62 0.00 0.00 178.44 177.24 2fa3 h LEU 65 N -0.10 -1.14 0.22 2.25 4.07 -1.13 -2.25 115.31 117.24 2fa3 h LEU 65 Ca 0.12 0.07 -0.00 0.00 0.08 0.00 0.00 57.88 58.14 2fa3 h LEU 65 Cb 0.28 0.34 -0.01 0.00 1.08 0.00 0.00 40.66 42.34 2fa3 h LEU 65 CO -0.28 -0.68 -0.26 -0.33 -1.08 0.00 0.00 178.44 175.81 2fa3 h GLU 66 N -1.08 -0.47 0.00 1.13 5.08 -1.45 -1.54 114.58 116.24 2fa3 h GLU 66 Ca -0.09 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2fa3 h GLU 66 Cb 0.88 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.23 2fa3 h GLU 66 CO 0.07 -0.32 -0.04 0.87 -1.00 0.00 0.00 179.01 178.60 2fa3 h LYS 67 N -0.49 0.00 -0.49 2.33 1.57 -1.40 0.27 116.57 118.36 2fa3 h LYS 67 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2fa3 h LYS 67 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2fa3 h LYS 67 CO -0.05 0.04 0.00 0.66 -0.57 0.00 0.00 179.45 179.52 2fa3 n TYR 68 N -3.18 0.63 -1.82 -1.35 4.02 -0.85 -4.96 117.16 109.66 2fa3 n TYR 68 Ca -0.00 -0.33 -0.21 0.00 -0.01 0.00 0.00 57.90 57.35 2fa3 n TYR 68 Cb 0.27 -0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.52 2fa3 n TYR 68 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2fa3 n LYS 69 N 1.48 -1.52 -2.76 -0.72 4.01 0.08 -4.95 118.16 113.79 2fa3 n LYS 69 Ca 0.20 1.17 -0.41 0.00 -0.51 0.00 0.00 58.31 58.76 2fa3 n LYS 69 Cb 0.60 -5.63 -0.04 0.00 -0.51 0.00 0.00 35.03 29.45 2fa3 n LYS 69 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2fa3 s ILE 70 N -2.84 4.67 0.03 -0.18 -1.09 -0.72 -5.03 121.20 116.04 2fa3 s ILE 70 Ca 0.00 2.00 -0.07 0.00 -2.23 0.00 0.00 60.65 60.36 2fa3 s ILE 70 Cb 0.00 -4.29 -0.05 0.00 -1.58 0.00 0.00 42.46 36.54 2fa3 s ILE 70 CO 0.00 0.27 0.29 1.51 -1.23 0.00 0.00 174.94 175.78 2fa3 s ASP 71 N 0.36 6.51 0.30 3.58 1.47 -1.26 -4.56 116.67 123.07 2fa3 s ASP 71 Ca 0.47 0.58 0.25 0.00 1.18 0.00 0.00 52.55 55.04 2fa3 s ASP 71 Cb -0.22 -2.10 1.02 0.00 -0.34 0.00 0.00 42.92 41.28 2fa3 s ASP 71 CO 0.28 0.23 1.76 -0.65 0.68 0.00 0.00 175.17 177.47 2fa3 h PRO 72 N 3.85 0.00 0.00 2.11 0.11 -1.97 -0.54 132.00 135.56 2fa3 h PRO 72 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2fa3 h PRO 72 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2fa3 h PRO 72 CO 0.67 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.09 2fa3 n LYS 73 N -2.38 0.09 0.00 1.05 5.02 -1.26 -3.26 118.16 117.42 2fa3 n LYS 73 Ca 0.02 0.27 0.13 0.00 -2.02 0.00 0.00 58.31 56.71 2fa3 n LYS 73 Cb 0.26 -1.65 0.31 0.00 -0.02 0.00 0.00 35.03 33.93 2fa3 n LYS 73 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2fa3 n GLN 74 N -1.82 1.07 -2.99 1.97 1.13 -0.21 -4.77 117.38 111.76 2fa3 n GLN 74 Ca 0.04 -0.71 -0.41 0.00 -1.94 0.00 0.00 57.00 53.97 2fa3 n GLN 74 Cb 0.24 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 29.05 2fa3 n GLN 74 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2fa3 s ILE 75 N -2.42 4.86 -0.03 5.09 -1.09 -1.20 -0.43 121.20 125.98 2fa3 s ILE 75 Ca 0.25 1.23 0.03 0.00 -2.23 0.00 0.00 60.65 59.93 2fa3 s ILE 75 Cb 0.19 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.95 2fa3 s ILE 75 CO 0.50 -0.13 0.08 0.61 -1.23 0.00 0.00 174.94 174.77 2fa3 n GLY 76 N 4.10 0.01 2.92 6.18 0.00 -0.22 -4.82 105.19 113.36 2fa3 n GLY 76 Ca 0.03 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.78 2fa3 n GLY 76 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2fa3 s ARG 77 N -2.05 0.76 -0.06 1.61 3.52 -1.20 -2.05 118.95 119.48 2fa3 s ARG 77 Ca -0.01 -0.14 -0.02 0.00 -0.13 0.00 0.00 55.73 55.42 2fa3 s ARG 77 Cb 0.02 -0.76 0.04 0.00 -1.56 0.00 0.00 34.95 32.69 2fa3 s ARG 77 CO 0.13 -0.02 0.08 -1.17 -0.81 0.00 0.00 175.30 173.52 2fa3 s LEU 78 N 0.62 0.11 0.03 -0.88 2.96 0.77 -0.69 118.68 121.59 2fa3 s LEU 78 Ca -0.08 0.08 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 2fa3 s LEU 78 Cb -0.12 -0.06 -0.02 0.00 0.50 0.00 0.00 46.19 46.50 2fa3 s LEU 78 CO 0.00 -0.26 -0.10 -1.61 -1.32 0.00 0.00 176.35 173.07 2fa3 s GLU 79 N 2.19 0.67 -0.08 1.98 2.02 -0.65 -4.18 118.70 120.66 2fa3 s GLU 79 Ca 0.04 -0.63 0.04 0.00 0.02 0.00 0.00 54.97 54.44 2fa3 s GLU 79 Cb -0.12 -0.59 0.00 0.00 0.10 0.00 0.00 34.13 33.52 2fa3 s GLU 79 CO -0.04 0.14 -0.20 0.08 0.02 0.00 0.00 175.26 175.26 2fa3 s VAL 80 N -0.87 1.77 -0.08 2.63 1.01 -1.12 -0.66 120.40 123.08 2fa3 s VAL 80 Ca -0.02 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 2fa3 s VAL 80 Cb -0.07 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 2fa3 s VAL 80 CO 0.01 0.50 0.01 -0.83 0.00 0.00 0.00 175.10 174.79 2fa3 s GLY 81 N 0.37 1.88 -0.13 4.51 0.00 0.19 -1.05 107.32 113.09 2fa3 s GLY 81 Ca -0.16 -0.81 -0.33 0.00 0.00 0.00 0.00 44.72 43.43 2fa3 s GLY 81 CO 0.07 -0.58 1.14 -0.45 0.00 0.00 0.00 173.10 173.28 2fa3 s SER 82 N -0.96 -0.18 0.00 1.64 0.15 -1.21 -1.88 113.70 111.26 2fa3 s SER 82 Ca 0.14 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2fa3 s SER 82 Cb -0.11 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 2fa3 s SER 82 CO 0.03 -0.33 0.72 -1.84 1.20 0.00 0.00 173.24 173.02 2fa3 n GLU 83 N -0.16 1.41 -3.12 5.44 0.28 -1.26 -4.54 120.64 118.68 2fa3 n GLU 83 Ca -0.02 -0.96 -0.45 0.00 -0.16 0.00 0.00 57.16 55.56 2fa3 n GLU 83 Cb 0.59 -0.76 -0.04 0.00 1.43 0.00 0.00 31.44 32.67 2fa3 n GLU 83 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2fa3 s THR 84 N -0.48 4.89 -0.21 3.84 2.01 -1.26 -4.99 115.64 119.43 2fa3 s THR 84 Ca 0.00 -1.16 -0.14 0.00 0.31 0.00 0.00 61.69 60.70 2fa3 s THR 84 Cb 0.00 -4.50 -0.04 0.00 0.01 0.00 0.00 72.50 67.97 2fa3 s THR 84 CO 0.00 -1.14 0.32 0.68 -0.69 0.00 0.00 174.62 173.79 2fa3 s VAL 85 N 2.47 5.26 -0.11 3.82 -7.23 -1.26 -4.90 120.40 118.44 2fa3 s VAL 85 Ca 0.13 0.53 0.17 0.00 -1.81 0.00 0.00 61.98 61.00 2fa3 s VAL 85 Cb -0.22 -3.65 -0.25 0.00 0.56 0.00 0.00 36.38 32.81 2fa3 s VAL 85 CO 0.04 0.29 0.21 2.30 -0.31 0.00 0.00 175.10 177.63 2fa3 n ILE 86 N 4.27 0.69 -4.37 -0.62 -5.35 -1.26 -4.95 119.36 107.77 2fa3 n ILE 86 Ca -0.11 -0.62 -0.19 0.00 -0.27 0.00 0.00 62.75 61.57 2fa3 n ILE 86 Cb 0.51 -0.27 -0.14 0.00 -1.74 0.00 0.00 39.64 37.99 2fa3 n ILE 86 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2fa3 s ASP 87 N -4.76 1.15 0.00 7.28 2.15 -1.26 -4.91 116.67 116.32 2fa3 s ASP 87 Ca -0.08 -0.21 0.28 0.00 0.43 0.00 0.00 52.55 52.97 2fa3 s ASP 87 Cb 0.08 -0.11 1.14 0.00 -0.30 0.00 0.00 42.92 43.73 2fa3 s ASP 87 CO 0.76 0.09 1.83 0.29 -0.17 0.00 0.00 175.17 177.97 2fa3 n LYS 88 N 2.70 0.31 0.00 4.34 5.02 -1.26 -4.40 118.16 124.87 2fa3 n LYS 88 Ca -0.14 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 2fa3 n LYS 88 Cb 0.56 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 2fa3 n LYS 88 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2fa3 n SER 89 N -1.27 0.98 -4.54 4.39 2.88 -1.26 -5.02 113.62 109.78 2fa3 n SER 89 Ca 0.10 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.22 2fa3 n SER 89 Cb 0.30 0.10 -0.06 0.00 -0.75 0.00 0.00 64.21 63.80 2fa3 n SER 89 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2fa3 s LYS 90 N -1.19 3.44 0.58 -1.46 2.20 -1.26 -5.04 119.74 117.01 2fa3 s LYS 90 Ca 0.00 -0.13 -0.15 0.00 -0.36 0.00 0.00 55.97 55.32 2fa3 s LYS 90 Cb 0.00 -3.91 -0.04 0.00 -1.51 0.00 0.00 37.83 32.37 2fa3 s LYS 90 CO 0.00 -0.99 1.04 -1.54 -0.36 0.00 0.00 175.35 173.49 2fa3 s SER 91 N 2.01 6.01 0.43 1.43 1.04 -1.26 -4.54 113.70 118.81 2fa3 s SER 91 Ca 0.27 1.71 0.10 0.00 0.48 0.00 0.00 55.95 58.50 2fa3 s SER 91 Cb -0.13 -2.52 0.96 0.00 0.10 0.00 0.00 66.02 64.43 2fa3 s SER 91 CO 0.20 -1.01 2.06 0.40 0.98 0.00 0.00 173.24 175.87 2fa3 h ILE 92 N 0.44 1.05 -0.93 -1.02 2.04 -1.96 -2.04 117.51 115.08 2fa3 h ILE 92 Ca -0.46 -0.15 0.17 0.00 1.00 0.00 0.00 64.86 65.41 2fa3 h ILE 92 Cb 1.21 0.58 -0.08 0.00 -0.74 0.00 0.00 36.82 37.79 2fa3 h ILE 92 CO 0.59 0.08 0.60 0.50 0.00 0.00 0.00 178.15 179.91 2fa3 h LYS 93 N 0.43 0.66 -0.13 2.37 3.11 -1.92 -1.40 116.57 119.69 2fa3 h LYS 93 Ca 0.15 -0.04 -0.13 0.00 -2.81 0.00 0.00 60.65 57.82 2fa3 h LYS 93 Cb 0.06 -0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 31.13 2fa3 h LYS 93 CO -0.03 0.43 -0.47 1.79 -2.81 0.00 0.00 179.45 178.36 2fa3 h THR 94 N 0.68 1.33 -0.59 1.00 1.35 -1.74 -2.75 112.91 112.19 2fa3 h THR 94 Ca 0.49 -1.67 -0.04 0.00 -0.55 0.00 0.00 66.41 64.63 2fa3 h THR 94 Cb 0.84 1.75 -0.03 0.00 -1.73 0.00 0.00 68.15 68.99 2fa3 h THR 94 CO -0.25 0.51 0.19 -0.26 -0.25 0.00 0.00 175.52 175.46 2fa3 h PHE 95 N 0.26 0.90 0.00 4.73 0.04 -1.33 -2.34 116.94 119.21 2fa3 h PHE 95 Ca 0.02 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.70 2fa3 h PHE 95 Cb 0.93 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.81 2fa3 h PHE 95 CO 0.02 0.72 -0.08 -0.07 -0.60 0.00 0.00 178.31 178.31 2fa3 h LEU 96 N 0.86 0.00 -2.14 1.54 4.07 -1.13 -2.16 115.31 116.35 2fa3 h LEU 96 Ca 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.15 2fa3 h LEU 96 Cb 0.24 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.98 2fa3 h LEU 96 CO -0.01 0.08 -0.03 0.24 -1.08 0.00 0.00 178.44 177.64 2fa3 h MET 97 N 0.00 0.00 -0.65 1.13 2.86 -1.28 -1.25 114.93 115.73 2fa3 h MET 97 Ca -0.00 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.78 2fa3 h MET 97 Cb 0.44 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 31.99 2fa3 h MET 97 CO 0.01 0.03 -0.04 1.96 1.06 0.00 0.00 176.91 179.93 2fa3 h GLN 98 N 0.00 0.08 -0.00 1.72 4.20 -1.49 -0.14 115.11 119.47 2fa3 h GLN 98 Ca -0.00 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2fa3 h GLN 98 Cb 0.28 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 2fa3 h GLN 98 CO 0.00 0.05 0.02 -0.07 -0.67 0.00 0.00 178.83 178.17 2fa3 h LEU 99 N 0.08 0.00 -1.24 1.46 4.07 -1.45 -2.94 115.31 115.30 2fa3 h LEU 99 Ca 0.34 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.30 2fa3 h LEU 99 Cb 0.56 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.30 2fa3 h LEU 99 CO -0.59 0.00 -0.24 0.49 -1.08 0.00 0.00 178.44 177.02 2fa3 n PHE 100 N -3.15 0.00 0.65 1.13 3.01 -0.09 -4.34 117.46 114.67 2fa3 n PHE 100 Ca -0.03 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.56 2fa3 n PHE 100 Cb 0.09 0.00 0.38 0.00 -0.01 0.00 0.00 39.48 39.95 2fa3 n PHE 100 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2fa3 n GLU 101 N 0.37 0.25 0.10 -1.08 1.02 -1.03 -2.62 120.64 117.65 2fa3 n GLU 101 Ca 0.09 0.18 -0.04 0.00 -0.02 0.00 0.00 57.16 57.36 2fa3 n GLU 101 Cb 0.42 -1.76 0.05 0.00 -0.02 0.00 0.00 31.44 30.13 2fa3 n GLU 101 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2fa3 h LYS 102 N 0.00 0.04 -0.32 3.49 1.79 -1.76 -3.19 116.57 116.62 2fa3 h LYS 102 Ca 0.00 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2fa3 h LYS 102 Cb 0.72 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.38 2fa3 h LYS 102 CO 0.00 0.80 0.00 0.00 -1.08 0.00 0.00 179.45 179.17 2fa3 n GLY 104 N 0.84 0.63 3.39 0.00 0.00 -1.10 -4.95 105.19 104.00 2fa3 n GLY 104 Ca 0.13 -0.49 -0.45 0.00 0.00 0.00 0.00 46.02 45.22 2fa3 n GLY 104 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2fa3 s ASN 105 N -2.72 6.37 0.00 1.61 2.47 -1.08 -4.82 114.94 116.77 2fa3 s ASN 105 Ca 0.00 -1.74 0.05 0.00 0.42 0.00 0.00 52.86 51.59 2fa3 s ASN 105 Cb 0.00 -2.32 -0.02 0.00 -1.45 0.00 0.00 41.25 37.46 2fa3 s ASN 105 CO 0.00 -1.04 0.38 0.35 -3.72 0.00 0.00 177.10 173.06 2fa3 n THR 106 N 5.31 0.00 -2.43 -5.21 -2.24 -1.26 -4.72 114.28 103.72 2fa3 n THR 106 Ca 0.02 -0.42 -0.43 0.00 -2.27 0.00 0.00 64.05 60.95 2fa3 n THR 106 Cb 0.45 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 2fa3 n THR 106 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2fa3 n ASP 107 N -0.61 4.75 -3.67 3.42 -0.08 -1.26 -4.89 116.55 114.21 2fa3 n ASP 107 Ca 0.02 -2.92 -0.29 0.00 -1.51 0.00 0.00 54.79 50.10 2fa3 n ASP 107 Cb 0.10 -1.71 -0.16 0.00 2.34 0.00 0.00 41.12 41.70 2fa3 n ASP 107 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2fa3 s VAL 108 N 3.64 0.41 0.89 5.18 1.01 -1.26 -4.78 120.40 125.50 2fa3 s VAL 108 Ca 0.51 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 2fa3 s VAL 108 Cb 0.06 -1.17 0.13 0.00 0.00 0.00 0.00 36.38 35.39 2fa3 s VAL 108 CO 0.04 -0.51 1.10 -1.61 0.00 0.00 0.00 175.10 174.12 2fa3 s GLU 109 N 1.88 1.26 0.00 2.72 2.02 -0.87 -4.66 118.70 121.04 2fa3 s GLU 109 Ca 0.05 1.19 0.00 0.00 0.02 0.00 0.00 54.97 56.23 2fa3 s GLU 109 Cb -0.17 -1.78 0.00 0.00 0.10 0.00 0.00 34.13 32.28 2fa3 s GLU 109 CO -0.22 -2.35 0.00 0.41 0.02 0.00 0.00 175.26 173.13 2fa3 n GLY 110 N -0.49 2.99 0.00 -1.39 0.00 -1.26 -0.17 105.19 104.88 2fa3 n GLY 110 Ca 0.09 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.41 2fa3 n GLY 110 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2fa3 n VAL 111 N 0.18 0.00 -3.44 1.61 0.24 -1.26 -4.81 118.33 110.85 2fa3 n VAL 111 Ca 0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 61.96 2fa3 n VAL 111 Cb 0.00 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.31 2fa3 n VAL 111 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2fa3 s ASP 112 N 1.00 6.72 -0.19 -1.34 1.11 -1.26 -2.81 116.67 119.89 2fa3 s ASP 112 Ca 0.00 0.95 -0.05 0.00 0.18 0.00 0.00 52.55 53.62 2fa3 s ASP 112 Cb 0.00 -2.24 -0.03 0.00 1.07 0.00 0.00 42.92 41.72 2fa3 s ASP 112 CO 0.00 0.08 0.01 -0.44 1.18 0.00 0.00 175.17 176.01 2fa3 s SER 113 N -1.89 5.04 -0.15 0.27 0.01 -0.21 -4.95 113.70 111.81 2fa3 s SER 113 Ca 0.38 -0.12 -0.00 0.00 1.31 0.00 0.00 55.95 57.52 2fa3 s SER 113 Cb -0.14 -1.86 -0.00 0.00 0.21 0.00 0.00 66.02 64.23 2fa3 s SER 113 CO 0.19 0.10 -0.14 -0.89 0.41 0.00 0.00 173.24 172.92 2fa3 s THR 114 N 0.77 2.77 -0.30 1.44 2.01 -1.26 -3.32 115.64 117.75 2fa3 s THR 114 Ca 0.01 -0.74 -0.07 0.00 0.31 0.00 0.00 61.69 61.20 2fa3 s THR 114 Cb -0.14 -2.17 0.19 0.00 0.01 0.00 0.00 72.50 70.39 2fa3 s THR 114 CO 0.02 0.51 0.94 0.21 -0.69 0.00 0.00 174.62 175.61 2fa3 s ASN 115 N 0.77 -0.69 0.00 3.53 3.84 -1.26 -4.88 114.94 116.25 2fa3 s ASN 115 Ca -0.06 0.09 0.00 0.00 0.21 0.00 0.00 52.86 53.10 2fa3 s ASN 115 Cb -0.15 1.44 0.00 0.00 -0.55 0.00 0.00 41.25 41.99 2fa3 s ASN 115 CO 0.01 -0.13 0.00 0.00 -2.79 0.00 0.00 177.10 174.19 2fa3 n ALA 116 N 5.19 0.00 0.00 1.71 0.00 -1.26 -2.92 120.51 123.22 2fa3 n ALA 116 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2fa3 n ALA 116 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 2fa3 n ALA 116 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2fa3 n TYR 118 N 0.00 0.00 -0.38 0.00 9.36 -1.23 -4.39 117.16 120.52 2fa3 n TYR 118 Ca 0.00 0.00 0.38 0.00 3.32 0.00 0.00 57.90 61.60 2fa3 n TYR 118 Cb 0.00 0.00 0.75 0.00 -0.63 0.00 0.00 39.34 39.46 2fa3 n TYR 118 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2fa3 h GLY 119 N 0.00 0.00 0.66 2.98 0.00 -1.76 -2.68 103.07 102.27 2fa3 h GLY 119 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2fa3 h GLY 119 CO 0.00 0.00 -0.27 -1.33 0.00 0.00 0.00 176.54 174.94 2fa3 h GLY 120 N 0.00 0.34 0.39 4.60 0.00 -1.82 -2.45 103.07 104.13 2fa3 h GLY 120 Ca 0.62 -0.46 0.08 0.00 0.00 0.00 0.00 47.33 47.57 2fa3 h GLY 120 CO -0.01 0.41 0.08 -0.84 0.00 0.00 0.00 176.54 176.18 2fa3 h THR 121 N -0.19 0.74 -0.89 4.70 2.02 -1.79 0.99 112.91 118.49 2fa3 h THR 121 Ca -0.01 -0.07 0.04 0.00 0.77 0.00 0.00 66.41 67.14 2fa3 h THR 121 Cb 0.91 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.77 2fa3 h THR 121 CO 0.06 0.04 0.58 0.00 0.37 0.00 0.00 175.52 176.57 2fa3 h ALA 122 N 1.36 1.46 -0.18 6.16 0.00 -1.44 0.60 119.26 127.24 2fa3 h ALA 122 Ca 0.23 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 2fa3 h ALA 122 Cb 0.30 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2fa3 h ALA 122 CO -0.31 0.44 -0.09 0.00 0.00 0.00 0.00 179.25 179.29 2fa3 h ALA 123 N 1.49 0.25 -0.58 0.00 0.00 -0.74 -1.21 119.26 118.47 2fa3 h ALA 123 Ca 0.36 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 2fa3 h ALA 123 Cb 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2fa3 h ALA 123 CO -0.12 0.08 0.08 1.25 0.00 0.00 0.00 179.25 180.55 2fa3 h LEU 124 N 0.06 0.94 -0.37 0.00 5.85 -0.19 0.68 115.31 122.27 2fa3 h LEU 124 Ca 0.04 -0.27 0.07 0.00 0.84 0.00 0.00 57.88 58.56 2fa3 h LEU 124 Cb 0.58 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 2fa3 h LEU 124 CO 0.03 0.97 0.01 -0.07 -0.34 0.00 0.00 178.44 179.03 2fa3 h LEU 125 N 0.87 -0.14 -0.69 2.25 3.38 -0.86 -1.42 115.31 118.70 2fa3 h LEU 125 Ca 0.18 0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.28 2fa3 h LEU 125 Cb 0.44 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 2fa3 h LEU 125 CO 0.01 -0.03 0.40 0.78 0.09 0.00 0.00 178.44 179.69 2fa3 h ASN 126 N 0.11 0.60 -0.51 -0.43 2.35 0.07 0.18 115.58 117.96 2fa3 h ASN 126 Ca 0.18 0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.96 2fa3 h ASN 126 Cb 0.25 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 2fa3 h ASN 126 CO -0.30 0.39 0.33 0.00 -1.65 0.00 0.00 177.43 176.21 2fa3 h VAL 128 N 0.68 0.36 -0.88 0.00 2.07 -0.47 -2.26 116.25 115.75 2fa3 h VAL 128 Ca 0.19 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.87 2fa3 h VAL 128 Cb -0.08 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 29.98 2fa3 h VAL 128 CO -0.04 0.00 0.57 0.78 0.02 0.00 0.00 177.57 178.90 2fa3 h ASN 129 N -0.61 0.54 -0.61 0.57 2.35 -0.92 0.63 115.58 117.54 2fa3 h ASN 129 Ca -0.00 0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.72 2fa3 h ASN 129 Cb 0.58 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.86 2fa3 h ASN 129 CO -0.09 0.25 0.10 -0.25 -1.65 0.00 0.00 177.43 175.79 2fa3 h TRP 130 N 0.56 1.10 -0.25 1.19 7.01 -0.93 -2.38 115.95 122.25 2fa3 h TRP 130 Ca 0.45 -0.14 -0.13 0.00 2.11 0.00 0.00 58.89 61.18 2fa3 h TRP 130 Cb 0.89 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 27.63 2fa3 h TRP 130 CO -0.00 0.93 -0.39 0.28 -2.79 0.00 0.00 178.44 176.46 2fa3 h VAL 131 N 0.97 1.30 0.00 2.65 2.07 -0.30 -2.07 116.25 120.87 2fa3 h VAL 131 Ca 0.20 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 66.17 2fa3 h VAL 131 Cb 0.42 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2fa3 h VAL 131 CO 0.01 0.49 0.00 -0.62 0.02 0.00 0.00 177.57 177.47 2fa3 n GLU 132 N -4.04 0.96 -3.88 1.57 1.02 -0.88 -4.76 120.64 110.63 2fa3 n GLU 132 Ca -0.02 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.92 2fa3 n GLU 132 Cb 0.51 -1.31 -0.02 0.00 -0.02 0.00 0.00 31.44 30.59 2fa3 n GLU 132 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2fa3 s SER 133 N -1.64 6.07 0.22 1.62 1.04 -0.78 -4.95 113.70 115.28 2fa3 s SER 133 Ca 0.29 -0.06 0.21 0.00 0.48 0.00 0.00 55.95 56.86 2fa3 s SER 133 Cb 0.13 -1.61 0.91 0.00 0.10 0.00 0.00 66.02 65.56 2fa3 s SER 133 CO 0.22 -0.16 1.63 0.59 0.98 0.00 0.00 173.24 176.50 2fa3 n ASN 134 N -1.42 0.51 -0.70 7.02 5.03 -1.26 -1.35 115.26 123.09 2fa3 n ASN 134 Ca -0.07 0.65 0.13 0.00 0.87 0.00 0.00 54.58 56.17 2fa3 n ASN 134 Cb 0.57 -0.75 0.34 0.00 -1.02 0.00 0.00 39.78 38.92 2fa3 n ASN 134 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 2fa3 n SER 135 N -2.10 2.18 -4.72 6.41 3.41 -1.26 -4.94 113.62 112.60 2fa3 n SER 135 Ca 0.01 -1.73 -0.42 0.00 -0.26 0.00 0.00 58.87 56.48 2fa3 n SER 135 Cb 0.17 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 2fa3 n SER 135 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2fa3 s TRP 136 N -1.98 2.94 -1.83 7.33 -0.00 -0.46 -4.90 118.94 120.04 2fa3 s TRP 136 Ca 0.34 0.40 0.18 0.00 -0.00 0.00 0.00 56.10 57.02 2fa3 s TRP 136 Cb 0.21 -4.09 0.54 0.00 -0.00 0.00 0.00 33.47 30.12 2fa3 s TRP 136 CO 0.32 -4.13 1.45 -0.40 -0.00 0.00 0.00 176.95 174.19 2fa3 n ASP 137 N 3.99 3.38 0.00 5.86 3.85 -1.26 -4.92 116.55 127.45 2fa3 n ASP 137 Ca 0.15 -2.08 0.00 0.00 -0.71 0.00 0.00 54.79 52.15 2fa3 n ASP 137 Cb 0.36 -0.43 0.00 0.00 -1.35 0.00 0.00 41.12 39.70 2fa3 n ASP 137 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2fa3 n GLY 138 N 1.35 1.11 3.99 6.12 0.00 -1.26 -5.06 105.19 111.45 2fa3 n GLY 138 Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 2fa3 n GLY 138 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fa3 s ARG 139 N -0.41 2.67 0.46 1.61 0.52 -1.26 -5.07 118.95 117.47 2fa3 s ARG 139 Ca 0.00 -1.05 -0.23 0.00 -0.52 0.00 0.00 55.73 53.94 2fa3 s ARG 139 Cb 0.00 -2.63 -0.07 0.00 0.52 0.00 0.00 34.95 32.77 2fa3 s ARG 139 CO 0.00 -0.50 1.15 0.71 0.02 0.00 0.00 175.30 176.68 2fa3 s TYR 140 N -2.56 2.89 0.31 -0.53 1.51 0.43 -4.71 117.35 114.69 2fa3 s TYR 140 Ca 0.56 1.55 -0.02 0.00 -1.01 0.00 0.00 57.07 58.15 2fa3 s TYR 140 Cb -0.10 -3.35 -0.04 0.00 -0.11 0.00 0.00 41.96 38.36 2fa3 s TYR 140 CO 0.36 -1.43 0.55 0.20 -1.11 0.00 0.00 175.55 174.11 2fa3 s GLY 141 N -1.42 1.61 -0.03 0.71 0.00 -0.32 -1.06 107.32 106.81 2fa3 s GLY 141 Ca 0.64 -0.73 -0.01 0.00 0.00 0.00 0.00 44.72 44.62 2fa3 s GLY 141 CO 0.33 -0.65 0.03 -2.27 0.00 0.00 0.00 173.10 170.54 2fa3 s LEU 142 N -3.92 0.80 -0.13 0.66 0.20 0.13 0.08 118.68 116.50 2fa3 s LEU 142 Ca 0.42 0.02 -0.02 0.00 0.69 0.00 0.00 54.13 55.24 2fa3 s LEU 142 Cb -0.10 -0.17 -0.02 0.00 -0.43 0.00 0.00 46.19 45.46 2fa3 s LEU 142 CO 0.33 -0.16 -0.08 -0.69 -0.29 0.00 0.00 176.35 175.46 2fa3 s VAL 143 N 1.45 3.52 -0.14 1.68 1.01 0.11 -1.63 120.40 126.39 2fa3 s VAL 143 Ca -0.04 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 2fa3 s VAL 143 Cb -0.13 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 2fa3 s VAL 143 CO -0.03 0.52 -0.08 -0.63 0.00 0.00 0.00 175.10 174.89 2fa3 s ILE 144 N 0.19 3.55 -0.38 2.22 1.09 0.17 -0.93 121.20 127.11 2fa3 s ILE 144 Ca -0.05 -0.48 -0.13 0.00 -1.10 0.00 0.00 60.65 58.90 2fa3 s ILE 144 Cb -0.14 -2.53 0.02 0.00 -1.06 0.00 0.00 42.46 38.75 2fa3 s ILE 144 CO 0.04 0.51 0.24 0.00 -0.10 0.00 0.00 174.94 175.63 2fa3 s THR 146 N 1.62 0.88 0.01 0.00 -1.32 -0.79 -0.33 115.64 115.71 2fa3 s THR 146 Ca 0.04 -0.54 -0.28 0.00 -1.21 0.00 0.00 61.69 59.70 2fa3 s THR 146 Cb -0.19 -0.75 0.10 0.00 -1.51 0.00 0.00 72.50 70.15 2fa3 s THR 146 CO 0.08 0.20 0.85 -1.81 -2.21 0.00 0.00 174.62 171.73 2fa3 s ASP 147 N -0.38 -0.40 -0.31 8.08 1.01 -1.02 -4.33 116.67 119.32 2fa3 s ASP 147 Ca 0.04 0.04 -0.02 0.00 0.71 0.00 0.00 52.55 53.31 2fa3 s ASP 147 Cb -0.05 0.41 0.10 0.00 1.01 0.00 0.00 42.92 44.40 2fa3 s ASP 147 CO -0.00 -0.65 0.12 -0.55 0.21 0.00 0.00 175.17 174.30 2fa3 s SER 148 N -2.41 3.72 -0.23 0.27 0.15 -1.26 -2.36 113.70 111.57 2fa3 s SER 148 Ca 0.04 -1.53 -0.29 0.00 0.70 0.00 0.00 55.95 54.86 2fa3 s SER 148 Cb -0.01 -0.59 0.00 0.00 -1.71 0.00 0.00 66.02 63.71 2fa3 s SER 148 CO -0.09 -0.42 1.17 0.00 1.20 0.00 0.00 173.24 175.11 2fa3 s ALA 149 N 1.78 3.61 -0.01 5.45 0.00 0.33 -4.96 121.76 127.96 2fa3 s ALA 149 Ca 0.10 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.31 2fa3 s ALA 149 Cb -0.17 -3.63 -0.00 0.00 0.00 0.00 0.00 23.12 19.32 2fa3 s ALA 149 CO -0.29 -1.27 -0.03 0.08 0.00 0.00 0.00 175.76 174.25 2fa3 s VAL 150 N 3.55 0.28 0.26 0.00 1.01 -1.26 -2.46 120.40 121.78 2fa3 s VAL 150 Ca 0.50 -0.14 0.10 0.00 0.00 0.00 0.00 61.98 62.44 2fa3 s VAL 150 Cb -0.17 -0.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.90 2fa3 s VAL 150 CO 0.13 0.09 -0.16 -0.31 0.00 0.00 0.00 175.10 174.85 2fa3 s TYR 151 N 0.01 2.08 0.41 5.22 2.02 -1.26 -4.41 117.35 121.42 2fa3 s TYR 151 Ca 0.00 -0.46 -0.26 0.00 -0.37 0.00 0.00 57.07 55.98 2fa3 s TYR 151 Cb -0.03 -0.98 -0.09 0.00 -0.40 0.00 0.00 41.96 40.47 2fa3 s TYR 151 CO -0.00 0.54 1.32 0.00 -1.57 0.00 0.00 175.55 175.84 2fa3 s ALA 152 N -2.72 3.26 0.00 3.71 0.00 -1.26 -4.61 121.76 120.14 2fa3 s ALA 152 Ca 0.28 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.50 2fa3 s ALA 152 Cb -0.02 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.60 2fa3 s ALA 152 CO 0.12 -0.87 0.00 -0.85 0.00 0.00 0.00 175.76 174.16 2fa3 n GLU 153 N 0.09 0.00 0.00 0.00 0.28 -1.26 -3.91 120.64 115.83 2fa3 n GLU 153 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.04 2fa3 n GLU 153 Cb 0.43 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.30 2fa3 n GLU 153 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2fa3 n GLY 154 N 0.00 -2.28 0.00 -1.84 0.00 -1.26 -4.58 105.19 95.23 2fa3 n GLY 154 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2fa3 n GLY 154 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2fa3 n PRO 155 N 0.00 0.00 -0.02 1.61 -0.04 -1.26 -3.09 135.00 132.20 2fa3 n PRO 155 Ca 0.00 0.45 0.07 0.00 -0.04 0.00 0.00 63.50 63.98 2fa3 n PRO 155 Cb 0.00 -1.57 -0.15 0.00 -0.04 0.00 0.00 33.50 31.74 2fa3 n PRO 155 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fa3 n ALA 156 N -1.45 2.58 -0.31 0.55 0.00 -1.26 -4.43 120.51 116.18 2fa3 n ALA 156 Ca -0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 53.44 52.79 2fa3 n ALA 156 Cb 0.06 -0.61 -0.06 0.00 0.00 0.00 0.00 19.45 18.84 2fa3 n ALA 156 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2fa3 n ARG 157 N -2.26 -0.31 0.25 0.00 0.63 -1.18 -1.24 116.66 112.56 2fa3 n ARG 157 Ca -0.07 1.13 0.09 0.00 -0.92 0.00 0.00 57.85 58.08 2fa3 n ARG 157 Cb 0.60 -1.66 0.50 0.00 0.45 0.00 0.00 32.46 32.35 2fa3 n ARG 157 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 2fa3 h PRO 158 N 0.00 0.00 -0.53 -0.14 0.11 -1.83 -1.55 132.00 128.07 2fa3 h PRO 158 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2fa3 h PRO 158 Cb 0.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.44 2fa3 h PRO 158 CO -0.71 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.33 2fa3 n THR 159 N -2.43 0.87 -1.18 -1.15 -2.24 -0.37 -4.96 114.28 102.82 2fa3 n THR 159 Ca -0.01 -0.65 -0.29 0.00 -2.27 0.00 0.00 64.05 60.83 2fa3 n THR 159 Cb 0.43 0.11 0.19 0.00 -2.10 0.00 0.00 70.33 68.96 2fa3 n THR 159 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2fa3 s GLY 160 N -0.85 1.57 -0.03 3.38 0.00 -0.59 -3.23 107.32 107.57 2fa3 s GLY 160 Ca 0.30 -0.54 -0.30 0.00 0.00 0.00 0.00 44.72 44.18 2fa3 s GLY 160 CO 0.17 0.14 1.32 -0.32 0.00 0.00 0.00 173.10 174.41 2fa3 s GLY 161 N -3.62 -0.33 -0.12 0.20 0.00 -0.85 -2.83 107.32 99.77 2fa3 s GLY 161 Ca 0.67 0.50 -0.27 0.00 0.00 0.00 0.00 44.72 45.62 2fa3 s GLY 161 CO 0.57 2.28 0.65 0.00 0.00 0.00 0.00 173.10 176.60 2fa3 s ALA 162 N -2.19 -1.66 -0.25 3.20 0.00 -1.14 -0.52 121.76 119.20 2fa3 s ALA 162 Ca 0.20 1.47 -0.29 0.00 0.00 0.00 0.00 51.96 53.34 2fa3 s ALA 162 Cb 0.03 -0.42 0.17 0.00 0.00 0.00 0.00 23.12 22.91 2fa3 s ALA 162 CO -0.03 -0.34 1.24 0.00 0.00 0.00 0.00 175.76 176.62 2fa3 s ALA 163 N -0.61 -2.07 -0.00 0.00 0.00 -1.00 -4.37 121.76 113.72 2fa3 s ALA 163 Ca -0.07 1.77 0.03 0.00 0.00 0.00 0.00 51.96 53.69 2fa3 s ALA 163 Cb -0.02 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 2fa3 s ALA 163 CO 0.06 -0.24 -0.06 0.00 0.00 0.00 0.00 175.76 175.52 2fa3 s ALA 164 N -0.85 3.05 -0.04 0.00 0.00 0.43 -2.42 121.76 121.93 2fa3 s ALA 164 Ca 0.05 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 51.02 2fa3 s ALA 164 Cb -0.01 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.96 2fa3 s ALA 164 CO -0.06 0.61 -0.08 0.42 0.00 0.00 0.00 175.76 176.66 2fa3 s ILE 165 N -1.00 0.75 -0.13 0.00 1.01 0.55 -0.61 121.20 121.77 2fa3 s ILE 165 Ca 0.17 -0.29 -0.02 0.00 0.00 0.00 0.00 60.65 60.52 2fa3 s ILE 165 Cb -0.11 -0.71 -0.02 0.00 0.01 0.00 0.00 42.46 41.63 2fa3 s ILE 165 CO 0.07 0.26 -0.08 0.00 0.00 0.00 0.00 174.94 175.19 2fa3 s ALA 166 N 0.58 2.85 -0.11 9.38 0.00 -0.38 0.37 121.76 134.46 2fa3 s ALA 166 Ca -0.09 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.04 2fa3 s ALA 166 Cb -0.13 -1.38 0.01 0.00 0.00 0.00 0.00 23.12 21.62 2fa3 s ALA 166 CO 0.01 0.28 -0.21 -1.64 0.00 0.00 0.00 175.76 174.20 2fa3 s MET 167 N 0.20 2.74 -0.15 0.00 -1.94 -0.11 -1.27 119.30 118.77 2fa3 s MET 167 Ca -0.05 -0.77 -0.15 0.00 -1.71 0.00 0.00 55.69 53.01 2fa3 s MET 167 Cb -0.14 -2.15 -0.04 0.00 2.01 0.00 0.00 34.83 34.50 2fa3 s MET 167 CO 0.04 0.08 0.36 -1.17 -0.01 0.00 0.00 175.02 174.32 2fa3 s LEU 168 N 0.58 4.24 -0.03 -0.03 2.96 -0.06 -0.72 118.68 125.63 2fa3 s LEU 168 Ca -0.14 0.60 0.07 0.00 -0.22 0.00 0.00 54.13 54.44 2fa3 s LEU 168 Cb -0.17 -2.49 -0.02 0.00 0.50 0.00 0.00 46.19 44.02 2fa3 s LEU 168 CO 0.04 0.05 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.25 2fa3 s ILE 169 N 0.61 1.95 0.00 6.68 -1.09 0.11 0.95 121.20 130.41 2fa3 s ILE 169 Ca 0.20 -1.04 0.00 0.00 -2.23 0.00 0.00 60.65 57.58 2fa3 s ILE 169 Cb -0.14 -1.63 0.00 0.00 -1.58 0.00 0.00 42.46 39.11 2fa3 s ILE 169 CO 0.06 0.55 0.00 0.61 -1.23 0.00 0.00 174.94 174.93 2fa3 n GLY 170 N 2.63 -0.21 3.91 6.18 0.00 -0.88 -1.18 105.19 115.65 2fa3 n GLY 170 Ca -0.16 -0.95 -0.27 0.00 0.00 0.00 0.00 46.02 44.64 2fa3 n GLY 170 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fa3 s PRO 171 N -2.00 3.10 -0.96 1.61 0.04 -1.26 -2.22 135.00 133.31 2fa3 s PRO 171 Ca 0.00 0.14 -0.00 0.00 0.04 0.00 0.00 61.00 61.18 2fa3 s PRO 171 Cb 0.00 -2.26 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 2fa3 s PRO 171 CO 0.00 -0.61 0.80 -0.25 0.04 0.00 0.00 177.00 176.98 2fa3 n ASP 172 N -2.56 -2.25 -4.89 6.66 8.00 -0.22 -4.89 116.55 116.40 2fa3 n ASP 172 Ca 0.04 -0.50 -0.29 0.00 0.71 0.00 0.00 54.79 54.74 2fa3 n ASP 172 Cb 0.57 -4.23 -0.03 0.00 -0.02 0.00 0.00 41.12 37.40 2fa3 n ASP 172 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fa3 s ALA 173 N -3.29 3.55 -0.29 2.24 0.00 -0.46 -4.98 121.76 118.53 2fa3 s ALA 173 Ca 0.02 -0.44 0.28 0.00 0.00 0.00 0.00 51.96 51.82 2fa3 s ALA 173 Cb -0.00 -2.41 0.92 0.00 0.00 0.00 0.00 23.12 21.62 2fa3 s ALA 173 CO 0.59 0.22 1.80 -1.00 0.00 0.00 0.00 175.76 177.36 2fa3 h PRO 174 N 1.69 0.00 -3.60 0.00 0.13 -1.73 -3.40 132.00 125.09 2fa3 h PRO 174 Ca -0.47 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.03 2fa3 h PRO 174 Cb 1.19 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.91 2fa3 h PRO 174 CO 0.66 0.00 -0.71 0.42 -0.23 0.00 0.00 178.00 178.14 2fa3 s ILE 175 N -3.39 1.81 -0.19 -3.56 1.01 -1.24 -1.18 121.20 114.47 2fa3 s ILE 175 Ca 0.05 -2.48 -0.12 0.00 0.00 0.00 0.00 60.65 58.10 2fa3 s ILE 175 Cb 0.08 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.21 2fa3 s ILE 175 CO 0.56 -0.76 0.21 -0.69 0.00 0.00 0.00 174.94 174.27 2fa3 s VAL 176 N 0.56 5.35 0.15 2.92 1.01 -0.71 -0.75 120.40 128.93 2fa3 s VAL 176 Ca 0.14 0.35 -0.31 0.00 0.00 0.00 0.00 61.98 62.17 2fa3 s VAL 176 Cb -0.22 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 2fa3 s VAL 176 CO -0.07 0.39 1.32 -0.36 0.00 0.00 0.00 175.10 176.38 2fa3 s PHE 177 N 0.59 3.29 -1.00 5.22 0.40 -0.96 -0.95 117.98 124.56 2fa3 s PHE 177 Ca 0.12 1.14 -0.21 0.00 -0.60 0.00 0.00 56.93 57.38 2fa3 s PHE 177 Cb -0.12 -3.59 0.09 0.00 0.51 0.00 0.00 43.02 39.90 2fa3 s PHE 177 CO 0.02 -1.94 1.33 -1.21 0.70 0.00 0.00 175.22 174.12 2fa3 s GLU 178 N 0.51 3.63 0.30 0.44 2.02 -0.53 -4.89 118.70 120.18 2fa3 s GLU 178 Ca 0.60 -1.46 0.02 0.00 0.02 0.00 0.00 54.97 54.15 2fa3 s GLU 178 Cb -0.35 -5.18 0.73 0.00 0.10 0.00 0.00 34.13 29.43 2fa3 s GLU 178 CO 0.34 -2.02 1.60 0.77 0.02 0.00 0.00 175.26 175.96 2fa3 h SER 179 N 9.24 -0.28 0.40 -0.19 0.02 -1.92 0.15 113.55 120.97 2fa3 h SER 179 Ca 0.20 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 2fa3 h SER 179 Cb 1.01 0.39 0.00 0.00 0.14 0.00 0.00 62.40 63.94 2fa3 h SER 179 CO 1.30 -0.28 -0.86 0.29 -1.14 0.00 0.00 176.83 176.14 2fa3 n LYS 180 N -5.38 0.16 -2.83 3.45 4.76 -1.26 -4.78 118.16 112.28 2fa3 n LYS 180 Ca 0.22 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.23 2fa3 n LYS 180 Cb 0.73 -1.56 -0.03 0.00 -1.84 0.00 0.00 35.03 32.34 2fa3 n LYS 180 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2fa3 s LEU 181 N -3.54 4.59 -0.30 -0.35 0.20 0.53 -4.90 118.68 114.91 2fa3 s LEU 181 Ca 0.06 -1.76 -0.36 0.00 0.69 0.00 0.00 54.13 52.76 2fa3 s LEU 181 Cb 0.15 -2.44 0.17 0.00 -0.43 0.00 0.00 46.19 43.64 2fa3 s LEU 181 CO 0.78 -1.22 1.39 0.00 -0.29 0.00 0.00 176.35 177.01 2fa3 s ARG 182 N 3.42 0.01 -0.07 1.98 1.70 -1.26 -2.73 118.95 122.00 2fa3 s ARG 182 Ca 0.35 -0.00 -0.06 0.00 -0.47 0.00 0.00 55.73 55.55 2fa3 s ARG 182 Cb -0.05 0.01 0.02 0.00 -0.57 0.00 0.00 34.95 34.36 2fa3 s ARG 182 CO -0.07 -0.00 0.17 0.20 -1.08 0.00 0.00 175.30 174.52 2fa3 s GLY 183 N -1.74 -0.12 0.21 3.88 0.00 -0.64 -4.47 107.32 104.45 2fa3 s GLY 183 Ca 0.11 0.53 0.10 0.00 0.00 0.00 0.00 44.72 45.46 2fa3 s GLY 183 CO -0.04 0.52 -0.09 -0.56 0.00 0.00 0.00 173.10 172.93 2fa3 s SER 184 N 0.27 4.20 -0.04 1.64 0.01 -1.26 -0.82 113.70 117.70 2fa3 s SER 184 Ca -0.01 -0.66 0.01 0.00 1.31 0.00 0.00 55.95 56.60 2fa3 s SER 184 Cb -0.03 -0.68 0.02 0.00 0.21 0.00 0.00 66.02 65.54 2fa3 s SER 184 CO -0.01 0.07 -0.06 -2.28 0.41 0.00 0.00 173.24 171.37 2fa3 s HIS 185 N -1.94 0.84 0.01 2.43 2.46 -0.76 -4.65 115.29 113.68 2fa3 s HIS 185 Ca 0.27 -0.24 0.03 0.00 0.47 0.00 0.00 55.06 55.59 2fa3 s HIS 185 Cb -0.08 -0.69 -0.01 0.00 -0.13 0.00 0.00 32.58 31.67 2fa3 s HIS 185 CO 0.16 -0.17 -0.10 -1.64 -2.47 0.00 0.00 174.74 170.52 2fa3 s MET 186 N 0.69 0.75 0.25 2.88 -1.94 -1.26 -2.02 119.30 118.65 2fa3 s MET 186 Ca -0.10 -0.49 -0.16 0.00 -1.71 0.00 0.00 55.69 53.23 2fa3 s MET 186 Cb -0.13 -0.71 0.01 0.00 2.01 0.00 0.00 34.83 36.01 2fa3 s MET 186 CO 0.01 0.18 0.56 0.00 -0.01 0.00 0.00 175.02 175.76 2fa3 s ALA 187 N -0.53 -0.63 -0.44 3.03 0.00 -0.60 -5.03 121.76 117.57 2fa3 s ALA 187 Ca 0.01 -0.63 -0.09 0.00 0.00 0.00 0.00 51.96 51.25 2fa3 s ALA 187 Cb -0.05 0.97 0.10 0.00 0.00 0.00 0.00 23.12 24.14 2fa3 s ALA 187 CO 0.00 -0.91 0.30 -1.58 0.00 0.00 0.00 175.76 173.58 2fa3 s HIS 188 N -3.97 3.38 0.19 0.00 2.46 -1.26 -3.91 115.29 112.18 2fa3 s HIS 188 Ca 0.17 -1.67 0.01 0.00 0.47 0.00 0.00 55.06 54.04 2fa3 s HIS 188 Cb -0.02 -3.20 -0.05 0.00 -0.13 0.00 0.00 32.58 29.18 2fa3 s HIS 188 CO 0.07 -0.91 0.05 0.14 -2.47 0.00 0.00 174.74 171.62 2fa3 s VAL 189 N 1.40 0.49 -0.43 0.89 -7.23 -0.78 -5.05 120.40 109.70 2fa3 s VAL 189 Ca 0.04 -1.98 0.07 0.00 -1.81 0.00 0.00 61.98 58.31 2fa3 s VAL 189 Cb -0.24 -2.30 0.42 0.00 0.56 0.00 0.00 36.38 34.81 2fa3 s VAL 189 CO 0.01 -0.29 1.06 -1.22 -0.31 0.00 0.00 175.10 174.35 2fa3 n TYR 190 N -0.29 3.06 0.08 2.82 0.53 -1.26 -4.26 117.16 117.84 2fa3 n TYR 190 Ca -0.04 -3.16 -0.20 0.00 -1.02 0.00 0.00 57.90 53.48 2fa3 n TYR 190 Cb 0.64 -0.17 -0.11 0.00 -1.03 0.00 0.00 39.34 38.67 2fa3 n TYR 190 CO 0.00 0.00 0.00 0.38 -1.02 0.00 0.00 176.86 176.22 2fa3 h ASP 191 N 2.69 0.82 -2.90 7.72 -0.00 -1.92 -3.43 116.42 119.39 2fa3 h ASP 191 Ca 0.22 -0.72 -0.06 0.00 -0.00 0.00 0.00 57.03 56.47 2fa3 h ASP 191 Cb 0.92 -0.26 -0.25 0.00 -0.00 0.00 0.00 39.33 39.75 2fa3 h ASP 191 CO 0.78 1.53 -0.21 0.12 -0.00 0.00 0.00 179.24 181.46 2fa3 s PHE 192 N -3.09 -0.84 0.31 4.15 5.99 -1.26 -1.83 117.98 121.41 2fa3 s PHE 192 Ca -0.09 1.66 -0.17 0.00 0.00 0.00 0.00 56.93 58.34 2fa3 s PHE 192 Cb 0.06 0.43 0.03 0.00 0.00 0.00 0.00 43.02 43.54 2fa3 s PHE 192 CO 0.92 -0.45 0.69 1.52 -0.00 0.00 0.00 175.22 177.90 2fa3 s TYR 193 N 1.85 0.07 -0.53 10.12 -0.85 -0.73 -4.11 117.35 123.18 2fa3 s TYR 193 Ca -0.08 -0.57 0.05 0.00 -0.52 0.00 0.00 57.07 55.95 2fa3 s TYR 193 Cb -0.09 0.63 0.20 0.00 0.38 0.00 0.00 41.96 43.08 2fa3 s TYR 193 CO -0.15 -1.31 0.48 1.63 -1.52 0.00 0.00 175.55 174.68 2fa3 n LYS 194 N -0.48 1.10 0.12 -3.49 5.02 -1.26 -0.26 118.16 118.91 2fa3 n LYS 194 Ca -0.05 -3.78 0.12 0.00 -2.02 0.00 0.00 58.31 52.58 2fa3 n LYS 194 Cb 0.60 -1.85 0.16 0.00 -0.02 0.00 0.00 35.03 33.91 2fa3 n LYS 194 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2fa3 h PRO 195 N 5.06 0.00 -6.22 1.97 0.13 -1.96 -3.43 132.00 127.55 2fa3 h PRO 195 Ca 0.19 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.75 2fa3 h PRO 195 Cb 0.82 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.86 2fa3 h PRO 195 CO 0.56 0.00 1.16 -0.80 -0.23 0.00 0.00 178.00 178.69 2fa3 s ASN 196 N -5.16 6.27 0.30 1.44 -0.87 -1.26 -4.90 114.94 110.76 2fa3 s ASN 196 Ca 0.05 -0.80 -0.00 0.00 -1.57 0.00 0.00 52.86 50.54 2fa3 s ASN 196 Cb 0.10 -2.55 0.50 0.00 -0.02 0.00 0.00 41.25 39.28 2fa3 s ASN 196 CO 0.71 -1.71 1.92 -0.07 -2.57 0.00 0.00 177.10 175.38 2fa3 h LEU 197 N 12.83 0.92 0.00 0.60 3.38 -1.98 -2.20 115.31 128.86 2fa3 h LEU 197 Ca -0.13 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2fa3 h LEU 197 Cb 1.04 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2fa3 h LEU 197 CO 1.32 0.61 -0.77 0.00 0.09 0.00 0.00 178.44 179.68 2fa3 h ALA 198 N 1.50 0.58 -2.45 1.53 0.00 -1.97 -3.47 119.26 114.98 2fa3 h ALA 198 Ca 0.37 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.77 2fa3 h ALA 198 Cb 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2fa3 h ALA 198 CO -0.13 0.00 0.08 0.45 0.00 0.00 0.00 179.25 179.65 2fa3 s SER 199 N -5.10 6.91 0.00 0.00 0.15 -0.83 -4.85 113.70 109.98 2fa3 s SER 199 Ca 0.02 1.31 0.28 0.00 0.70 0.00 0.00 55.95 58.27 2fa3 s SER 199 Cb 0.10 -2.38 1.25 0.00 -1.71 0.00 0.00 66.02 63.28 2fa3 s SER 199 CO 0.76 -0.06 1.92 1.21 1.20 0.00 0.00 173.24 178.27 2fa3 n GLU 200 N 0.27 0.08 -4.30 5.44 2.13 -1.26 -4.91 120.64 118.09 2fa3 n GLU 200 Ca -0.00 0.02 -0.35 0.00 0.66 0.00 0.00 57.16 57.48 2fa3 n GLU 200 Cb 0.52 -1.50 -0.09 0.00 0.27 0.00 0.00 31.44 30.64 2fa3 n GLU 200 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2fa3 s TYR 201 N -2.92 3.23 0.55 4.31 4.12 -1.26 -4.78 117.35 120.60 2fa3 s TYR 201 Ca 0.16 0.24 -0.16 0.00 0.02 0.00 0.00 57.07 57.33 2fa3 s TYR 201 Cb 0.19 -1.81 -0.06 0.00 -1.52 0.00 0.00 41.96 38.75 2fa3 s TYR 201 CO 0.50 0.50 1.01 -1.25 0.02 0.00 0.00 175.55 176.34 2fa3 s PRO 202 N -0.88 3.68 -0.14 -1.71 0.04 -1.26 -4.83 135.00 129.90 2fa3 s PRO 202 Ca 0.13 1.02 -0.25 0.00 0.04 0.00 0.00 61.00 61.95 2fa3 s PRO 202 Cb -0.11 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 2fa3 s PRO 202 CO 0.03 -0.50 0.79 0.08 0.04 0.00 0.00 177.00 177.44 2fa3 s VAL 203 N -2.63 4.93 -0.19 -0.36 1.01 0.64 -4.94 120.40 118.87 2fa3 s VAL 203 Ca 0.60 1.56 -0.02 0.00 0.00 0.00 0.00 61.98 64.13 2fa3 s VAL 203 Cb -0.12 -4.10 0.05 0.00 0.00 0.00 0.00 36.38 32.21 2fa3 s VAL 203 CO 0.36 0.09 0.00 -0.69 0.00 0.00 0.00 175.10 174.86 2fa3 s VAL 204 N 1.78 0.82 0.34 2.92 1.01 -1.26 -1.78 120.40 124.23 2fa3 s VAL 204 Ca 0.38 -0.67 -0.26 0.00 0.00 0.00 0.00 61.98 61.43 2fa3 s VAL 204 Cb -0.17 -1.20 -0.10 0.00 0.00 0.00 0.00 36.38 34.91 2fa3 s VAL 204 CO 0.14 -0.10 0.96 -0.62 0.00 0.00 0.00 175.10 175.48 2fa3 s ASP 205 N 1.73 7.25 -0.04 3.32 -1.08 -0.76 -5.02 116.67 122.07 2fa3 s ASP 205 Ca -0.01 1.85 0.11 0.00 -0.52 0.00 0.00 52.55 53.98 2fa3 s ASP 205 Cb -0.17 -2.58 -0.16 0.00 -1.46 0.00 0.00 42.92 38.56 2fa3 s ASP 205 CO -0.07 -0.13 0.18 0.61 0.52 0.00 0.00 175.17 176.27 2fa3 n GLY 206 N 0.46 -0.51 0.03 2.66 0.00 -1.26 -2.58 105.19 103.99 2fa3 n GLY 206 Ca 0.03 -0.24 0.16 0.00 0.00 0.00 0.00 46.02 45.97 2fa3 n GLY 206 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2fa3 n LYS 207 N -2.04 0.89 0.00 1.61 2.85 -1.26 -3.29 118.16 116.92 2fa3 n LYS 207 Ca -0.07 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.13 2fa3 n LYS 207 Cb 0.46 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.34 2fa3 n LYS 207 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2fa3 n LEU 208 N -1.00 1.90 0.00 -5.58 4.77 -1.26 -4.66 117.00 111.17 2fa3 n LEU 208 Ca 0.21 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 2fa3 n LEU 208 Cb 0.16 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2fa3 n LEU 208 CO 0.19 0.30 0.23 -1.54 -1.33 0.00 0.00 177.39 175.24 2fa3 n SER 209 N -2.42 0.00 0.04 -1.43 3.41 -1.07 -0.14 113.62 112.02 2fa3 n SER 209 Ca 0.00 0.45 -0.03 0.00 -0.26 0.00 0.00 58.87 59.03 2fa3 n SER 209 Cb 0.40 -0.18 0.20 0.00 -0.26 0.00 0.00 64.21 64.37 2fa3 n SER 209 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2fa3 h GLN 210 N 0.00 0.41 -0.12 4.33 4.15 -1.86 -2.73 115.11 119.28 2fa3 h GLN 210 Ca 0.00 -0.17 0.05 0.00 0.77 0.00 0.00 58.65 59.29 2fa3 h GLN 210 Cb 0.00 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.61 2fa3 h GLN 210 CO 0.00 0.69 -0.34 1.15 -1.93 0.00 0.00 178.83 178.40 2fa3 h THR 211 N 0.35 0.25 -0.28 2.39 2.02 -1.05 -2.18 112.91 114.40 2fa3 h THR 211 Ca 0.04 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.17 2fa3 h THR 211 Cb 0.75 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2fa3 h THR 211 CO 0.06 0.00 -0.06 0.00 0.37 0.00 0.00 175.52 175.89 2fa3 h TYR 213 N 0.43 1.10 0.00 0.00 5.03 -1.24 -1.60 116.97 120.69 2fa3 h TYR 213 Ca 0.09 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.35 2fa3 h TYR 213 Cb 0.38 -0.36 -0.01 0.00 1.55 0.00 0.00 36.73 38.29 2fa3 h TYR 213 CO 0.01 0.73 -0.32 -0.07 -1.32 0.00 0.00 178.16 177.19 2fa3 h LEU 214 N 1.16 0.00 -0.70 2.82 4.07 -0.45 -0.54 115.31 121.66 2fa3 h LEU 214 Ca 0.30 -0.56 0.11 0.00 0.08 0.00 0.00 57.88 57.82 2fa3 h LEU 214 Cb -0.05 0.00 -0.12 0.00 1.08 0.00 0.00 40.66 41.57 2fa3 h LEU 214 CO -0.06 0.96 -0.26 0.23 -1.08 0.00 0.00 178.44 178.24 2fa3 n MET 215 N -4.61 -0.15 -0.10 1.13 2.81 0.20 -0.09 117.12 116.31 2fa3 n MET 215 Ca -0.12 1.08 -0.13 0.00 -1.81 0.00 0.00 57.70 56.72 2fa3 n MET 215 Cb 0.39 -1.61 -0.03 0.00 -0.71 0.00 0.00 33.22 31.26 2fa3 n MET 215 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2fa3 h ALA 216 N 1.04 0.48 -0.23 3.04 0.00 -1.26 -2.82 119.26 119.51 2fa3 h ALA 216 Ca 0.26 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2fa3 h ALA 216 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2fa3 h ALA 216 CO -0.70 0.53 0.12 1.25 0.00 0.00 0.00 179.25 180.45 2fa3 h LEU 217 N 0.57 0.29 -0.46 0.00 5.85 0.04 -0.10 115.31 121.50 2fa3 h LEU 217 Ca 0.05 -0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.77 2fa3 h LEU 217 Cb 0.91 -0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.77 2fa3 h LEU 217 CO 0.08 0.30 -0.13 0.44 -0.34 0.00 0.00 178.44 178.80 2fa3 h ASP 218 N 0.26 -0.46 -0.16 1.25 3.32 -0.47 0.47 116.42 120.63 2fa3 h ASP 218 Ca 0.08 0.14 -0.08 0.00 0.02 0.00 0.00 57.03 57.19 2fa3 h ASP 218 Cb 0.08 0.30 -0.00 0.00 0.22 0.00 0.00 39.33 39.92 2fa3 h ASP 218 CO -0.01 -0.16 -0.23 -1.28 -1.72 0.00 0.00 179.24 175.84 2fa3 h SER 219 N -0.01 0.47 -0.55 6.45 0.87 -1.24 -0.84 113.55 118.70 2fa3 h SER 219 Ca 0.22 -0.52 0.01 0.00 -1.23 0.00 0.00 61.79 60.27 2fa3 h SER 219 Cb 0.35 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 2fa3 h SER 219 CO -0.49 0.90 0.36 0.00 -0.53 0.00 0.00 176.83 177.08 2fa3 h TYR 221 N 0.74 0.46 -0.57 0.00 3.20 -0.34 -1.79 116.97 118.67 2fa3 h TYR 221 Ca 0.20 -0.11 0.02 0.00 3.14 0.00 0.00 58.73 61.99 2fa3 h TYR 221 Cb -0.09 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 2fa3 h TYR 221 CO 0.00 0.67 0.38 0.87 -1.64 0.00 0.00 178.16 178.44 2fa3 h LYS 222 N 0.11 0.68 0.00 1.82 1.57 -1.13 -0.18 116.57 119.44 2fa3 h LYS 222 Ca 0.05 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2fa3 h LYS 222 Cb 0.54 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 2fa3 h LYS 222 CO 0.02 0.45 -0.69 0.45 -0.57 0.00 0.00 179.45 179.11 2fa3 h HIS 223 N 0.70 0.00 0.12 -1.35 3.86 -1.29 -1.68 115.15 115.51 2fa3 h HIS 223 Ca 0.22 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 59.14 2fa3 h HIS 223 Cb 0.03 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.53 2fa3 h HIS 223 CO -0.00 0.69 -1.25 1.25 0.86 0.00 0.00 177.93 179.48 2fa3 h LEU 224 N 0.00 0.84 -0.06 2.43 6.46 -0.62 -2.90 115.31 121.46 2fa3 h LEU 224 Ca -0.01 -0.78 0.04 0.00 -0.12 0.00 0.00 57.88 57.01 2fa3 h LEU 224 Cb 1.46 -0.26 -0.06 0.00 -0.73 0.00 0.00 40.66 41.07 2fa3 h LEU 224 CO 0.09 1.59 -0.40 0.00 -0.62 0.00 0.00 178.44 179.10 2fa3 h ASN 226 N -0.52 0.18 -0.78 0.00 2.35 -1.36 -0.73 115.58 114.73 2fa3 h ASN 226 Ca 0.06 0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 2fa3 h ASN 226 Cb 0.62 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.04 2fa3 h ASN 226 CO -0.34 0.10 0.38 0.11 -1.65 0.00 0.00 177.43 176.04 2fa3 h LYS 227 N 0.38 1.12 -0.56 0.81 1.79 -1.22 -2.16 116.57 116.73 2fa3 h LYS 227 Ca 0.31 -0.15 -0.01 0.00 -2.18 0.00 0.00 60.65 58.62 2fa3 h LYS 227 Cb 0.41 -0.21 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 2fa3 h LYS 227 CO -0.33 0.86 0.33 0.35 -1.08 0.00 0.00 179.45 179.57 2fa3 h PHE 228 N 1.12 0.75 -0.77 -1.35 3.57 0.24 -0.61 116.94 119.89 2fa3 h PHE 228 Ca 0.27 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 2fa3 h PHE 228 Cb 0.10 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.56 2fa3 h PHE 228 CO 0.01 0.53 0.44 1.49 -2.23 0.00 0.00 178.31 178.55 2fa3 h GLU 229 N 0.76 1.06 0.49 1.11 4.81 -0.78 0.34 114.58 122.37 2fa3 h GLU 229 Ca 0.20 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2fa3 h GLU 229 Cb 0.01 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 2fa3 h GLU 229 CO -0.04 0.77 -0.36 0.87 -0.73 0.00 0.00 179.01 179.52 2fa3 h LYS 230 N 1.05 -0.79 -0.38 1.92 1.57 -1.21 -2.09 116.57 116.64 2fa3 h LYS 230 Ca 0.27 0.05 0.02 0.00 -1.87 0.00 0.00 60.65 59.13 2fa3 h LYS 230 Cb 0.01 0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 2fa3 h LYS 230 CO -0.05 -0.53 0.21 -0.07 -0.57 0.00 0.00 179.45 178.44 2fa3 h LEU 231 N -0.82 0.32 -0.22 2.94 4.07 -0.67 -3.34 115.31 117.58 2fa3 h LEU 231 Ca -0.07 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.91 2fa3 h LEU 231 Cb 0.67 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.36 2fa3 h LEU 231 CO 0.03 0.23 -0.28 -0.62 -1.08 0.00 0.00 178.44 176.72 2fa3 n GLU 232 N -4.90 3.86 -0.71 1.13 1.02 0.12 -5.01 120.64 116.14 2fa3 n GLU 232 Ca 0.01 -0.17 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 2fa3 n GLU 232 Cb 0.08 -0.89 0.00 0.00 -0.02 0.00 0.00 31.44 30.61 2fa3 n GLU 232 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2fa3 n GLY 233 N 1.05 0.60 3.11 0.62 0.00 -0.79 -5.03 105.19 104.76 2fa3 n GLY 233 Ca 0.02 -0.36 -0.08 0.00 0.00 0.00 0.00 46.02 45.60 2fa3 n GLY 233 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fa3 s LYS 234 N -0.81 0.64 0.08 1.61 -2.85 -1.26 -5.03 119.74 112.13 2fa3 s LYS 234 Ca 0.00 -1.04 -0.31 0.00 -1.00 0.00 0.00 55.97 53.63 2fa3 s LYS 234 Cb 0.00 0.24 -0.09 0.00 -2.06 0.00 0.00 37.83 35.92 2fa3 s LYS 234 CO 0.00 -0.15 1.74 -1.21 0.10 0.00 0.00 175.35 175.83 2fa3 s GLU 235 N -3.51 4.17 0.18 1.78 2.02 -1.26 -3.49 118.70 118.59 2fa3 s GLU 235 Ca 0.03 2.45 -0.30 0.00 0.02 0.00 0.00 54.97 57.16 2fa3 s GLU 235 Cb 0.04 -3.65 -0.09 0.00 0.10 0.00 0.00 34.13 30.54 2fa3 s GLU 235 CO -0.09 -0.80 1.38 0.12 0.02 0.00 0.00 175.26 175.89 2fa3 s PHE 236 N 2.85 3.19 0.32 1.61 5.36 -1.26 -4.86 117.98 125.20 2fa3 s PHE 236 Ca 0.78 1.06 0.06 0.00 -0.96 0.00 0.00 56.93 57.87 2fa3 s PHE 236 Cb -0.42 -3.69 -0.02 0.00 -0.34 0.00 0.00 43.02 38.54 2fa3 s PHE 236 CO 0.34 -2.29 0.23 -1.13 -1.46 0.00 0.00 175.22 170.91 2fa3 n SER 237 N 3.06 -0.26 0.19 6.13 3.41 -1.26 -4.93 113.62 119.96 2fa3 n SER 237 Ca 0.08 -2.99 0.14 0.00 -0.26 0.00 0.00 58.87 55.84 2fa3 n SER 237 Cb 0.42 1.40 0.61 0.00 -0.26 0.00 0.00 64.21 66.38 2fa3 n SER 237 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 2fa3 h ILE 238 N 1.90 0.00 0.00 -1.33 6.09 -1.93 -0.74 117.51 121.50 2fa3 h ILE 238 Ca -0.23 -0.24 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 2fa3 h ILE 238 Cb 1.09 1.01 0.00 0.00 0.47 0.00 0.00 36.82 39.40 2fa3 h ILE 238 CO 0.34 0.00 0.00 0.59 -3.07 0.00 0.00 178.15 176.01 2fa3 n ASN 239 N -2.51 0.00 -1.08 2.19 3.02 -1.26 -3.98 115.26 111.64 2fa3 n ASN 239 Ca 0.01 0.34 0.08 0.00 -0.03 0.00 0.00 54.58 54.98 2fa3 n ASN 239 Cb 0.20 -0.44 0.24 0.00 -0.61 0.00 0.00 39.78 39.17 2fa3 n ASN 239 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2fa3 n ASP 240 N -1.44 3.13 -3.79 6.41 8.00 -0.28 -4.80 116.55 123.78 2fa3 n ASP 240 Ca 0.08 -2.13 -0.13 0.00 0.71 0.00 0.00 54.79 53.32 2fa3 n ASP 240 Cb 0.29 -0.41 -0.10 0.00 -0.02 0.00 0.00 41.12 40.87 2fa3 n ASP 240 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fa3 s ALA 241 N -1.49 -0.63 -0.47 2.24 0.00 -1.26 -4.95 121.76 115.21 2fa3 s ALA 241 Ca 0.36 0.48 0.23 0.00 0.00 0.00 0.00 51.96 53.03 2fa3 s ALA 241 Cb 0.21 -0.20 0.40 0.00 0.00 0.00 0.00 23.12 23.53 2fa3 s ALA 241 CO 0.21 -0.18 1.63 -0.44 0.00 0.00 0.00 175.76 176.99 2fa3 h ASP 242 N 4.95 0.00 -3.90 0.00 5.19 -1.24 -3.47 116.42 117.96 2fa3 h ASP 242 Ca -0.28 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.04 2fa3 h ASP 242 Cb 1.19 0.00 -0.23 0.00 0.18 0.00 0.00 39.33 40.47 2fa3 h ASP 242 CO 0.37 0.00 -0.10 -0.31 -3.12 0.00 0.00 179.24 176.08 2fa3 s TYR 243 N -3.20 -0.59 -0.15 4.55 1.51 -1.10 -4.41 117.35 113.96 2fa3 s TYR 243 Ca 0.07 1.42 0.01 0.00 -1.01 0.00 0.00 57.07 57.57 2fa3 s TYR 243 Cb 0.06 0.21 0.00 0.00 -0.11 0.00 0.00 41.96 42.12 2fa3 s TYR 243 CO 0.66 -0.28 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.58 2fa3 s PHE 244 N 0.32 2.74 -0.12 2.71 0.40 -0.92 -0.98 117.98 122.13 2fa3 s PHE 244 Ca -0.00 -1.14 0.03 0.00 -0.60 0.00 0.00 56.93 55.22 2fa3 s PHE 244 Cb -0.04 -1.86 -0.00 0.00 0.51 0.00 0.00 43.02 41.63 2fa3 s PHE 244 CO 0.00 -0.51 -0.21 0.08 0.70 0.00 0.00 175.22 175.28 2fa3 s VAL 245 N 0.79 2.29 0.23 -0.44 1.01 -0.46 -4.55 120.40 119.27 2fa3 s VAL 245 Ca -0.06 -0.93 0.11 0.00 0.00 0.00 0.00 61.98 61.10 2fa3 s VAL 245 Cb -0.15 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 2fa3 s VAL 245 CO -0.00 0.55 -0.20 -0.36 0.00 0.00 0.00 175.10 175.08 2fa3 s PHE 246 N 0.45 2.34 0.22 5.22 0.40 -1.26 -0.55 117.98 124.79 2fa3 s PHE 246 Ca -0.15 -0.33 -0.32 0.00 -0.60 0.00 0.00 56.93 55.53 2fa3 s PHE 246 Cb -0.17 -1.09 -0.14 0.00 0.51 0.00 0.00 43.02 42.12 2fa3 s PHE 246 CO 0.06 0.59 1.32 1.58 0.70 0.00 0.00 175.22 179.48 2fa3 n HIS 247 N -0.15 1.87 -3.24 0.36 -0.00 -0.28 -4.45 115.22 109.32 2fa3 n HIS 247 Ca -0.09 0.52 -0.26 0.00 -0.00 0.00 0.00 57.72 57.88 2fa3 n HIS 247 Cb 0.58 -2.40 -0.06 0.00 -0.00 0.00 0.00 29.99 28.10 2fa3 n HIS 247 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2fa3 n SER 248 N 2.10 3.34 -0.19 0.26 7.64 -1.26 -4.74 113.62 120.77 2fa3 n SER 248 Ca 0.13 -3.40 -0.05 0.00 1.01 0.00 0.00 58.87 56.56 2fa3 n SER 248 Cb 0.29 -0.63 0.05 0.00 -1.01 0.00 0.00 64.21 62.91 2fa3 n SER 248 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2fa3 h PRO 249 N 3.73 0.65 -2.67 1.43 0.13 -1.93 -3.40 132.00 129.93 2fa3 h PRO 249 Ca 0.16 -0.04 -0.09 0.00 -0.87 0.00 0.00 66.00 65.16 2fa3 h PRO 249 Cb 0.66 -0.15 -0.19 0.00 0.13 0.00 0.00 31.00 31.46 2fa3 h PRO 249 CO 0.76 0.43 -0.06 1.52 -0.23 0.00 0.00 178.00 180.42 2fa3 s TYR 250 N -6.13 -0.37 0.50 1.56 1.13 -1.26 -3.09 117.35 109.68 2fa3 s TYR 250 Ca -0.13 0.56 0.14 0.00 -1.41 0.00 0.00 57.07 56.23 2fa3 s TYR 250 Cb 0.14 0.24 1.19 0.00 -1.10 0.00 0.00 41.96 42.43 2fa3 s TYR 250 CO 0.75 -0.52 2.13 -0.97 -2.51 0.00 0.00 175.55 174.43 2fa3 h ASN 251 N 3.32 0.09 -0.95 -0.18 -0.73 -1.76 -2.51 115.58 112.86 2fa3 h ASN 251 Ca -0.29 -0.00 0.09 0.00 1.87 0.00 0.00 56.30 57.96 2fa3 h ASN 251 Cb 1.17 -0.02 -0.07 0.00 0.27 0.00 0.00 38.32 39.67 2fa3 h ASN 251 CO 0.40 0.07 0.59 0.50 -0.37 0.00 0.00 177.43 178.63 2fa3 h LYS 252 N 0.11 0.99 -0.16 6.67 1.63 -1.14 -1.74 116.57 122.92 2fa3 h LYS 252 Ca 0.03 -0.06 -0.17 0.00 -0.85 0.00 0.00 60.65 59.60 2fa3 h LYS 252 Cb -0.01 -0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 31.39 2fa3 h LYS 252 CO -0.01 0.65 -0.60 1.25 -3.45 0.00 0.00 179.45 177.30 2fa3 h LEU 253 N 1.02 0.62 -0.73 5.20 5.85 -1.72 -1.52 115.31 124.02 2fa3 h LEU 253 Ca 0.44 -0.35 0.12 0.00 0.84 0.00 0.00 57.88 58.92 2fa3 h LEU 253 Cb 0.31 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.08 2fa3 h LEU 253 CO -0.22 1.07 0.33 0.58 -0.34 0.00 0.00 178.44 179.87 2fa3 h VAL 254 N 0.41 0.76 0.05 1.05 2.07 -1.36 0.15 116.25 119.38 2fa3 h VAL 254 Ca -0.00 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2fa3 h VAL 254 Cb 1.16 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2fa3 h VAL 254 CO 0.11 0.10 -0.02 1.56 0.02 0.00 0.00 177.57 179.34 2fa3 h GLN 255 N 0.53 -0.06 -0.67 1.57 4.20 -0.92 -2.67 115.11 117.10 2fa3 h GLN 255 Ca 0.38 0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.13 2fa3 h GLN 255 Cb 0.49 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.24 2fa3 h GLN 255 CO -0.33 0.10 0.41 0.87 -0.67 0.00 0.00 178.83 179.22 2fa3 h LYS 256 N -0.21 0.78 -0.75 1.46 1.57 -1.03 -2.27 116.57 116.13 2fa3 h LYS 256 Ca -0.01 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2fa3 h LYS 256 Cb 0.19 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 2fa3 h LYS 256 CO 0.01 0.52 0.39 0.77 -0.57 0.00 0.00 179.45 180.57 2fa3 h SER 257 N 0.80 0.94 0.07 0.86 0.02 -0.53 -1.07 113.55 114.65 2fa3 h SER 257 Ca 0.27 -0.09 -0.21 0.00 -0.84 0.00 0.00 61.79 60.92 2fa3 h SER 257 Cb 0.03 -0.24 0.02 0.00 0.14 0.00 0.00 62.40 62.35 2fa3 h SER 257 CO -0.11 0.77 -0.86 0.15 -1.14 0.00 0.00 176.83 175.63 2fa3 h PHE 258 N 1.05 0.74 -1.00 3.45 3.04 -1.32 -2.46 116.94 120.45 2fa3 h PHE 258 Ca 0.26 -0.45 0.32 0.00 3.98 0.00 0.00 57.97 62.08 2fa3 h PHE 258 Cb 0.06 -0.07 -0.15 0.00 2.56 0.00 0.00 35.95 38.35 2fa3 h PHE 258 CO 0.01 1.30 0.55 0.00 -2.02 0.00 0.00 178.31 178.15 2fa3 h ALA 259 N 0.26 1.92 -0.14 2.41 0.00 -1.15 -1.36 119.26 121.20 2fa3 h ALA 259 Ca -0.13 0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 2fa3 h ALA 259 Cb 1.59 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 2fa3 h ALA 259 CO 0.17 -0.57 -0.53 -0.09 0.00 0.00 0.00 179.25 178.22 2fa3 h ARG 260 N 0.32 0.40 -0.18 0.00 9.65 -0.73 -1.31 114.38 122.53 2fa3 h ARG 260 Ca 0.73 -0.25 0.01 0.00 -1.10 0.00 0.00 59.98 59.37 2fa3 h ARG 260 Cb 1.65 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 30.24 2fa3 h ARG 260 CO -0.61 0.84 0.09 -0.07 2.80 0.00 0.00 179.97 183.02 2fa3 h LEU 261 N 0.31 0.14 0.12 3.80 3.38 -0.98 0.98 115.31 123.07 2fa3 h LEU 261 Ca 0.01 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2fa3 h LEU 261 Cb 1.04 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.74 2fa3 h LEU 261 CO 0.09 0.11 -0.23 0.25 0.09 0.00 0.00 178.44 178.75 2fa3 h LEU 262 N 0.19 -0.64 -1.28 1.67 7.12 -0.96 0.46 115.31 121.87 2fa3 h LEU 262 Ca 0.07 0.07 0.29 0.00 0.13 0.00 0.00 57.88 58.44 2fa3 h LEU 262 Cb 0.01 0.24 -0.11 0.00 -0.53 0.00 0.00 40.66 40.28 2fa3 h LEU 262 CO -0.05 -0.32 0.67 0.22 -0.13 0.00 0.00 178.44 178.83 2fa3 h TYR 263 N -0.43 0.72 -0.16 1.25 3.20 -1.13 -0.30 116.97 120.13 2fa3 h TYR 263 Ca 0.03 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.79 2fa3 h TYR 263 Cb 0.45 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2fa3 h TYR 263 CO -0.21 0.02 -0.49 -0.91 -1.64 0.00 0.00 178.16 174.93 2fa3 h ASN 264 N 0.39 0.45 -0.08 -2.11 2.35 0.72 -2.81 115.58 114.48 2fa3 h ASN 264 Ca 0.64 -0.22 -0.04 0.00 -0.55 0.00 0.00 56.30 56.13 2fa3 h ASN 264 Cb 1.59 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.82 2fa3 h ASN 264 CO -0.36 0.86 -0.04 0.44 -1.65 0.00 0.00 177.43 176.68 2fa3 h ASP 265 N 0.33 0.28 0.00 5.81 5.19 0.78 -2.99 116.42 125.83 2fa3 h ASP 265 Ca 0.02 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 2fa3 h ASP 265 Cb 0.98 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.42 2fa3 h ASP 265 CO 0.08 0.37 0.00 0.33 -3.12 0.00 0.00 179.24 176.90 2fa3 n PHE 266 N -4.33 0.00 0.00 4.55 -0.00 -0.86 -1.89 117.46 114.94 2fa3 n PHE 266 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2fa3 n PHE 266 Cb 0.22 -0.04 0.00 0.00 -0.00 0.00 0.00 39.48 39.66 2fa3 n PHE 266 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2fa3 n LEU 267 N -0.64 0.00 -0.66 -2.13 4.77 -1.08 0.27 117.00 117.53 2fa3 n LEU 267 Ca 0.00 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.05 2fa3 n LEU 267 Cb 0.00 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.21 2fa3 n LEU 267 CO 0.00 0.00 0.56 0.54 -1.33 0.00 0.00 177.39 177.16 2fa3 n ARG 268 N -2.35 1.79 -1.61 3.23 1.74 -1.14 -5.00 116.66 113.32 2fa3 n ARG 268 Ca 0.00 -1.71 -0.20 0.00 -0.77 0.00 0.00 57.85 55.16 2fa3 n ARG 268 Cb 0.00 -1.30 -0.08 0.00 -1.02 0.00 0.00 32.46 30.06 2fa3 n ARG 268 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2fa3 n ASN 269 N 0.78 -5.31 -3.58 0.55 5.15 0.77 -4.97 115.26 108.64 2fa3 n ASN 269 Ca 0.11 0.48 -0.30 0.00 -0.60 0.00 0.00 54.58 54.27 2fa3 n ASN 269 Cb 0.40 -4.69 0.27 0.00 -0.53 0.00 0.00 39.78 35.23 2fa3 n ASN 269 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2fa3 s ALA 270 N -2.71 -0.32 -1.00 5.20 0.00 -0.79 -4.88 121.76 117.25 2fa3 s ALA 270 Ca 0.00 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 2fa3 s ALA 270 Cb 0.00 -2.93 0.27 0.00 0.00 0.00 0.00 23.12 20.46 2fa3 s ALA 270 CO 0.00 -4.27 2.04 -1.13 0.00 0.00 0.00 175.76 172.40 2fa3 n SER 271 N -5.35 7.46 0.00 0.00 3.41 -1.26 -3.06 113.62 114.81 2fa3 n SER 271 Ca 0.12 -3.59 0.00 0.00 -0.26 0.00 0.00 58.87 55.14 2fa3 n SER 271 Cb 0.60 -1.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2fa3 n SER 271 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fa3 n SER 272 N 0.21 0.00 -4.28 4.04 3.41 -1.26 -4.89 113.62 110.85 2fa3 n SER 272 Ca 0.51 -0.48 -0.45 0.00 -0.26 0.00 0.00 58.87 58.20 2fa3 n SER 272 Cb 0.27 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.17 2fa3 n SER 272 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2fa3 s ILE 273 N 0.00 5.02 1.19 -1.33 -1.09 -1.17 -5.03 121.20 118.79 2fa3 s ILE 273 Ca 0.00 -1.81 -0.20 0.00 -2.23 0.00 0.00 60.65 56.42 2fa3 s ILE 273 Cb 0.00 -4.21 0.29 0.00 -1.58 0.00 0.00 42.46 36.96 2fa3 s ILE 273 CO 0.00 -0.88 1.16 1.51 -1.23 0.00 0.00 174.94 175.50 2fa3 s ASP 274 N 3.01 1.06 0.24 3.58 3.84 -1.26 -4.79 116.67 122.35 2fa3 s ASP 274 Ca 0.07 0.45 -0.05 0.00 -0.00 0.00 0.00 52.55 53.02 2fa3 s ASP 274 Cb -0.25 -0.56 0.38 0.00 -1.38 0.00 0.00 42.92 41.11 2fa3 s ASP 274 CO -0.00 -4.02 1.81 -0.33 -0.00 0.00 0.00 175.17 172.63 2fa3 h GLU 275 N -2.52 0.75 0.02 2.11 5.08 -2.00 -2.50 114.58 115.52 2fa3 h GLU 275 Ca -0.43 -0.05 -0.22 0.00 -1.00 0.00 0.00 59.36 57.66 2fa3 h GLU 275 Cb 1.27 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.32 2fa3 h GLU 275 CO 0.30 0.50 -1.05 0.00 -1.00 0.00 0.00 179.01 177.75 2fa3 h ALA 276 N 1.44 0.33 0.08 3.43 0.00 -1.99 -2.61 119.26 119.95 2fa3 h ALA 276 Ca 0.39 -0.93 -0.00 0.00 0.00 0.00 0.00 54.91 54.37 2fa3 h ALA 276 Cb 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2fa3 h ALA 276 CO -0.24 1.23 -0.04 0.00 0.00 0.00 0.00 179.25 180.20 2fa3 h ALA 277 N 0.95 -0.10 -0.97 0.00 0.00 -1.89 -0.87 119.26 116.38 2fa3 h ALA 277 Ca -0.03 -0.19 0.30 0.00 0.00 0.00 0.00 54.91 54.99 2fa3 h ALA 277 Cb 1.80 0.04 -0.15 0.00 0.00 0.00 0.00 17.79 19.48 2fa3 h ALA 277 CO 0.14 -0.37 0.44 -0.22 0.00 0.00 0.00 179.25 179.24 2fa3 h LYS 278 N -0.48 0.25 0.76 0.00 3.64 -1.45 0.38 116.57 119.67 2fa3 h LYS 278 Ca -0.01 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2fa3 h LYS 278 Cb 0.41 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2fa3 h LYS 278 CO 0.02 0.16 -0.37 1.49 -2.27 0.00 0.00 179.45 178.48 2fa3 h GLU 279 N 0.25 -0.99 -0.79 1.90 4.81 -1.23 -2.41 114.58 116.13 2fa3 h GLU 279 Ca 0.68 0.07 0.12 0.00 -0.13 0.00 0.00 59.36 60.10 2fa3 h GLU 279 Cb 1.53 0.22 -0.06 0.00 0.63 0.00 0.00 28.75 31.08 2fa3 h GLU 279 CO -0.65 -0.66 0.52 0.87 -0.73 0.00 0.00 179.01 178.36 2fa3 h LYS 280 N -1.19 0.58 0.02 1.92 1.57 0.41 -2.65 116.57 117.23 2fa3 h LYS 280 Ca -0.10 -0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.43 2fa3 h LYS 280 Cb 0.78 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 2fa3 h LYS 280 CO 0.17 0.38 -0.96 0.74 -0.57 0.00 0.00 179.45 179.22 2fa3 h PHE 281 N 0.60 0.25 0.00 -1.35 0.05 -0.35 -3.38 116.94 112.76 2fa3 h PHE 281 Ca 0.38 -0.16 -0.02 0.00 3.82 0.00 0.00 57.97 61.99 2fa3 h PHE 281 Cb 0.65 -0.02 -0.00 0.00 2.00 0.00 0.00 35.95 38.57 2fa3 h PHE 281 CO -0.00 1.02 -0.10 1.79 -0.18 0.00 0.00 178.31 180.84 2fa3 h THR 282 N 0.07 0.34 -0.71 -1.55 1.35 -1.05 -0.25 112.91 111.13 2fa3 h THR 282 Ca -0.05 -0.64 0.21 0.00 -0.55 0.00 0.00 66.41 65.38 2fa3 h THR 282 Cb 1.63 1.47 -0.03 0.00 -1.73 0.00 0.00 68.15 69.49 2fa3 h THR 282 CO 0.14 0.10 1.03 -0.65 -0.25 0.00 0.00 175.52 175.89 2fa3 h PRO 283 N 0.00 0.00 -0.01 4.72 0.11 -1.74 -3.02 132.00 132.06 2fa3 h PRO 283 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2fa3 h PRO 283 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 2fa3 h PRO 283 CO 0.01 0.00 -0.01 0.66 -0.21 0.00 0.00 178.00 178.45 2fa3 n TYR 284 N -3.16 0.00 0.40 0.65 4.01 -0.10 -4.55 117.16 114.41 2fa3 n TYR 284 Ca 0.16 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 58.00 2fa3 n TYR 284 Cb 1.25 0.00 0.43 0.00 -0.31 0.00 0.00 39.34 40.71 2fa3 n TYR 284 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2fa3 n SER 285 N 0.41 0.44 -0.29 7.72 3.41 -1.14 -1.88 113.62 122.29 2fa3 n SER 285 Ca 0.05 0.62 0.10 0.00 -0.26 0.00 0.00 58.87 59.38 2fa3 n SER 285 Cb 0.21 -0.71 0.49 0.00 -0.26 0.00 0.00 64.21 63.94 2fa3 n SER 285 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2fa3 n SER 286 N -1.99 0.88 -4.74 4.04 7.64 -1.26 -4.91 113.62 113.27 2fa3 n SER 286 Ca 0.02 -1.54 -0.41 0.00 1.01 0.00 0.00 58.87 57.96 2fa3 n SER 286 Cb 0.19 -0.05 -0.04 0.00 -1.01 0.00 0.00 64.21 63.30 2fa3 n SER 286 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2fa3 s LEU 287 N -1.62 4.51 1.07 -3.43 1.43 -0.79 -5.05 118.68 114.81 2fa3 s LEU 287 Ca 0.32 2.13 -0.12 0.00 -1.03 0.00 0.00 54.13 55.42 2fa3 s LEU 287 Cb 0.16 -3.61 0.22 0.00 0.03 0.00 0.00 46.19 42.99 2fa3 s LEU 287 CO 0.25 -0.18 0.98 -1.54 0.23 0.00 0.00 176.35 176.09 2fa3 n SER 288 N 2.01 -1.03 0.08 2.29 3.41 -1.26 -4.77 113.62 114.35 2fa3 n SER 288 Ca 0.01 0.08 -0.13 0.00 -0.26 0.00 0.00 58.87 58.57 2fa3 n SER 288 Cb 0.46 -1.32 -0.08 0.00 -0.26 0.00 0.00 64.21 63.01 2fa3 n SER 288 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2fa3 h LEU 289 N -2.32 -0.13 -0.99 1.04 6.46 -2.00 -1.18 115.31 116.19 2fa3 h LEU 289 Ca -0.53 -0.13 0.10 0.00 -0.12 0.00 0.00 57.88 57.20 2fa3 h LEU 289 Cb 1.31 0.03 -0.08 0.00 -0.73 0.00 0.00 40.66 41.19 2fa3 h LEU 289 CO 0.45 0.06 0.62 0.44 -0.62 0.00 0.00 178.44 179.39 2fa3 h ASP 290 N -0.31 0.93 -0.54 1.25 3.45 -2.01 0.24 116.42 119.44 2fa3 h ASP 290 Ca -0.02 0.04 0.07 0.00 0.43 0.00 0.00 57.03 57.56 2fa3 h ASP 290 Cb 0.25 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 38.84 2fa3 h ASP 290 CO 0.03 0.52 0.36 -0.33 -1.57 0.00 0.00 179.24 178.25 2fa3 h GLU 291 N 1.02 0.43 0.00 3.56 5.08 -1.79 -3.00 114.58 119.88 2fa3 h GLU 291 Ca 0.47 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.69 2fa3 h GLU 291 Cb 0.40 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2fa3 h GLU 291 CO -0.24 0.28 -0.56 0.66 -1.00 0.00 0.00 179.01 178.15 2fa3 h SER 292 N 0.44 0.00 0.74 1.42 4.64 0.71 -2.53 113.55 118.97 2fa3 h SER 292 Ca 0.24 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.45 2fa3 h SER 292 Cb 0.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 2fa3 h SER 292 CO -0.06 0.56 -0.52 1.88 -0.87 0.00 0.00 176.83 177.82 2fa3 h TYR 293 N 0.00 0.00 -0.01 4.77 0.99 -1.41 -3.31 116.97 117.99 2fa3 h TYR 293 Ca -0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.72 2fa3 h TYR 293 Cb 1.23 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.96 2fa3 h TYR 293 CO 0.00 0.52 -0.27 0.94 -0.00 0.00 0.00 178.16 179.35 2fa3 n GLN 294 N -3.67 1.16 -3.41 4.88 -0.06 -0.97 -4.91 117.38 110.41 2fa3 n GLN 294 Ca -0.01 -0.81 -0.43 0.00 -2.00 0.00 0.00 57.00 53.75 2fa3 n GLN 294 Cb 0.58 -1.48 -0.09 0.00 -4.06 0.00 0.00 30.24 25.18 2fa3 n GLN 294 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2fa3 s SER 295 N -2.39 6.14 0.52 1.69 0.15 -1.13 -4.93 113.70 113.74 2fa3 s SER 295 Ca 0.25 -1.00 0.26 0.00 0.70 0.00 0.00 55.95 56.16 2fa3 s SER 295 Cb 0.19 -2.18 1.44 0.00 -1.71 0.00 0.00 66.02 63.76 2fa3 s SER 295 CO 0.50 -0.54 2.08 0.03 1.20 0.00 0.00 173.24 176.51 2fa3 h ARG 296 N 8.69 0.00 -0.46 5.44 3.08 -1.93 -1.47 114.38 127.72 2fa3 h ARG 296 Ca -0.27 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.64 2fa3 h ARG 296 Cb 1.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 2fa3 h ARG 296 CO 0.79 0.11 -0.24 -0.44 -1.07 0.00 0.00 179.97 179.12 2fa3 h ASP 297 N 0.00 1.00 -0.16 7.04 3.32 -2.00 -2.79 116.42 122.82 2fa3 h ASP 297 Ca -0.00 -0.39 -0.03 0.00 0.02 0.00 0.00 57.03 56.63 2fa3 h ASP 297 Cb 0.30 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2fa3 h ASP 297 CO 0.01 1.18 -0.02 0.25 -1.72 0.00 0.00 179.24 178.94 2fa3 h LEU 298 N 0.83 0.30 -0.58 1.55 6.46 -1.66 -1.38 115.31 120.83 2fa3 h LEU 298 Ca 0.10 -0.34 0.07 0.00 -0.12 0.00 0.00 57.88 57.59 2fa3 h LEU 298 Cb 0.81 -0.08 -0.10 0.00 -0.73 0.00 0.00 40.66 40.57 2fa3 h LEU 298 CO 0.07 0.57 -0.53 -0.33 -0.62 0.00 0.00 178.44 177.60 2fa3 h GLU 299 N 0.03 -0.26 0.04 1.25 5.08 -1.60 0.35 114.58 119.46 2fa3 h GLU 299 Ca 0.04 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 2fa3 h GLU 299 Cb 0.43 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2fa3 h GLU 299 CO 0.01 -0.17 -0.26 0.87 -1.00 0.00 0.00 179.01 178.46 2fa3 h LYS 300 N -0.27 -0.41 -0.12 2.33 1.57 -1.34 0.30 116.57 118.63 2fa3 h LYS 300 Ca 0.12 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.97 2fa3 h LYS 300 Cb 0.55 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 2fa3 h LYS 300 CO -0.69 -0.27 -0.09 0.28 -0.57 0.00 0.00 179.45 178.11 2fa3 h VAL 301 N -0.42 0.73 -0.43 0.50 2.07 -1.08 -2.13 116.25 115.50 2fa3 h VAL 301 Ca 0.05 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.59 2fa3 h VAL 301 Cb 0.49 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 2fa3 h VAL 301 CO -0.20 0.00 0.26 0.28 0.02 0.00 0.00 177.57 177.93 2fa3 h SER 302 N -0.10 0.43 0.13 0.57 0.02 0.72 -1.61 113.55 113.71 2fa3 h SER 302 Ca 0.08 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2fa3 h SER 302 Cb 0.21 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2fa3 h SER 302 CO -0.18 0.31 -0.14 1.56 -1.14 0.00 0.00 176.83 177.23 2fa3 h GLN 303 N 0.53 0.03 0.11 3.45 4.20 -0.08 -2.13 115.11 121.21 2fa3 h GLN 303 Ca 0.17 -0.01 -0.17 0.00 0.06 0.00 0.00 58.65 58.70 2fa3 h GLN 303 Cb -0.01 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 27.78 2fa3 h GLN 303 CO -0.07 0.18 -0.74 0.37 -0.67 0.00 0.00 178.83 177.90 2fa3 h GLN 304 N 0.03 0.31 -0.09 1.46 4.15 -0.73 -2.63 115.11 117.61 2fa3 h GLN 304 Ca 0.01 -0.48 0.03 0.00 0.77 0.00 0.00 58.65 58.97 2fa3 h GLN 304 Cb 0.28 0.17 -0.00 0.00 0.21 0.00 0.00 27.48 28.13 2fa3 h GLN 304 CO 0.02 1.20 0.07 -0.07 -1.93 0.00 0.00 178.83 178.12 2fa3 h LEU 305 N -0.33 0.00 -0.23 -2.39 -0.00 -1.04 -3.25 115.31 108.07 2fa3 h LEU 305 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.76 2fa3 h LEU 305 Cb 1.55 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.21 2fa3 h LEU 305 CO 0.14 0.00 -0.33 0.00 -0.00 0.00 0.00 178.44 178.25 2fa3 n ALA 306 N -2.53 3.21 0.10 1.53 0.00 -0.82 -4.61 120.51 117.39 2fa3 n ALA 306 Ca -0.01 -0.35 0.11 0.00 0.00 0.00 0.00 53.44 53.19 2fa3 n ALA 306 Cb 0.18 -1.17 0.59 0.00 0.00 0.00 0.00 19.45 19.05 2fa3 n ALA 306 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2fa3 h LYS 307 N 0.55 0.17 0.10 0.00 3.64 -1.57 0.51 116.57 119.97 2fa3 h LYS 307 Ca 0.00 -0.01 -0.35 0.00 -1.27 0.00 0.00 60.65 59.02 2fa3 h LYS 307 Cb 0.49 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 2fa3 h LYS 307 CO 0.00 0.11 -1.96 -2.37 -2.27 0.00 0.00 179.45 172.96 2fa3 n THR 308 N -4.48 1.75 -0.08 1.00 5.66 -1.26 -2.68 114.28 114.19 2fa3 n THR 308 Ca 0.03 -0.68 -0.07 0.00 -3.05 0.00 0.00 64.05 60.29 2fa3 n THR 308 Cb 0.25 -1.61 -0.00 0.00 -1.55 0.00 0.00 70.33 67.41 2fa3 n THR 308 CO 0.00 0.00 0.00 1.88 -3.05 0.00 0.00 175.07 173.90 2fa3 h TYR 309 N 0.06 -0.06 -0.22 1.09 -1.99 -1.78 -1.42 116.97 112.64 2fa3 h TYR 309 Ca -0.41 0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.41 2fa3 h TYR 309 Cb 2.03 0.07 -0.01 0.00 2.00 0.00 0.00 36.73 40.83 2fa3 h TYR 309 CO 0.06 -0.08 0.21 -0.92 -0.00 0.00 0.00 178.16 177.43 2fa3 h TYR 310 N 0.05 0.00 0.00 4.88 3.20 -0.09 0.59 116.97 125.61 2fa3 h TYR 310 Ca 0.14 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.88 2fa3 h TYR 310 Cb 0.20 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 2fa3 h TYR 310 CO -0.24 0.00 -0.62 0.22 -1.64 0.00 0.00 178.16 175.88 2fa3 h ASP 311 N 0.00 0.00 0.11 -2.11 3.58 -1.04 0.64 116.42 117.60 2fa3 h ASP 311 Ca 0.11 0.00 -0.36 0.00 0.42 0.00 0.00 57.03 57.20 2fa3 h ASP 311 Cb 0.52 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.55 2fa3 h ASP 311 CO -0.00 0.62 -1.96 0.00 -2.88 0.00 0.00 179.24 175.02 2fa3 n ALA 312 N -2.27 0.89 0.41 -0.78 0.00 -0.83 -4.28 120.51 113.65 2fa3 n ALA 312 Ca 0.01 -0.59 0.11 0.00 0.00 0.00 0.00 53.44 52.96 2fa3 n ALA 312 Cb 0.76 -0.65 -0.10 0.00 0.00 0.00 0.00 19.45 19.45 2fa3 n ALA 312 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2fa3 n LYS 313 N -3.55 0.39 0.00 0.00 5.02 0.14 -4.81 118.16 115.34 2fa3 n LYS 313 Ca -0.32 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 55.88 2fa3 n LYS 313 Cb 1.02 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 2fa3 n LYS 313 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2fa3 n VAL 314 N -2.00 0.00 -0.32 -0.18 0.31 -0.88 -2.16 118.33 113.10 2fa3 n VAL 314 Ca -0.00 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.50 2fa3 n VAL 314 Cb 0.47 -0.24 0.37 0.00 -0.91 0.00 0.00 33.84 33.53 2fa3 n VAL 314 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2fa3 h GLN 315 N 0.00 0.34 0.00 5.55 -0.00 -1.07 0.20 115.11 120.13 2fa3 h GLN 315 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.63 2fa3 h GLN 315 Cb 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 27.48 27.66 2fa3 h GLN 315 CO 0.00 0.23 0.00 -2.30 0.00 0.00 0.00 178.83 176.76 2fa3 n PRO 316 N -5.07 0.58 -0.13 -2.39 -0.02 -1.26 -2.20 135.00 124.51 2fa3 n PRO 316 Ca 0.26 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.83 2fa3 n PRO 316 Cb 0.79 -1.28 0.16 0.00 -0.02 0.00 0.00 33.50 33.15 2fa3 n PRO 316 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2fa3 n THR 317 N -0.78 0.44 0.76 3.45 -2.24 0.69 -3.28 114.28 113.32 2fa3 n THR 317 Ca 0.08 -0.72 0.08 0.00 -2.27 0.00 0.00 64.05 61.23 2fa3 n THR 317 Cb 0.04 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 2fa3 n THR 317 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2fa3 n THR 318 N 1.11 0.00 0.20 4.28 -2.24 -0.93 -4.34 114.28 112.36 2fa3 n THR 318 Ca 0.15 -0.34 -0.16 0.00 -2.27 0.00 0.00 64.05 61.43 2fa3 n THR 318 Cb 0.50 1.22 -0.09 0.00 -2.10 0.00 0.00 70.33 69.86 2fa3 n THR 318 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2fa3 h LEU 319 N 2.04 -1.31 0.51 3.22 6.46 -1.81 -1.99 115.31 122.42 2fa3 h LEU 319 Ca 0.00 0.12 -0.02 0.00 -0.12 0.00 0.00 57.88 57.86 2fa3 h LEU 319 Cb 0.60 0.46 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 2fa3 h LEU 319 CO 0.00 -0.57 -0.24 0.58 -0.62 0.00 0.00 178.44 177.58 2fa3 h VAL 320 N -0.82 0.06 -0.98 1.05 2.07 -1.84 -2.39 116.25 113.40 2fa3 h VAL 320 Ca -0.02 -0.51 0.28 0.00 0.82 0.00 0.00 66.70 67.27 2fa3 h VAL 320 Cb 0.77 0.09 -0.18 0.00 -1.52 0.00 0.00 31.29 30.45 2fa3 h VAL 320 CO -0.15 0.01 0.07 -0.65 0.02 0.00 0.00 177.57 176.87 2fa3 h PRO 321 N -1.16 0.02 0.00 1.57 0.11 -1.85 0.50 132.00 131.19 2fa3 h PRO 321 Ca -0.07 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.02 2fa3 h PRO 321 Cb 0.54 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.64 2fa3 h PRO 321 CO 0.11 0.01 -0.09 0.87 -0.21 0.00 0.00 178.00 178.70 2fa3 h LYS 322 N 0.02 0.00 0.00 1.05 1.57 -1.14 -2.08 116.57 115.99 2fa3 h LYS 322 Ca 0.61 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.39 2fa3 h LYS 322 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2fa3 h LYS 322 CO -0.89 0.09 -0.94 1.04 -0.57 0.00 0.00 179.45 178.18 2fa3 n GLN 323 N -3.39 1.05 0.00 3.15 1.13 0.16 -0.77 117.38 118.72 2fa3 n GLN 323 Ca -0.01 -0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 2fa3 n GLN 323 Cb 0.26 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.25 2fa3 n GLN 323 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2fa3 n VAL 324 N -1.49 0.00 0.00 5.09 0.31 -0.57 -4.13 118.33 117.53 2fa3 n VAL 324 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2fa3 n VAL 324 Cb 0.30 -0.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.80 2fa3 n VAL 324 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2fa3 n GLY 325 N 2.90 -0.73 3.65 2.92 0.00 -0.78 -0.27 105.19 112.87 2fa3 n GLY 325 Ca 0.00 -2.18 -0.51 0.00 0.00 0.00 0.00 46.02 43.33 2fa3 n GLY 325 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2fa3 n ASN 326 N 0.00 2.43 -0.15 1.61 2.85 -1.13 -4.71 115.26 116.16 2fa3 n ASN 326 Ca 0.00 1.08 0.05 0.00 -0.11 0.00 0.00 54.58 55.60 2fa3 n ASN 326 Cb 0.00 -1.27 0.08 0.00 1.24 0.00 0.00 39.78 39.83 2fa3 n ASN 326 CO 0.00 0.00 0.00 0.23 -2.11 0.00 0.00 177.26 175.38 2fa3 n MET 327 N 3.93 2.39 0.00 1.20 2.81 -1.26 -2.01 117.12 124.18 2fa3 n MET 327 Ca 0.20 -2.02 0.00 0.00 -1.81 0.00 0.00 57.70 54.07 2fa3 n MET 327 Cb 0.22 -1.26 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 2fa3 n MET 327 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2fa3 n TYR 328 N -0.73 0.00 0.28 2.03 0.53 -1.26 -1.04 117.16 116.96 2fa3 n TYR 328 Ca 0.08 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 57.09 2fa3 n TYR 328 Cb 0.45 0.00 0.79 0.00 -1.03 0.00 0.00 39.34 39.55 2fa3 n TYR 328 CO 0.00 0.00 0.00 1.79 -1.02 0.00 0.00 176.86 177.63 2fa3 h THR 329 N 0.00 0.63 -0.01 -0.72 1.35 -1.86 0.19 112.91 112.49 2fa3 h THR 329 Ca 0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 2fa3 h THR 329 Cb 0.00 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 2fa3 h THR 329 CO 0.00 0.06 -0.52 0.00 -0.25 0.00 0.00 175.52 174.81 2fa3 n ALA 330 N -2.34 3.65 0.19 6.62 0.00 -0.21 -4.49 120.51 123.93 2fa3 n ALA 330 Ca -0.03 -0.51 -0.15 0.00 0.00 0.00 0.00 53.44 52.75 2fa3 n ALA 330 Cb 0.15 -0.95 -0.08 0.00 0.00 0.00 0.00 19.45 18.58 2fa3 n ALA 330 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2fa3 h SER 331 N 1.19 -0.35 -0.91 0.00 0.87 -0.55 0.11 113.55 113.90 2fa3 h SER 331 Ca 0.00 -0.02 0.15 0.00 -1.23 0.00 0.00 61.79 60.70 2fa3 h SER 331 Cb 0.59 0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 62.56 2fa3 h SER 331 CO 0.00 -0.22 0.59 0.25 -0.53 0.00 0.00 176.83 176.92 2fa3 h LEU 332 N -0.46 0.66 0.00 2.23 5.85 -1.78 -0.97 115.31 120.85 2fa3 h LEU 332 Ca -0.04 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2fa3 h LEU 332 Cb 0.35 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2fa3 h LEU 332 CO 0.07 0.32 -0.65 1.88 -0.34 0.00 0.00 178.44 179.72 2fa3 h TYR 333 N 0.69 0.00 -0.14 1.25 0.05 -1.73 -1.19 116.97 115.91 2fa3 h TYR 333 Ca 0.47 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 59.13 2fa3 h TYR 333 Cb 0.77 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.51 2fa3 h TYR 333 CO -0.00 0.16 -0.35 0.00 -1.05 0.00 0.00 178.16 176.91 2fa3 h ALA 334 N 1.84 0.23 -0.39 3.88 0.00 0.43 -1.49 119.26 123.77 2fa3 h ALA 334 Ca -0.02 -0.44 0.08 0.00 0.00 0.00 0.00 54.91 54.52 2fa3 h ALA 334 Cb 1.14 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 2fa3 h ALA 334 CO 0.02 0.29 -0.06 0.00 0.00 0.00 0.00 179.25 179.50 2fa3 h ALA 335 N 0.53 0.29 -0.92 0.00 0.00 -1.20 0.11 119.26 118.08 2fa3 h ALA 335 Ca -0.00 0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.10 2fa3 h ALA 335 Cb 0.96 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 2fa3 h ALA 335 CO 0.08 -0.43 0.60 0.35 0.00 0.00 0.00 179.25 179.84 2fa3 h PHE 336 N 0.04 1.07 -0.44 0.00 3.57 -1.21 -1.67 116.94 118.30 2fa3 h PHE 336 Ca 0.19 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.59 2fa3 h PHE 336 Cb 0.28 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 2fa3 h PHE 336 CO -0.31 0.57 -0.22 0.00 -2.23 0.00 0.00 178.31 176.11 2fa3 h ALA 337 N 1.50 0.78 -0.82 2.41 0.00 -0.60 -1.72 119.26 120.82 2fa3 h ALA 337 Ca 0.39 -0.38 0.18 0.00 0.00 0.00 0.00 54.91 55.10 2fa3 h ALA 337 Cb 0.18 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2fa3 h ALA 337 CO -0.15 0.65 0.55 0.77 0.00 0.00 0.00 179.25 181.08 2fa3 h SER 338 N 0.77 0.35 0.60 0.00 0.02 -0.18 0.20 113.55 115.31 2fa3 h SER 338 Ca 0.10 0.03 -0.28 0.00 -0.84 0.00 0.00 61.79 60.80 2fa3 h SER 338 Cb 0.77 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 2fa3 h SER 338 CO 0.06 0.16 -1.36 0.25 -1.14 0.00 0.00 176.83 174.80 2fa3 h LEU 339 N 0.36 0.32 -0.97 5.07 5.85 -0.83 -2.80 115.31 122.30 2fa3 h LEU 339 Ca 0.41 -0.39 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 2fa3 h LEU 339 Cb 1.06 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 2fa3 h LEU 339 CO -0.13 1.32 -0.50 0.58 -0.34 0.00 0.00 178.44 179.37 2fa3 h VAL 340 N 0.05 1.36 -0.06 1.05 2.07 -0.40 -1.94 116.25 118.38 2fa3 h VAL 340 Ca -0.17 -1.72 -0.03 0.00 0.82 0.00 0.00 66.70 65.60 2fa3 h VAL 340 Cb 1.96 1.91 -0.00 0.00 -1.52 0.00 0.00 31.29 33.64 2fa3 h VAL 340 CO 0.17 0.49 -0.10 -0.74 0.02 0.00 0.00 177.57 177.41 2fa3 h HIS 341 N 0.03 0.20 0.03 1.57 -0.00 -0.99 -3.05 115.15 112.94 2fa3 h HIS 341 Ca -0.00 -0.07 -0.25 0.00 -0.00 0.00 0.00 60.37 60.05 2fa3 h HIS 341 Cb 0.89 -0.04 0.01 0.00 -0.00 0.00 0.00 27.41 28.27 2fa3 h HIS 341 CO 0.00 0.68 -1.03 -0.91 -0.00 0.00 0.00 177.93 176.67 2fa3 h ASN 342 N -0.33 0.62 0.00 3.26 2.35 -1.50 -3.39 115.58 116.60 2fa3 h ASN 342 Ca 0.00 -0.53 -0.02 0.00 -0.55 0.00 0.00 56.30 55.21 2fa3 h ASN 342 Cb 0.66 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 2fa3 h ASN 342 CO 0.02 1.34 -0.32 0.29 -1.65 0.00 0.00 177.43 177.11 2fa3 n LYS 343 N -3.74 1.00 0.28 0.81 4.76 -0.73 -4.81 118.16 115.72 2fa3 n LYS 343 Ca -0.08 -2.42 0.15 0.00 -2.87 0.00 0.00 58.31 53.08 2fa3 n LYS 343 Cb 0.88 -1.20 0.79 0.00 -1.84 0.00 0.00 35.03 33.66 2fa3 n LYS 343 CO 0.00 0.00 0.00 1.12 -1.37 0.00 0.00 177.40 177.15 2fa3 h HIS 344 N 0.35 0.00 0.00 2.13 2.07 -1.69 -1.22 115.15 116.79 2fa3 h HIS 344 Ca -0.02 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.50 2fa3 h HIS 344 Cb 1.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.14 2fa3 h HIS 344 CO 0.23 0.09 -0.19 0.77 -3.07 0.00 0.00 177.93 175.75 2fa3 h SER 345 N 0.00 0.00 -0.11 3.10 0.02 -1.88 -3.15 113.55 111.53 2fa3 h SER 345 Ca -0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2fa3 h SER 345 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2fa3 h SER 345 CO 0.01 0.03 0.00 -0.67 -1.14 0.00 0.00 176.83 175.06 2fa3 n ASP 346 N -2.37 2.89 0.01 3.07 -0.08 -0.47 -4.71 116.55 114.88 2fa3 n ASP 346 Ca 0.05 -1.89 -0.15 0.00 -1.51 0.00 0.00 54.79 51.29 2fa3 n ASP 346 Cb 0.45 -0.06 -0.14 0.00 2.34 0.00 0.00 41.12 43.71 2fa3 n ASP 346 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2fa3 h LEU 347 N 4.07 0.23 -8.11 -2.67 3.38 -1.48 -3.45 115.31 107.28 2fa3 h LEU 347 Ca 0.00 -0.44 -0.78 0.00 0.09 0.00 0.00 57.88 56.75 2fa3 h LEU 347 Cb 0.88 -0.07 0.02 0.00 0.09 0.00 0.00 40.66 41.57 2fa3 h LEU 347 CO 0.00 1.39 0.50 0.00 0.09 0.00 0.00 178.44 180.42 2fa3 n ALA 348 N -2.72 -1.68 -1.01 1.53 0.00 -1.26 0.00 120.51 115.36 2fa3 n ALA 348 Ca -0.21 0.47 -0.00 0.00 0.00 0.00 0.00 53.44 53.69 2fa3 n ALA 348 Cb 1.05 -1.70 -0.00 0.00 0.00 0.00 0.00 19.45 18.80 2fa3 n ALA 348 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fa3 n GLY 349 N 3.12 0.45 3.85 0.00 0.00 0.72 -4.90 105.19 108.43 2fa3 n GLY 349 Ca 0.26 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.43 2fa3 n GLY 349 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fa3 s LYS 350 N -1.27 2.75 -0.27 1.61 -0.14 0.10 -4.90 119.74 117.63 2fa3 s LYS 350 Ca 0.00 -1.27 -0.05 0.00 -1.36 0.00 0.00 55.97 53.29 2fa3 s LYS 350 Cb 0.00 -2.49 0.01 0.00 -1.68 0.00 0.00 37.83 33.67 2fa3 s LYS 350 CO 0.00 0.13 0.03 0.50 -0.76 0.00 0.00 175.35 175.25 2fa3 s ARG 351 N -3.98 3.08 -0.20 1.68 3.52 -1.26 -1.37 118.95 120.41 2fa3 s ARG 351 Ca 0.40 -0.84 -0.07 0.00 -0.13 0.00 0.00 55.73 55.08 2fa3 s ARG 351 Cb -0.06 -3.23 -0.04 0.00 -1.56 0.00 0.00 34.95 30.06 2fa3 s ARG 351 CO 0.26 -0.39 0.07 0.08 -0.81 0.00 0.00 175.30 174.51 2fa3 s VAL 352 N 1.46 4.65 -0.10 7.11 1.01 -0.49 -0.72 120.40 133.31 2fa3 s VAL 352 Ca 0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 2fa3 s VAL 352 Cb -0.17 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 2fa3 s VAL 352 CO 0.00 0.42 -0.01 -0.69 0.00 0.00 0.00 175.10 174.82 2fa3 s VAL 353 N 0.78 4.23 -0.08 2.92 1.01 -0.15 -0.69 120.40 128.41 2fa3 s VAL 353 Ca 0.04 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 61.79 2fa3 s VAL 353 Cb -0.13 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.44 2fa3 s VAL 353 CO 0.02 0.58 -0.22 -0.04 0.00 0.00 0.00 175.10 175.44 2fa3 s MET 354 N -0.59 2.84 -0.24 2.72 -1.94 0.42 -1.36 119.30 121.16 2fa3 s MET 354 Ca 0.10 -0.85 0.01 0.00 -1.71 0.00 0.00 55.69 53.24 2fa3 s MET 354 Cb -0.12 -2.30 0.04 0.00 2.01 0.00 0.00 34.83 34.47 2fa3 s MET 354 CO 0.02 0.31 -0.12 0.12 -0.01 0.00 0.00 175.02 175.34 2fa3 s PHE 355 N 0.04 3.08 -0.08 -0.03 5.36 0.29 -0.40 117.98 126.25 2fa3 s PHE 355 Ca -0.09 -1.93 -0.08 0.00 -0.96 0.00 0.00 56.93 53.87 2fa3 s PHE 355 Cb -0.15 -1.97 -0.04 0.00 -0.34 0.00 0.00 43.02 40.52 2fa3 s PHE 355 CO 0.06 -0.82 0.20 0.45 -1.46 0.00 0.00 175.22 173.64 2fa3 s SER 356 N 1.22 6.47 0.04 6.13 0.15 0.08 -1.13 113.70 126.65 2fa3 s SER 356 Ca -0.03 0.55 -0.01 0.00 0.70 0.00 0.00 55.95 57.16 2fa3 s SER 356 Cb -0.17 -2.10 -0.03 0.00 -1.71 0.00 0.00 66.02 62.01 2fa3 s SER 356 CO -0.07 0.37 -0.02 -0.47 1.20 0.00 0.00 173.24 174.26 2fa3 s TYR 357 N -1.08 0.37 -0.22 3.44 5.04 -1.26 -2.02 117.35 121.62 2fa3 s TYR 357 Ca 0.18 -0.78 -0.11 0.00 -2.44 0.00 0.00 57.07 53.92 2fa3 s TYR 357 Cb -0.13 -0.28 0.07 0.00 0.35 0.00 0.00 41.96 41.98 2fa3 s TYR 357 CO 0.08 -0.30 0.52 0.20 -1.34 0.00 0.00 175.55 174.71 2fa3 s GLY 358 N -2.21 -0.46 0.94 8.97 0.00 0.22 -3.57 107.32 111.21 2fa3 s GLY 358 Ca -0.04 1.89 -0.11 0.00 0.00 0.00 0.00 44.72 46.46 2fa3 s GLY 358 CO -0.06 2.09 1.10 -0.56 0.00 0.00 0.00 173.10 175.68 2fa3 s SER 359 N 1.69 2.84 0.00 1.64 0.01 -1.26 -0.81 113.70 117.80 2fa3 s SER 359 Ca -0.09 1.86 0.00 0.00 1.31 0.00 0.00 55.95 59.04 2fa3 s SER 359 Cb -0.08 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2fa3 s SER 359 CO -0.16 -3.10 0.00 0.61 0.41 0.00 0.00 173.24 171.00 2fa3 n GLY 360 N -0.12 3.05 0.00 3.44 0.00 -1.26 -4.44 105.19 105.86 2fa3 n GLY 360 Ca 0.09 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2fa3 n GLY 360 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2fa3 n SER 361 N 0.73 0.00 -3.97 1.61 2.88 -1.12 -1.86 113.62 111.90 2fa3 n SER 361 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 2fa3 n SER 361 Cb 0.00 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.30 2fa3 n SER 361 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2fa3 s THR 362 N 0.00 0.82 -0.06 2.46 -4.23 0.01 -1.55 115.64 113.08 2fa3 s THR 362 Ca 0.00 -0.31 -0.23 0.00 -1.18 0.00 0.00 61.69 59.97 2fa3 s THR 362 Cb 0.00 -0.77 0.05 0.00 1.34 0.00 0.00 72.50 73.12 2fa3 s THR 362 CO 0.00 0.28 0.52 0.00 -0.54 0.00 0.00 174.62 174.88 2fa3 s ALA 363 N 0.64 -1.34 -0.17 3.99 0.00 -0.86 -0.61 121.76 123.41 2fa3 s ALA 363 Ca -0.11 0.99 -0.07 0.00 0.00 0.00 0.00 51.96 52.77 2fa3 s ALA 363 Cb -0.14 -0.11 0.07 0.00 0.00 0.00 0.00 23.12 22.94 2fa3 s ALA 363 CO 0.02 -0.31 0.37 0.99 0.00 0.00 0.00 175.76 176.83 2fa3 s THR 364 N -1.01 -0.33 0.01 0.00 2.01 -0.86 -1.84 115.64 113.63 2fa3 s THR 364 Ca -0.10 0.16 -0.17 0.00 0.31 0.00 0.00 61.69 61.89 2fa3 s THR 364 Cb -0.03 -0.58 -0.06 0.00 0.01 0.00 0.00 72.50 71.85 2fa3 s THR 364 CO 0.06 0.07 0.47 -0.32 -0.69 0.00 0.00 174.62 174.21 2fa3 s MET 365 N 2.02 4.06 0.21 4.92 1.75 -0.00 -0.74 119.30 131.52 2fa3 s MET 365 Ca -0.05 0.52 -0.14 0.00 -1.25 0.00 0.00 55.69 54.77 2fa3 s MET 365 Cb -0.11 -3.26 0.01 0.00 2.84 0.00 0.00 34.83 34.32 2fa3 s MET 365 CO -0.12 0.60 0.47 -0.59 -0.65 0.00 0.00 175.02 174.73 2fa3 s PHE 366 N -0.85 0.14 0.04 4.11 -0.71 0.47 -1.62 117.98 119.56 2fa3 s PHE 366 Ca 0.26 -0.50 0.06 0.00 -1.04 0.00 0.00 56.93 55.71 2fa3 s PHE 366 Cb -0.17 0.25 -0.02 0.00 -1.21 0.00 0.00 43.02 41.86 2fa3 s PHE 366 CO 0.15 -0.91 -0.16 0.45 -1.34 0.00 0.00 175.22 173.40 2fa3 s SER 367 N -2.94 1.94 0.00 1.98 0.15 -1.10 0.16 113.70 113.89 2fa3 s SER 367 Ca 0.15 -0.49 0.02 0.00 0.70 0.00 0.00 55.95 56.33 2fa3 s SER 367 Cb -0.00 -0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 64.17 2fa3 s SER 367 CO 0.02 0.07 -0.06 -0.76 1.20 0.00 0.00 173.24 173.70 2fa3 s LEU 368 N -1.21 2.04 -0.22 3.45 1.43 0.13 -1.45 118.68 122.85 2fa3 s LEU 368 Ca 0.03 -0.15 -0.00 0.00 -1.03 0.00 0.00 54.13 52.98 2fa3 s LEU 368 Cb -0.08 -0.30 0.02 0.00 0.03 0.00 0.00 46.19 45.86 2fa3 s LEU 368 CO 0.02 0.05 -0.13 -0.60 0.23 0.00 0.00 176.35 175.92 2fa3 s ARG 369 N -0.29 2.89 0.23 1.70 3.00 -0.13 -1.40 118.95 124.96 2fa3 s ARG 369 Ca 0.01 -0.92 -0.02 0.00 -1.00 0.00 0.00 55.73 53.81 2fa3 s ARG 369 Cb -0.03 -2.79 -0.04 0.00 0.00 0.00 0.00 34.95 32.09 2fa3 s ARG 369 CO -0.00 -0.31 0.44 -0.51 0.00 0.00 0.00 175.30 174.92 2fa3 s LEU 370 N 1.30 4.18 0.00 -0.88 1.43 -0.47 -1.73 118.68 122.50 2fa3 s LEU 370 Ca 0.02 0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 53.49 2fa3 s LEU 370 Cb -0.15 -3.27 0.04 0.00 0.03 0.00 0.00 46.19 42.85 2fa3 s LEU 370 CO -0.08 -0.09 0.58 0.00 0.23 0.00 0.00 176.35 176.99 2fa3 s GLU 372 N -2.05 4.44 -0.12 0.00 2.56 -1.26 -4.63 118.70 117.65 2fa3 s GLU 372 Ca 0.12 0.96 -0.30 0.00 0.00 0.00 0.00 54.97 55.76 2fa3 s GLU 372 Cb -0.03 -3.34 0.12 0.00 2.00 0.00 0.00 34.13 32.88 2fa3 s GLU 372 CO 0.06 0.35 0.94 1.21 -0.56 0.00 0.00 175.26 177.27 2fa3 s ASN 373 N -0.26 -0.39 0.43 -1.70 3.84 -1.26 -4.97 114.94 110.62 2fa3 s ASN 373 Ca 0.36 0.34 -0.26 0.00 0.21 0.00 0.00 52.86 53.51 2fa3 s ASN 373 Cb -0.20 0.34 -0.09 0.00 -0.55 0.00 0.00 41.25 40.76 2fa3 s ASN 373 CO 0.21 -0.43 1.37 -1.10 -2.79 0.00 0.00 177.10 174.37 2fa3 s GLN 374 N -1.57 3.83 0.60 0.43 1.11 -1.26 -4.21 119.66 118.60 2fa3 s GLN 374 Ca -0.01 2.31 -0.19 0.00 0.01 0.00 0.00 55.36 57.48 2fa3 s GLN 374 Cb -0.01 -2.72 -0.04 0.00 -1.01 0.00 0.00 33.01 29.24 2fa3 s GLN 374 CO 0.00 -0.66 1.14 0.43 0.01 0.00 0.00 175.29 176.22 2fa3 n SER 375 N -0.02 1.54 -0.09 5.90 7.64 -1.26 -0.39 113.62 126.95 2fa3 n SER 375 Ca 0.04 0.85 0.15 0.00 1.01 0.00 0.00 58.87 60.92 2fa3 n SER 375 Cb 0.42 -1.48 0.79 0.00 -1.01 0.00 0.00 64.21 62.94 2fa3 n SER 375 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2fa3 n PRO 376 N -1.28 0.94 -2.91 1.43 -0.04 -1.26 -4.92 135.00 126.95 2fa3 n PRO 376 Ca 0.14 -0.18 -0.40 0.00 -0.04 0.00 0.00 63.50 63.02 2fa3 n PRO 376 Cb 0.47 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 2fa3 n PRO 376 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2fa3 n PHE 377 N -0.87 2.68 -4.11 0.54 0.99 0.48 -4.61 117.46 112.57 2fa3 n PHE 377 Ca 0.20 -2.82 -0.15 0.00 -0.00 0.00 0.00 57.45 54.68 2fa3 n PHE 377 Cb 0.20 -1.11 -0.12 0.00 -1.00 0.00 0.00 39.48 37.45 2fa3 n PHE 377 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2fa3 s SER 378 N -1.84 1.09 0.24 4.37 1.04 -1.24 -4.17 113.70 113.19 2fa3 s SER 378 Ca 0.36 -0.54 -0.05 0.00 0.48 0.00 0.00 55.95 56.20 2fa3 s SER 378 Cb 0.13 0.00 0.42 0.00 0.10 0.00 0.00 66.02 66.67 2fa3 s SER 378 CO -0.00 -0.15 1.75 -0.07 0.98 0.00 0.00 173.24 175.75 2fa3 h LEU 379 N 4.52 0.36 -0.68 2.42 3.38 -1.85 -1.70 115.31 121.76 2fa3 h LEU 379 Ca -0.37 0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 2fa3 h LEU 379 Cb 1.20 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.97 2fa3 h LEU 379 CO 0.41 0.17 0.11 0.28 0.09 0.00 0.00 178.44 179.49 2fa3 h SER 380 N 0.51 1.08 0.13 -0.43 0.02 -1.95 -2.32 113.55 110.59 2fa3 h SER 380 Ca 0.39 -0.26 -0.14 0.00 -0.84 0.00 0.00 61.79 60.94 2fa3 h SER 380 Cb 0.54 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2fa3 h SER 380 CO -0.35 1.07 -0.52 -1.13 -1.14 0.00 0.00 176.83 174.76 2fa3 h ASN 381 N 1.05 0.47 -0.43 3.07 -1.24 -1.78 -0.56 115.58 116.16 2fa3 h ASN 381 Ca 0.21 -0.24 -0.08 0.00 0.71 0.00 0.00 56.30 56.89 2fa3 h ASN 381 Cb 0.45 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.35 2fa3 h ASN 381 CO 0.01 0.90 -0.06 0.40 -1.29 0.00 0.00 177.43 177.39 2fa3 h ILE 382 N 0.33 1.27 -0.54 2.57 2.04 -1.29 0.13 117.51 122.02 2fa3 h ILE 382 Ca 0.01 -1.14 -0.04 0.00 1.00 0.00 0.00 64.86 64.70 2fa3 h ILE 382 Cb 1.02 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 38.22 2fa3 h ILE 382 CO 0.09 0.39 0.17 0.00 0.00 0.00 0.00 178.15 178.80 2fa3 h ALA 383 N 0.87 1.30 0.26 1.87 0.00 -1.18 -1.42 119.26 120.96 2fa3 h ALA 383 Ca 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2fa3 h ALA 383 Cb 0.58 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2fa3 h ALA 383 CO 0.03 0.51 -0.13 1.03 0.00 0.00 0.00 179.25 180.70 2fa3 h SER 384 N 0.78 -0.30 -0.27 0.00 0.87 -0.69 -3.04 113.55 110.90 2fa3 h SER 384 Ca 0.18 -0.23 0.03 0.00 -1.23 0.00 0.00 61.79 60.54 2fa3 h SER 384 Cb 0.22 0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.23 2fa3 h SER 384 CO -0.01 0.14 0.09 0.58 -0.53 0.00 0.00 176.83 177.10 2fa3 h VAL 385 N -0.81 0.93 -0.89 2.23 2.07 -0.69 -2.45 116.25 116.64 2fa3 h VAL 385 Ca -0.04 -0.07 0.18 0.00 0.82 0.00 0.00 66.70 67.59 2fa3 h VAL 385 Cb 0.51 0.70 -0.07 0.00 -1.52 0.00 0.00 31.29 30.91 2fa3 h VAL 385 CO 0.06 0.04 0.58 0.24 0.02 0.00 0.00 177.57 178.51 2fa3 h MET 386 N 0.22 0.48 -6.65 1.57 2.86 -1.36 -3.46 114.93 108.58 2fa3 h MET 386 Ca 0.12 -0.03 -0.53 0.00 -2.06 0.00 0.00 59.70 57.20 2fa3 h MET 386 Cb 0.09 -0.11 0.02 0.00 0.06 0.00 0.00 31.60 31.66 2fa3 h MET 386 CO -0.12 0.32 -0.98 -3.47 1.06 0.00 0.00 176.91 173.71 2fa3 n ASP 387 N -4.54 -4.52 -0.26 1.22 2.03 -0.93 -4.82 116.55 104.73 2fa3 n ASP 387 Ca 0.19 -1.19 -0.02 0.00 0.52 0.00 0.00 54.79 54.29 2fa3 n ASP 387 Cb 0.62 -2.36 0.10 0.00 -0.72 0.00 0.00 41.12 38.75 2fa3 n ASP 387 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2fa3 h VAL 388 N -2.34 1.06 -0.04 5.18 2.07 -1.88 -2.56 116.25 117.75 2fa3 h VAL 388 Ca -0.70 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 2fa3 h VAL 388 Cb 1.39 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 2fa3 h VAL 388 CO 0.51 0.16 0.02 1.23 0.02 0.00 0.00 177.57 179.50 2fa3 h GLY 389 N 0.86 0.06 0.91 2.17 0.00 -1.95 -0.82 103.07 104.30 2fa3 h GLY 389 Ca 0.31 -0.03 0.07 0.00 0.00 0.00 0.00 47.33 47.68 2fa3 h GLY 389 CO -0.13 0.03 0.53 -1.33 0.00 0.00 0.00 176.54 175.63 2fa3 h GLY 390 N -0.03 1.11 1.24 4.60 0.00 -1.92 -1.71 103.07 106.37 2fa3 h GLY 390 Ca 0.01 -0.34 -0.34 0.00 0.00 0.00 0.00 47.33 46.66 2fa3 h GLY 390 CO -0.00 0.24 -1.50 0.50 0.00 0.00 0.00 176.54 175.77 2fa3 h LYS 391 N 0.84 0.53 -0.39 4.80 1.57 -0.96 -2.58 116.57 120.38 2fa3 h LYS 391 Ca 0.36 -0.91 0.08 0.00 -1.87 0.00 0.00 60.65 58.31 2fa3 h LYS 391 Cb 0.29 0.34 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 2fa3 h LYS 391 CO -0.13 1.43 0.27 -0.07 -0.57 0.00 0.00 179.45 180.38 2fa3 h LEU 392 N 0.14 0.14 -0.03 2.94 3.38 -0.91 -1.36 115.31 119.61 2fa3 h LEU 392 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2fa3 h LEU 392 Cb 2.17 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.89 2fa3 h LEU 392 CO 0.27 0.09 0.00 0.11 0.09 0.00 0.00 178.44 179.00 2fa3 h LYS 393 N 0.16 0.00 -0.62 1.13 1.57 -1.07 -3.31 116.57 114.43 2fa3 h LYS 393 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2fa3 h LYS 393 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 2fa3 h LYS 393 CO -0.03 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.85 2fa3 n ALA 394 N -1.81 2.99 -1.66 3.86 0.00 -0.51 -4.98 120.51 118.39 2fa3 n ALA 394 Ca 0.05 -1.15 -0.29 0.00 0.00 0.00 0.00 53.44 52.06 2fa3 n ALA 394 Cb 0.43 -1.03 0.12 0.00 0.00 0.00 0.00 19.45 18.97 2fa3 n ALA 394 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2fa3 s ARG 395 N -1.80 1.44 -0.21 0.00 0.52 -1.25 -4.88 118.95 112.78 2fa3 s ARG 395 Ca 0.37 0.24 -0.04 0.00 -0.52 0.00 0.00 55.73 55.78 2fa3 s ARG 395 Cb 0.24 -1.88 0.10 0.00 0.52 0.00 0.00 34.95 33.94 2fa3 s ARG 395 CO 0.17 -1.98 0.29 -1.01 0.02 0.00 0.00 175.30 172.79 2fa3 s HIS 396 N -3.38 -0.50 0.46 -0.53 3.76 -0.56 -5.01 115.29 109.53 2fa3 s HIS 396 Ca 0.63 0.58 -0.21 0.00 -0.15 0.00 0.00 55.06 55.91 2fa3 s HIS 396 Cb -0.13 -0.17 -0.10 0.00 1.11 0.00 0.00 32.58 33.29 2fa3 s HIS 396 CO 0.52 -0.60 1.00 -2.00 -0.85 0.00 0.00 174.74 172.80 2fa3 s GLU 397 N 2.42 4.01 0.10 1.40 2.12 -1.26 -2.53 118.70 124.97 2fa3 s GLU 397 Ca 0.08 1.25 0.10 0.00 0.36 0.00 0.00 54.97 56.76 2fa3 s GLU 397 Cb -0.15 -2.15 -0.04 0.00 0.26 0.00 0.00 34.13 32.06 2fa3 s GLU 397 CO -0.13 -0.23 -0.26 0.71 -0.54 0.00 0.00 175.26 174.81 2fa3 s TYR 398 N -2.07 2.23 0.30 5.30 4.12 0.10 -4.88 117.35 122.45 2fa3 s TYR 398 Ca 0.65 -0.39 -0.29 0.00 0.02 0.00 0.00 57.07 57.05 2fa3 s TYR 398 Cb -0.13 -1.25 -0.10 0.00 -1.52 0.00 0.00 41.96 38.97 2fa3 s TYR 398 CO 0.17 0.26 1.13 0.00 0.02 0.00 0.00 175.55 177.12 2fa3 s ALA 399 N -0.99 3.39 0.45 3.71 0.00 -1.26 -4.44 121.76 122.62 2fa3 s ALA 399 Ca 0.12 0.94 0.32 0.00 0.00 0.00 0.00 51.96 53.35 2fa3 s ALA 399 Cb -0.10 -3.35 1.48 0.00 0.00 0.00 0.00 23.12 21.16 2fa3 s ALA 399 CO 0.05 -0.24 1.60 -1.35 0.00 0.00 0.00 175.76 175.81 2fa3 h PRO 400 N 3.65 0.03 -0.46 0.00 0.11 -1.92 -0.19 132.00 133.22 2fa3 h PRO 400 Ca -0.47 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.64 2fa3 h PRO 400 Cb 1.21 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2fa3 h PRO 400 CO 0.66 0.02 0.30 0.93 -0.21 0.00 0.00 178.00 179.70 2fa3 h GLU 401 N 0.03 0.59 -0.26 1.05 4.39 -1.97 -0.16 114.58 118.26 2fa3 h GLU 401 Ca 0.86 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 60.43 2fa3 h GLU 401 Cb 2.78 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 31.29 2fa3 h GLU 401 CO -0.43 0.39 -0.20 -0.22 -1.16 0.00 0.00 179.01 177.39 2fa3 h LYS 402 N 0.61 0.59 -0.75 2.33 3.64 -1.42 -2.17 116.57 119.40 2fa3 h LYS 402 Ca 0.17 -0.29 0.11 0.00 -1.27 0.00 0.00 60.65 59.37 2fa3 h LYS 402 Cb -0.06 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 31.64 2fa3 h LYS 402 CO -0.05 0.88 -0.44 0.35 -2.27 0.00 0.00 179.45 177.92 2fa3 h PHE 403 N 0.30 -1.28 -0.01 1.91 3.57 -1.33 0.14 116.94 120.23 2fa3 h PHE 403 Ca 0.05 0.09 0.03 0.00 3.53 0.00 0.00 57.97 61.67 2fa3 h PHE 403 Cb 0.74 0.67 -0.04 0.00 2.79 0.00 0.00 35.95 40.11 2fa3 h PHE 403 CO 0.07 -0.41 -0.20 0.28 -2.23 0.00 0.00 178.31 175.82 2fa3 h VAL 404 N -0.13 0.53 -0.64 1.41 2.07 -0.84 0.92 116.25 119.56 2fa3 h VAL 404 Ca 0.22 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.88 2fa3 h VAL 404 Cb 0.55 0.53 -0.10 0.00 -1.52 0.00 0.00 31.29 30.75 2fa3 h VAL 404 CO -0.80 0.00 0.08 -0.33 0.02 0.00 0.00 177.57 176.54 2fa3 h GLU 405 N -0.31 0.19 -0.18 1.57 5.08 -0.68 -0.38 114.58 119.86 2fa3 h GLU 405 Ca 0.06 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.44 2fa3 h GLU 405 Cb 0.39 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 2fa3 h GLU 405 CO -0.19 0.13 -0.01 1.15 -1.00 0.00 0.00 179.01 179.08 2fa3 h THR 406 N 0.19 0.86 -0.66 1.13 2.02 0.04 -0.92 112.91 115.57 2fa3 h THR 406 Ca 0.35 -0.02 0.13 0.00 0.77 0.00 0.00 66.41 67.64 2fa3 h THR 406 Cb 0.56 0.81 -0.10 0.00 -1.74 0.00 0.00 68.15 67.68 2fa3 h THR 406 CO -0.49 0.01 0.12 0.24 0.37 0.00 0.00 175.52 175.77 2fa3 h MET 407 N 0.05 0.23 -0.31 6.66 2.86 0.77 0.44 114.93 125.63 2fa3 h MET 407 Ca 0.09 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.77 2fa3 h MET 407 Cb 0.11 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.67 2fa3 h MET 407 CO -0.15 0.15 0.00 0.87 1.06 0.00 0.00 176.91 178.84 2fa3 h LYS 408 N 0.24 0.09 -0.24 1.72 1.57 -0.96 -0.11 116.57 118.88 2fa3 h LYS 408 Ca 0.36 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.17 2fa3 h LYS 408 Cb 0.57 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.83 2fa3 h LYS 408 CO -0.47 0.06 -0.01 1.25 -0.57 0.00 0.00 179.45 179.71 2fa3 h LEU 409 N 0.09 -0.12 -1.22 2.94 5.85 0.00 -2.71 115.31 120.15 2fa3 h LEU 409 Ca 0.15 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.86 2fa3 h LEU 409 Cb 0.19 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 2fa3 h LEU 409 CO -0.24 -0.03 -0.11 0.24 -0.34 0.00 0.00 178.44 177.96 2fa3 h MET 410 N 0.06 0.41 -0.83 1.25 2.86 -0.48 0.84 114.93 119.04 2fa3 h MET 410 Ca 0.11 -0.10 0.09 0.00 -2.06 0.00 0.00 59.70 57.74 2fa3 h MET 410 Cb 0.15 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.70 2fa3 h MET 410 CO -0.20 0.52 0.54 1.49 1.06 0.00 0.00 176.91 180.33 2fa3 h GLU 411 N 0.38 0.79 0.00 1.72 4.81 -0.72 -2.08 114.58 119.48 2fa3 h GLU 411 Ca 0.08 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2fa3 h GLU 411 Cb 0.43 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2fa3 h GLU 411 CO 0.02 0.52 0.00 0.45 -0.73 0.00 0.00 179.01 179.27 2fa3 h HIS 412 N 0.81 0.00 0.00 0.92 3.86 -0.61 -3.33 115.15 116.80 2fa3 h HIS 412 Ca 0.38 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.59 2fa3 h HIS 412 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2fa3 h HIS 412 CO -0.00 0.00 -0.91 0.54 0.86 0.00 0.00 177.93 178.41 2fa3 n ARG 413 N -3.07 1.61 -2.07 2.45 1.74 -0.82 -4.58 116.66 111.91 2fa3 n ARG 413 Ca 0.03 -0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.65 2fa3 n ARG 413 Cb 0.43 -1.26 -0.03 0.00 -1.02 0.00 0.00 32.46 30.58 2fa3 n ARG 413 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2fa3 s TYR 414 N -2.59 2.10 0.00 -1.55 5.04 -0.99 -2.07 117.35 117.29 2fa3 s TYR 414 Ca 0.04 0.36 0.00 0.00 -2.44 0.00 0.00 57.07 55.03 2fa3 s TYR 414 Cb 0.12 -3.87 0.00 0.00 0.35 0.00 0.00 41.96 38.55 2fa3 s TYR 414 CO 0.65 -3.42 0.00 0.41 -1.34 0.00 0.00 175.55 171.84 2fa3 n GLY 415 N 4.17 0.45 3.93 8.97 0.00 -1.26 -5.01 105.19 116.44 2fa3 n GLY 415 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 2fa3 n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fa3 s ALA 416 N -2.18 3.55 0.38 4.61 0.00 -0.88 -5.12 121.76 122.12 2fa3 s ALA 416 Ca 0.00 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.21 2fa3 s ALA 416 Cb 0.00 -2.35 -0.06 0.00 0.00 0.00 0.00 23.12 20.71 2fa3 s ALA 416 CO 0.00 -0.37 0.04 -1.59 0.00 0.00 0.00 175.76 173.84 2fa3 s LYS 417 N -4.64 1.85 -1.02 0.00 -2.85 -1.26 -4.94 119.74 106.88 2fa3 s LYS 417 Ca 0.47 -2.07 -0.14 0.00 -1.00 0.00 0.00 55.97 53.24 2fa3 s LYS 417 Cb -0.10 -1.19 -0.01 0.00 -2.06 0.00 0.00 37.83 34.47 2fa3 s LYS 417 CO 0.41 -0.19 0.76 -1.91 0.10 0.00 0.00 175.35 174.53 2fa3 n GLU 418 N -0.87 -1.34 -4.17 1.78 2.13 0.10 -4.92 120.64 113.35 2fa3 n GLU 418 Ca -0.05 0.69 -0.11 0.00 0.66 0.00 0.00 57.16 58.35 2fa3 n GLU 418 Cb 0.67 -4.25 -0.10 0.00 0.27 0.00 0.00 31.44 28.03 2fa3 n GLU 418 CO 0.00 0.00 0.00 -0.59 -0.41 0.00 0.00 177.13 176.13 2fa3 s PHE 419 N -3.32 0.89 -0.08 4.31 -0.12 -0.33 -4.96 117.98 114.39 2fa3 s PHE 419 Ca 0.33 -0.98 0.02 0.00 -0.05 0.00 0.00 56.93 56.25 2fa3 s PHE 419 Cb -0.11 -0.53 -0.02 0.00 -0.63 0.00 0.00 43.02 41.73 2fa3 s PHE 419 CO 0.84 -0.22 -0.13 0.08 -0.05 0.00 0.00 175.22 175.73 2fa3 s VAL 420 N -3.71 3.11 0.29 -2.49 1.01 -1.26 -1.71 120.40 115.64 2fa3 s VAL 420 Ca 0.14 -0.69 -0.28 0.00 0.00 0.00 0.00 61.98 61.16 2fa3 s VAL 420 Cb 0.06 -2.25 -0.09 0.00 0.00 0.00 0.00 36.38 34.10 2fa3 s VAL 420 CO -0.03 0.57 0.99 0.42 0.00 0.00 0.00 175.10 177.05 2fa3 s THR 421 N -0.40 3.94 -0.39 3.92 -4.23 -0.43 -4.97 115.64 113.07 2fa3 s THR 421 Ca 0.05 1.80 -0.27 0.00 -1.18 0.00 0.00 61.69 62.09 2fa3 s THR 421 Cb -0.12 -4.09 0.02 0.00 1.34 0.00 0.00 72.50 69.65 2fa3 s THR 421 CO 0.02 0.32 0.99 -0.55 -0.54 0.00 0.00 174.62 174.86 2fa3 s SER 422 N -1.27 6.69 0.14 3.99 0.15 -1.26 -4.92 113.70 117.22 2fa3 s SER 422 Ca 0.46 0.57 0.17 0.00 0.70 0.00 0.00 55.95 57.85 2fa3 s SER 422 Cb -0.25 -2.49 -0.06 0.00 -1.71 0.00 0.00 66.02 61.51 2fa3 s SER 422 CO 0.31 -0.96 1.03 0.11 1.20 0.00 0.00 173.24 174.94 2fa3 h LYS 423 N 8.63 0.00 -6.11 5.44 1.57 -1.97 -3.46 116.57 120.66 2fa3 h LYS 423 Ca -0.23 0.00 -0.75 0.00 -1.87 0.00 0.00 60.65 57.80 2fa3 h LYS 423 Cb 1.07 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.43 2fa3 h LYS 423 CO 1.02 0.32 0.30 0.39 -0.57 0.00 0.00 179.45 180.91 2fa3 n GLU 424 N -2.96 0.51 0.00 3.15 -0.58 -1.26 -1.35 120.64 118.14 2fa3 n GLU 424 Ca -0.05 0.18 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 2fa3 n GLU 424 Cb 0.78 -1.75 0.00 0.00 -0.57 0.00 0.00 31.44 29.90 2fa3 n GLU 424 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2fa3 n GLY 425 N 2.20 1.30 0.20 0.62 0.00 -1.26 -4.68 105.19 103.57 2fa3 n GLY 425 Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 2fa3 n GLY 425 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2fa3 n ILE 426 N -1.96 1.42 -0.25 -0.61 5.41 -0.46 -4.44 119.36 118.47 2fa3 n ILE 426 Ca 0.00 -0.16 0.06 0.00 1.00 0.00 0.00 62.75 63.65 2fa3 n ILE 426 Cb 0.00 -2.01 0.18 0.00 -0.71 0.00 0.00 39.64 37.10 2fa3 n ILE 426 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2fa3 h LEU 427 N -0.91 -0.13 -2.17 1.39 5.85 -1.57 0.32 115.31 118.08 2fa3 h LEU 427 Ca -0.40 0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.55 2fa3 h LEU 427 Cb 1.31 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 2fa3 h LEU 427 CO -0.24 -0.11 0.22 -2.24 -0.34 0.00 0.00 178.44 175.73 2fa3 h ASP 428 N 0.19 0.00 0.59 1.25 3.04 -1.82 -1.68 116.42 117.98 2fa3 h ASP 428 Ca 0.42 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.21 2fa3 h ASP 428 Cb 0.75 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.04 2fa3 h ASP 428 CO -0.58 0.00 0.00 0.18 -2.04 0.00 0.00 179.24 176.80 2fa3 n LEU 429 N -3.93 0.14 -4.78 0.15 4.77 0.11 -4.86 117.00 108.62 2fa3 n LEU 429 Ca 0.02 0.53 -0.33 0.00 -0.03 0.00 0.00 56.01 56.21 2fa3 n LEU 429 Cb 0.35 -0.51 -0.07 0.00 -2.33 0.00 0.00 43.42 40.86 2fa3 n LEU 429 CO 0.29 -0.30 -0.25 -0.76 -1.33 0.00 0.00 177.39 175.04 2fa3 s LEU 430 N -3.31 3.88 0.35 2.23 1.43 -0.63 -4.88 118.68 117.74 2fa3 s LEU 430 Ca 0.07 0.14 -0.27 0.00 -1.03 0.00 0.00 54.13 53.04 2fa3 s LEU 430 Cb 0.10 -2.24 -0.12 0.00 0.03 0.00 0.00 46.19 43.96 2fa3 s LEU 430 CO 0.31 0.28 1.19 0.00 0.23 0.00 0.00 176.35 178.36 2fa3 n ALA 431 N 1.23 0.85 -1.63 4.21 0.00 -1.26 -4.87 120.51 119.03 2fa3 n ALA 431 Ca -0.13 0.34 -0.47 0.00 0.00 0.00 0.00 53.44 53.17 2fa3 n ALA 431 Cb 0.53 -2.19 -0.04 0.00 0.00 0.00 0.00 19.45 17.75 2fa3 n ALA 431 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2fa3 n PRO 432 N 0.47 1.69 -0.28 0.00 -0.02 -1.26 -1.82 135.00 133.78 2fa3 n PRO 432 Ca 0.06 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2fa3 n PRO 432 Cb 0.36 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2fa3 n PRO 432 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fa3 n GLY 433 N 2.35 0.73 3.77 -1.23 0.00 -1.26 -4.92 105.19 104.62 2fa3 n GLY 433 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2fa3 n GLY 433 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fa3 s THR 434 N -2.62 2.80 -0.04 2.61 2.01 -0.75 -4.22 115.64 115.43 2fa3 s THR 434 Ca 0.00 0.71 -0.19 0.00 0.31 0.00 0.00 61.69 62.52 2fa3 s THR 434 Cb 0.00 -3.42 -0.05 0.00 0.01 0.00 0.00 72.50 69.04 2fa3 s THR 434 CO 0.00 0.10 0.54 -0.31 -0.69 0.00 0.00 174.62 174.26 2fa3 s TYR 435 N -1.29 3.63 0.01 4.92 1.51 -1.26 -2.33 117.35 122.55 2fa3 s TYR 435 Ca 0.56 1.08 0.01 0.00 -1.01 0.00 0.00 57.07 57.72 2fa3 s TYR 435 Cb -0.36 -2.56 -0.01 0.00 -0.11 0.00 0.00 41.96 38.92 2fa3 s TYR 435 CO 0.46 0.32 -0.05 1.52 -1.11 0.00 0.00 175.55 176.69 2fa3 s TYR 436 N -0.02 0.46 -0.17 2.71 -0.85 -0.09 -4.74 117.35 114.66 2fa3 s TYR 436 Ca 0.29 -0.26 -0.29 0.00 -0.52 0.00 0.00 57.07 56.28 2fa3 s TYR 436 Cb -0.17 -0.29 -0.04 0.00 0.38 0.00 0.00 41.96 41.83 2fa3 s TYR 436 CO 0.15 -0.05 1.82 -1.17 -1.52 0.00 0.00 175.55 174.77 2fa3 s LEU 437 N -0.75 3.90 -0.14 -3.49 2.96 0.45 0.46 118.68 122.08 2fa3 s LEU 437 Ca -0.04 1.89 -0.24 0.00 -0.22 0.00 0.00 54.13 55.52 2fa3 s LEU 437 Cb -0.05 -3.53 -0.21 0.00 0.50 0.00 0.00 46.19 42.90 2fa3 s LEU 437 CO -0.00 -1.37 0.61 0.11 -1.32 0.00 0.00 176.35 174.38 2fa3 h LYS 438 N 11.65 0.00 -2.87 1.98 1.57 -1.11 -3.44 116.57 124.36 2fa3 h LYS 438 Ca -0.38 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.41 2fa3 h LYS 438 Cb 1.19 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.38 2fa3 h LYS 438 CO 0.98 0.82 0.26 -1.83 -0.57 0.00 0.00 179.45 179.12 2fa3 s GLU 439 N -2.11 1.27 -0.20 3.15 -1.05 -1.10 -1.31 118.70 117.35 2fa3 s GLU 439 Ca -0.16 -0.51 -0.01 0.00 -0.15 0.00 0.00 54.97 54.14 2fa3 s GLU 439 Cb -0.02 0.55 0.01 0.00 -0.44 0.00 0.00 34.13 34.24 2fa3 s GLU 439 CO 0.56 -0.56 -0.14 0.08 0.95 0.00 0.00 175.26 176.15 2fa3 s VAL 440 N -3.66 2.51 0.98 1.83 1.01 -0.69 -1.81 120.40 120.56 2fa3 s VAL 440 Ca 0.03 -0.84 -0.16 0.00 0.00 0.00 0.00 61.98 61.01 2fa3 s VAL 440 Cb -0.02 -2.11 0.21 0.00 0.00 0.00 0.00 36.38 34.46 2fa3 s VAL 440 CO -0.09 0.46 1.33 1.51 0.00 0.00 0.00 175.10 178.30 2fa3 s ASP 441 N 1.34 2.98 0.00 3.32 1.47 -0.88 0.02 116.67 124.92 2fa3 s ASP 441 Ca 0.04 0.25 0.21 0.00 1.18 0.00 0.00 52.55 54.24 2fa3 s ASP 441 Cb -0.14 -0.27 1.07 0.00 -0.34 0.00 0.00 42.92 43.24 2fa3 s ASP 441 CO -0.09 -2.82 1.69 -1.54 0.68 0.00 0.00 175.17 173.09 2fa3 n SER 442 N -3.82 0.00 -1.38 2.11 3.41 -1.26 -1.26 113.62 111.42 2fa3 n SER 442 Ca 0.16 0.02 0.08 0.00 -0.26 0.00 0.00 58.87 58.87 2fa3 n SER 442 Cb 0.59 -0.30 0.33 0.00 -0.26 0.00 0.00 64.21 64.57 2fa3 n SER 442 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2fa3 n LEU 443 N -1.30 4.75 0.00 1.04 4.77 -1.26 -4.85 117.00 120.15 2fa3 n LEU 443 Ca 0.10 -2.89 0.00 0.00 -0.03 0.00 0.00 56.01 53.18 2fa3 n LEU 443 Cb 0.18 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2fa3 n LEU 443 CO 0.17 0.67 0.00 -1.22 -1.33 0.00 0.00 177.39 175.68 2fa3 n TYR 444 N 0.17 0.00 -2.20 -1.77 4.02 -0.39 -4.99 117.16 112.00 2fa3 n TYR 444 Ca 0.24 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.73 2fa3 n TYR 444 Cb 1.01 -1.90 -0.03 0.00 -0.02 0.00 0.00 39.34 38.41 2fa3 n TYR 444 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2fa3 s ARG 445 N -1.90 4.42 -0.02 -0.72 0.52 -1.26 -4.74 118.95 115.26 2fa3 s ARG 445 Ca 0.00 2.12 -0.01 0.00 -0.52 0.00 0.00 55.73 57.32 2fa3 s ARG 445 Cb 0.00 -3.10 -0.04 0.00 0.52 0.00 0.00 34.95 32.33 2fa3 s ARG 445 CO 0.00 -0.09 0.08 1.03 0.02 0.00 0.00 175.30 176.33 2fa3 s ARG 446 N -1.71 3.08 -0.05 3.54 0.52 -1.26 -2.08 118.95 120.99 2fa3 s ARG 446 Ca 0.48 -0.46 -0.01 0.00 -0.52 0.00 0.00 55.73 55.22 2fa3 s ARG 446 Cb -0.38 -2.87 0.03 0.00 0.52 0.00 0.00 34.95 32.24 2fa3 s ARG 446 CO 0.50 0.66 -0.00 -0.06 0.02 0.00 0.00 175.30 176.42 2fa3 s PHE 447 N -1.16 0.56 -0.03 -0.53 0.40 -0.75 -5.04 117.98 111.43 2fa3 s PHE 447 Ca 0.22 -0.11 0.05 0.00 -0.60 0.00 0.00 56.93 56.49 2fa3 s PHE 447 Cb -0.12 -0.67 -0.02 0.00 0.51 0.00 0.00 43.02 42.72 2fa3 s PHE 447 CO 0.13 -0.25 -0.18 0.71 0.70 0.00 0.00 175.22 176.33 2fa3 s TYR 448 N 1.58 2.59 0.35 0.36 1.51 -1.26 -0.48 117.35 121.99 2fa3 s TYR 448 Ca -0.01 -0.24 0.07 0.00 -1.01 0.00 0.00 57.07 55.88 2fa3 s TYR 448 Cb -0.13 -1.58 -0.02 0.00 -0.11 0.00 0.00 41.96 40.12 2fa3 s TYR 448 CO -0.03 0.13 0.32 0.20 -1.11 0.00 0.00 175.55 175.06 2fa3 s GLY 449 N -0.76 1.81 0.47 0.71 0.00 0.17 -4.86 107.32 104.87 2fa3 s GLY 449 Ca 0.11 -1.67 0.04 0.00 0.00 0.00 0.00 44.72 43.21 2fa3 s GLY 449 CO 0.00 -1.57 0.03 1.25 0.00 0.00 0.00 173.10 172.81 2fa3 s LYS 450 N -4.03 2.11 0.00 2.90 2.20 -1.26 -0.91 119.74 120.74 2fa3 s LYS 450 Ca 0.42 -2.25 0.00 0.00 -0.36 0.00 0.00 55.97 53.78 2fa3 s LYS 450 Cb -0.06 -1.61 0.00 0.00 -1.51 0.00 0.00 37.83 34.65 2fa3 s LYS 450 CO 0.27 -0.24 0.00 1.17 -0.36 0.00 0.00 175.35 176.19