#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ftj s THR 5 N 0.00 3.98 -0.20 0.00 2.01 -1.26 -4.64 115.64 115.52 1ftj s THR 5 Ca 0.00 1.27 -0.29 0.00 0.31 0.00 0.00 61.69 62.98 1ftj s THR 5 Cb 0.00 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.68 1ftj s THR 5 CO 0.00 -0.06 1.40 -0.69 -0.69 0.00 0.00 174.62 174.58 1ftj s VAL 6 N 3.01 4.02 -0.24 3.82 1.01 0.42 -4.85 120.40 127.60 1ftj s VAL 6 Ca 0.61 1.20 -0.27 0.00 0.00 0.00 0.00 61.98 63.51 1ftj s VAL 6 Cb -0.27 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.20 1ftj s VAL 6 CO 0.22 -0.26 0.96 -0.69 0.00 0.00 0.00 175.10 175.33 1ftj s VAL 7 N 4.21 4.74 -0.24 2.92 1.01 -1.26 -0.74 120.40 131.03 1ftj s VAL 7 Ca 0.61 1.85 -0.09 0.00 0.00 0.00 0.00 61.98 64.35 1ftj s VAL 7 Cb -0.22 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.88 1ftj s VAL 7 CO 0.22 -0.15 0.11 -0.69 0.00 0.00 0.00 175.10 174.59 1ftj s VAL 8 N 3.07 4.77 -0.13 2.92 1.01 0.76 -1.07 120.40 131.73 1ftj s VAL 8 Ca 0.41 -0.02 -0.13 0.00 0.00 0.00 0.00 61.98 62.23 1ftj s VAL 8 Cb -0.15 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 1ftj s VAL 8 CO 0.07 0.35 0.30 0.28 0.00 0.00 0.00 175.10 176.09 1ftj s THR 9 N 1.31 5.28 0.21 3.92 -1.32 0.55 0.02 115.64 125.62 1ftj s THR 9 Ca 0.06 0.56 0.03 0.00 -1.21 0.00 0.00 61.69 61.13 1ftj s THR 9 Cb -0.15 -3.62 -0.01 0.00 -1.51 0.00 0.00 72.50 67.21 1ftj s THR 9 CO 0.05 0.44 0.21 1.07 -2.21 0.00 0.00 174.62 174.18 1ftj n THR 10 N 3.14 0.00 -4.11 5.08 5.66 0.42 -2.40 114.28 122.07 1ftj n THR 10 Ca -0.13 -1.37 -0.15 0.00 -3.05 0.00 0.00 64.05 59.35 1ftj n THR 10 Cb 0.52 0.72 -0.14 0.00 -1.55 0.00 0.00 70.33 69.88 1ftj n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1ftj s ILE 11 N -2.78 0.34 -0.87 1.09 2.07 -1.26 -0.25 121.20 119.54 1ftj s ILE 11 Ca 0.22 -0.18 -0.25 0.00 -1.41 0.00 0.00 60.65 59.03 1ftj s ILE 11 Cb 0.01 -0.29 -0.00 0.00 0.13 0.00 0.00 42.46 42.30 1ftj s ILE 11 CO 0.16 0.10 1.68 -0.76 -1.91 0.00 0.00 174.94 174.20 1ftj s LEU 12 N -0.09 3.29 -0.13 8.50 1.43 -1.26 -4.24 118.68 126.18 1ftj s LEU 12 Ca 0.02 -0.72 -0.04 0.00 -1.03 0.00 0.00 54.13 52.35 1ftj s LEU 12 Cb -0.02 -2.56 0.05 0.00 0.03 0.00 0.00 46.19 43.70 1ftj s LEU 12 CO -0.00 -2.16 0.09 -0.70 0.23 0.00 0.00 176.35 173.81 1ftj s GLU 13 N 6.18 0.02 0.37 1.70 2.56 -0.81 -4.99 118.70 123.74 1ftj s GLU 13 Ca 0.57 0.08 -0.26 0.00 0.00 0.00 0.00 54.97 55.36 1ftj s GLU 13 Cb -0.06 -1.38 -0.09 0.00 2.00 0.00 0.00 34.13 34.60 1ftj s GLU 13 CO 0.02 -0.56 1.13 -1.12 -0.56 0.00 0.00 175.26 174.17 1ftj s SER 14 N 2.16 6.79 -0.12 -1.70 0.01 -1.26 -0.93 113.70 118.66 1ftj s SER 14 Ca 0.03 2.26 0.13 0.00 1.31 0.00 0.00 55.95 59.68 1ftj s SER 14 Cb -0.15 -2.61 0.58 0.00 0.21 0.00 0.00 66.02 64.05 1ftj s SER 14 CO -0.07 -0.48 1.44 -0.81 0.41 0.00 0.00 173.24 173.72 1ftj n PRO 15 N 0.36 3.38 0.15 12.44 -0.04 -1.26 -4.93 135.00 145.11 1ftj n PRO 15 Ca 0.03 -2.27 -0.14 0.00 -0.04 0.00 0.00 63.50 61.08 1ftj n PRO 15 Cb 0.47 -1.86 -0.08 0.00 -0.04 0.00 0.00 33.50 31.99 1ftj n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1ftj h TYR 16 N 3.14 -0.36 -3.16 0.54 0.05 -1.36 -0.75 116.97 115.07 1ftj h TYR 16 Ca 0.00 -0.01 -0.25 0.00 0.05 0.00 0.00 58.73 58.52 1ftj h TYR 16 Cb 1.32 0.12 -0.33 0.00 1.01 0.00 0.00 36.73 38.85 1ftj h TYR 16 CO 0.67 -0.06 -0.60 0.08 -1.05 0.00 0.00 178.16 177.21 1ftj s VAL 17 N -5.00 -0.14 0.03 -2.88 1.01 -0.81 -0.96 120.40 111.65 1ftj s VAL 17 Ca -0.15 0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.02 1ftj s VAL 17 Cb 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 36.12 1ftj s VAL 17 CO 0.58 0.10 0.11 -0.04 0.00 0.00 0.00 175.10 175.84 1ftj s MET 18 N 1.61 0.56 0.05 2.72 -1.94 -0.30 -1.92 119.30 120.09 1ftj s MET 18 Ca -0.05 -0.66 -0.31 0.00 -1.71 0.00 0.00 55.69 52.97 1ftj s MET 18 Cb -0.12 0.22 -0.05 0.00 2.01 0.00 0.00 34.83 36.89 1ftj s MET 18 CO -0.06 -0.14 1.18 1.41 -0.01 0.00 0.00 175.02 177.40 1ftj s MET 19 N -2.26 4.44 0.59 2.03 1.75 -1.26 -1.95 119.30 122.65 1ftj s MET 19 Ca -0.08 1.74 -0.18 0.00 -1.25 0.00 0.00 55.69 55.92 1ftj s MET 19 Cb -0.03 -3.36 -0.03 0.00 2.84 0.00 0.00 34.83 34.25 1ftj s MET 19 CO -0.03 -0.24 1.17 0.21 -0.65 0.00 0.00 175.02 175.47 1ftj s LYS 20 N 1.07 3.04 0.16 4.11 2.20 -0.23 -4.87 119.74 125.22 1ftj s LYS 20 Ca 0.58 1.68 -0.31 0.00 -0.36 0.00 0.00 55.97 57.57 1ftj s LYS 20 Cb -0.29 -1.95 -0.06 0.00 -1.51 0.00 0.00 37.83 34.02 1ftj s LYS 20 CO 0.29 -1.12 1.54 0.87 -0.36 0.00 0.00 175.35 176.58 1ftj h LYS 21 N 0.82 -0.07 -0.85 4.03 1.57 -1.94 -2.17 116.57 117.95 1ftj h LYS 21 Ca -0.50 0.01 -0.58 0.00 -1.87 0.00 0.00 60.65 57.71 1ftj h LYS 21 Cb 1.28 0.02 -0.32 0.00 0.08 0.00 0.00 32.23 33.28 1ftj h LYS 21 CO 0.55 -0.05 0.17 0.09 -0.57 0.00 0.00 179.45 179.65 1ftj n ASN 22 N -5.29 6.04 -0.27 0.86 5.03 -1.26 -4.79 115.26 115.58 1ftj n ASN 22 Ca 0.01 -3.77 0.32 0.00 0.87 0.00 0.00 54.58 52.02 1ftj n ASN 22 Cb 0.28 -0.71 0.72 0.00 -1.02 0.00 0.00 39.78 39.05 1ftj n ASN 22 CO 0.00 0.00 0.00 1.12 -1.83 0.00 0.00 177.26 176.55 1ftj h HIS 23 N 1.92 0.06 0.00 3.10 -0.00 -1.66 0.25 115.15 118.82 1ftj h HIS 23 Ca 0.49 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.86 1ftj h HIS 23 Cb 1.25 -0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 28.65 1ftj h HIS 23 CO 1.20 0.01 -0.01 1.05 -0.00 0.00 0.00 177.93 180.17 1ftj h GLU 24 N 0.03 0.00 -0.02 5.12 4.11 -1.86 -1.05 114.58 120.91 1ftj h GLU 24 Ca 0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.95 1ftj h GLU 24 Cb 2.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.27 1ftj h GLU 24 CO -0.03 0.01 -0.27 -1.33 0.07 0.00 0.00 179.01 177.46 1ftj n MET 25 N -3.23 1.61 -3.82 1.06 2.81 0.08 -4.97 117.12 110.66 1ftj n MET 25 Ca -0.02 -1.30 -0.23 0.00 -1.81 0.00 0.00 57.70 54.34 1ftj n MET 25 Cb 0.13 -1.47 -0.04 0.00 -0.71 0.00 0.00 33.22 31.13 1ftj n MET 25 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1ftj s LEU 26 N -2.29 3.20 0.14 4.03 1.43 -0.40 -5.15 118.68 119.64 1ftj s LEU 26 Ca 0.23 -0.93 0.06 0.00 -1.03 0.00 0.00 54.13 52.45 1ftj s LEU 26 Cb 0.19 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1ftj s LEU 26 CO 0.46 -0.67 -0.13 -1.61 0.23 0.00 0.00 176.35 174.64 1ftj s GLU 27 N -4.06 1.06 3.85 1.70 2.02 -1.26 -4.82 118.70 117.17 1ftj s GLU 27 Ca 0.44 -1.33 0.00 0.00 0.02 0.00 0.00 54.97 54.10 1ftj s GLU 27 Cb -0.00 -0.84 0.00 0.00 0.10 0.00 0.00 34.13 33.39 1ftj s GLU 27 CO 0.25 0.14 0.00 0.41 0.02 0.00 0.00 175.26 176.08 1ftj n GLY 28 N 0.25 3.13 0.24 -1.39 0.00 -1.26 -1.84 105.19 104.32 1ftj n GLY 28 Ca -0.13 0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.07 1ftj n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ftj h ASN 29 N 0.00 0.00 0.40 1.61 2.35 -1.93 -2.84 115.58 115.18 1ftj h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ftj h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1ftj h ASN 29 CO 0.00 0.18 0.00 -0.62 -1.65 0.00 0.00 177.43 175.34 1ftj n GLU 30 N -3.69 0.08 0.25 0.81 -0.58 -0.77 -2.53 120.64 114.22 1ftj n GLU 30 Ca -0.01 0.21 0.14 0.00 -0.42 0.00 0.00 57.16 57.08 1ftj n GLU 30 Cb 0.30 -1.50 0.44 0.00 -0.57 0.00 0.00 31.44 30.11 1ftj n GLU 30 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ftj h ARG 31 N 0.00 0.00 -6.13 3.49 3.08 -1.60 -3.45 114.38 109.77 1ftj h ARG 31 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 1ftj h ARG 31 Cb 0.20 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.16 1ftj h ARG 31 CO 0.00 0.03 -0.61 0.71 -1.07 0.00 0.00 179.97 179.03 1ftj s TYR 32 N -3.46 2.65 0.06 3.04 2.02 -1.05 -1.07 117.35 119.53 1ftj s TYR 32 Ca 0.04 -0.32 -0.15 0.00 -0.37 0.00 0.00 57.07 56.27 1ftj s TYR 32 Cb 0.07 -1.38 0.02 0.00 -0.40 0.00 0.00 41.96 40.27 1ftj s TYR 32 CO 0.61 0.51 0.33 -1.83 -1.57 0.00 0.00 175.55 173.60 1ftj s GLU 33 N -3.73 0.88 0.00 -0.62 -1.05 -0.82 -4.81 118.70 108.55 1ftj s GLU 33 Ca 0.34 -0.55 0.00 0.00 -0.15 0.00 0.00 54.97 54.61 1ftj s GLU 33 Cb -0.04 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.03 1ftj s GLU 33 CO 0.20 -0.30 0.00 0.41 0.95 0.00 0.00 175.26 176.53 1ftj n GLY 34 N 0.38 1.44 0.17 -3.83 0.00 -1.26 -1.14 105.19 100.95 1ftj n GLY 34 Ca -0.18 -1.73 -0.06 0.00 0.00 0.00 0.00 46.02 44.06 1ftj n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ftj h TYR 35 N 0.00 0.34 0.00 1.61 5.03 -0.42 -1.04 116.97 122.49 1ftj h TYR 35 Ca 0.00 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.29 1ftj h TYR 35 Cb 0.00 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.18 1ftj h TYR 35 CO 0.00 0.17 -0.19 0.00 -1.32 0.00 0.00 178.16 176.82 1ftj h VAL 37 N 0.00 1.41 -0.74 0.00 2.07 -1.41 -0.28 116.25 117.30 1ftj h VAL 37 Ca -0.00 -1.75 -0.04 0.00 0.82 0.00 0.00 66.70 65.73 1ftj h VAL 37 Cb 0.76 2.29 -0.03 0.00 -1.52 0.00 0.00 31.29 32.78 1ftj h VAL 37 CO 0.02 0.51 0.32 0.44 0.02 0.00 0.00 177.57 178.89 1ftj h ASP 38 N -0.08 1.00 -0.56 0.57 3.45 -0.97 -2.32 116.42 117.52 1ftj h ASP 38 Ca -0.02 -0.16 -0.10 0.00 0.43 0.00 0.00 57.03 57.18 1ftj h ASP 38 Cb 1.02 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.51 1ftj h ASP 38 CO 0.08 0.88 -0.03 0.25 -1.57 0.00 0.00 179.24 178.84 1ftj h LEU 39 N 1.06 0.99 -0.54 1.55 5.85 -0.94 -2.63 115.31 120.64 1ftj h LEU 39 Ca 0.25 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ftj h LEU 39 Cb 0.17 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1ftj h LEU 39 CO -0.03 1.07 0.36 0.00 -0.34 0.00 0.00 178.44 179.50 1ftj h ALA 40 N 0.95 0.69 -0.83 1.25 0.00 -0.84 0.46 119.26 120.94 1ftj h ALA 40 Ca 0.15 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ftj h ALA 40 Cb 0.58 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1ftj h ALA 40 CO 0.03 0.13 0.54 0.00 0.00 0.00 0.00 179.25 179.96 1ftj h ALA 41 N 1.19 1.08 -0.05 0.00 0.00 -1.36 -1.48 119.26 118.64 1ftj h ALA 41 Ca 0.20 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1ftj h ALA 41 Cb -0.08 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.41 1ftj h ALA 41 CO -0.04 0.41 -0.21 0.93 0.00 0.00 0.00 179.25 180.33 1ftj h GLU 42 N 1.08 0.23 -0.85 0.00 4.39 -1.05 -2.45 114.58 115.93 1ftj h GLU 42 Ca 0.32 -0.18 0.04 0.00 0.34 0.00 0.00 59.36 59.87 1ftj h GLU 42 Cb -0.05 0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.58 1ftj h GLU 42 CO -0.09 0.83 0.56 0.82 -1.16 0.00 0.00 179.01 179.96 1ftj h ILE 43 N -0.31 1.14 -0.41 3.13 2.04 -0.88 -1.25 117.51 120.97 1ftj h ILE 43 Ca -0.01 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.41 1ftj h ILE 43 Cb 0.86 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1ftj h ILE 43 CO 0.04 0.19 -0.03 0.00 0.00 0.00 0.00 178.15 178.36 1ftj h ALA 44 N 1.51 0.55 0.14 1.87 0.00 -1.30 0.39 119.26 122.41 1ftj h ALA 44 Ca 0.34 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ftj h ALA 44 Cb 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ftj h ALA 44 CO -0.10 0.36 -0.07 0.87 0.00 0.00 0.00 179.25 180.31 1ftj h LYS 45 N 0.56 -0.18 -0.15 0.00 1.57 -0.91 0.73 116.57 118.18 1ftj h LYS 45 Ca 0.11 0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.82 1ftj h LYS 45 Cb 0.52 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1ftj h LYS 45 CO 0.03 -0.12 -0.28 0.45 -0.57 0.00 0.00 179.45 178.96 1ftj h HIS 46 N -0.19 0.30 0.00 -1.35 3.86 -1.20 -2.82 115.15 113.75 1ftj h HIS 46 Ca -0.02 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1ftj h HIS 46 Cb 0.15 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.54 1ftj h HIS 46 CO -0.07 0.53 -0.50 0.00 0.86 0.00 0.00 177.93 178.75 1ftj n GLY 48 N 1.48 0.55 3.20 0.00 0.00 0.11 -5.05 105.19 105.48 1ftj n GLY 48 Ca 0.05 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 1ftj n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ftj s PHE 49 N -3.08 1.14 0.05 1.61 -0.12 -0.37 -5.04 117.98 112.17 1ftj s PHE 49 Ca 0.14 -0.69 -0.07 0.00 -0.05 0.00 0.00 56.93 56.27 1ftj s PHE 49 Cb -0.06 -0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 41.67 1ftj s PHE 49 CO 0.19 0.03 0.33 -1.59 -0.05 0.00 0.00 175.22 174.12 1ftj s LYS 50 N -3.09 3.64 0.16 1.99 0.00 -1.26 -4.58 119.74 116.61 1ftj s LYS 50 Ca 0.09 -0.00 -0.04 0.00 0.00 0.00 0.00 55.97 56.02 1ftj s LYS 50 Cb -0.01 -3.02 -0.03 0.00 0.00 0.00 0.00 37.83 34.77 1ftj s LYS 50 CO 0.00 0.59 0.17 1.52 0.00 0.00 0.00 175.35 177.63 1ftj s TYR 51 N -1.39 0.76 -0.08 1.78 1.13 -1.26 -0.44 117.35 117.85 1ftj s TYR 51 Ca 0.31 -1.10 -0.01 0.00 -1.41 0.00 0.00 57.07 54.87 1ftj s TYR 51 Cb -0.13 -0.33 0.03 0.00 -1.10 0.00 0.00 41.96 40.43 1ftj s TYR 51 CO 0.18 -0.64 -0.02 0.21 -2.51 0.00 0.00 175.55 172.77 1ftj s LYS 52 N -4.05 0.88 0.11 -3.49 2.20 0.08 -4.87 119.74 110.60 1ftj s LYS 52 Ca 0.25 -0.01 -0.30 0.00 -0.36 0.00 0.00 55.97 55.56 1ftj s LYS 52 Cb 0.06 -1.14 -0.06 0.00 -1.51 0.00 0.00 37.83 35.17 1ftj s LYS 52 CO 0.04 -0.28 1.09 -0.51 -0.36 0.00 0.00 175.35 175.34 1ftj s LEU 53 N 1.84 4.44 -0.02 5.43 1.43 -1.26 -0.17 118.68 130.36 1ftj s LEU 53 Ca 0.04 1.98 0.01 0.00 -1.03 0.00 0.00 54.13 55.13 1ftj s LEU 53 Cb -0.12 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.52 1ftj s LEU 53 CO -0.06 -0.28 -0.04 -0.89 0.23 0.00 0.00 176.35 175.32 1ftj s THR 54 N 0.31 0.42 -0.08 5.49 2.01 0.10 -4.89 115.64 119.00 1ftj s THR 54 Ca 0.52 -0.13 -0.23 0.00 0.31 0.00 0.00 61.69 62.16 1ftj s THR 54 Cb -0.28 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 1ftj s THR 54 CO 0.32 0.16 0.68 -0.63 -0.69 0.00 0.00 174.62 174.46 1ftj s ILE 55 N 0.45 5.05 -0.03 1.82 -1.09 -1.26 -0.44 121.20 125.71 1ftj s ILE 55 Ca -0.05 1.40 -0.36 0.00 -2.23 0.00 0.00 60.65 59.40 1ftj s ILE 55 Cb -0.09 -4.02 -0.15 0.00 -1.58 0.00 0.00 42.46 36.62 1ftj s ILE 55 CO -0.00 0.24 1.61 0.55 -1.23 0.00 0.00 174.94 176.11 1ftj n VAL 56 N 3.84 0.20 -0.21 2.92 3.14 0.65 -4.86 118.33 124.01 1ftj n VAL 56 Ca -0.02 -0.04 0.01 0.00 -2.96 0.00 0.00 64.34 61.34 1ftj n VAL 56 Cb 0.51 -1.30 0.13 0.00 -1.06 0.00 0.00 33.84 32.12 1ftj n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1ftj h GLY 57 N 6.51 0.89 -0.38 7.55 0.00 -1.93 -1.69 103.07 114.01 1ftj h GLY 57 Ca -0.47 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1ftj h GLY 57 CO 0.88 -0.07 0.00 2.09 0.00 0.00 0.00 176.54 179.45 1ftj n ASP 58 N -5.04 1.19 -2.04 0.19 3.85 -1.26 -4.92 116.55 108.52 1ftj n ASP 58 Ca 0.10 -1.59 -0.21 0.00 -0.71 0.00 0.00 54.79 52.38 1ftj n ASP 58 Cb 0.32 -0.06 -0.04 0.00 -1.35 0.00 0.00 41.12 39.98 1ftj n ASP 58 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ftj n GLY 59 N 1.05 0.49 3.68 6.12 0.00 -0.64 -4.97 105.19 110.91 1ftj n GLY 59 Ca 0.16 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 1ftj n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ftj s LYS 60 N -4.52 2.18 -0.14 1.61 1.02 -1.26 -5.00 119.74 113.62 1ftj s LYS 60 Ca 0.00 -1.72 -0.22 0.00 0.02 0.00 0.00 55.97 54.05 1ftj s LYS 60 Cb 0.00 -1.99 -0.19 0.00 -0.52 0.00 0.00 37.83 35.12 1ftj s LYS 60 CO 0.00 0.08 0.51 1.88 -0.92 0.00 0.00 175.35 176.90 1ftj h TYR 61 N 1.67 0.00 0.00 3.18 -1.99 -1.90 -2.67 116.97 115.26 1ftj h TYR 61 Ca -0.43 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.30 1ftj h TYR 61 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.98 1ftj h TYR 61 CO 0.67 0.85 0.00 0.41 -0.00 0.00 0.00 178.16 180.09 1ftj n GLY 62 N 1.62 2.97 3.18 3.88 0.00 -1.26 -1.67 105.19 113.91 1ftj n GLY 62 Ca -0.11 -0.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 1ftj n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ftj s ALA 63 N 0.00 -0.59 -0.08 4.61 0.00 -1.24 -4.77 121.76 119.68 1ftj s ALA 63 Ca 0.00 0.13 -0.17 0.00 0.00 0.00 0.00 51.96 51.92 1ftj s ALA 63 Cb 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 1ftj s ALA 63 CO 0.00 -0.24 0.45 0.50 0.00 0.00 0.00 175.76 176.47 1ftj s ARG 64 N -1.35 4.22 -0.28 0.00 3.52 -1.26 -1.24 118.95 122.56 1ftj s ARG 64 Ca -0.14 0.43 -0.26 0.00 -0.13 0.00 0.00 55.73 55.64 1ftj s ARG 64 Cb -0.06 -3.37 0.00 0.00 -1.56 0.00 0.00 34.95 29.96 1ftj s ARG 64 CO 0.03 0.33 0.89 0.34 -0.81 0.00 0.00 175.30 176.08 1ftj s ASP 65 N 0.07 6.82 0.27 -2.12 -1.08 -0.37 -4.94 116.67 115.33 1ftj s ASP 65 Ca 0.25 0.94 0.00 0.00 -0.52 0.00 0.00 52.55 53.22 1ftj s ASP 65 Cb -0.16 -2.46 0.56 0.00 -1.46 0.00 0.00 42.92 39.40 1ftj s ASP 65 CO 0.11 -0.64 1.80 0.00 0.52 0.00 0.00 175.17 176.95 1ftj h ALA 66 N 7.90 1.41 0.12 3.66 0.00 -1.95 0.30 119.26 130.69 1ftj h ALA 66 Ca -0.22 0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.53 1ftj h ALA 66 Cb 1.08 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.79 1ftj h ALA 66 CO 0.92 0.05 -0.90 0.38 0.00 0.00 0.00 179.25 179.70 1ftj h ASP 67 N 0.80 0.59 1.23 0.00 -0.00 -1.99 -3.38 116.42 113.67 1ftj h ASP 67 Ca 0.49 -0.89 -0.00 0.00 -0.00 0.00 0.00 57.03 56.63 1ftj h ASP 67 Cb 0.60 -0.19 -0.00 0.00 -0.00 0.00 0.00 39.33 39.74 1ftj h ASP 67 CO -0.32 1.42 -0.77 0.00 -0.00 0.00 0.00 179.24 179.58 1ftj h THR 68 N -0.16 0.01 0.00 1.15 1.03 -1.94 -3.48 112.91 109.52 1ftj h THR 68 Ca -0.15 -1.02 0.00 0.00 -0.01 0.00 0.00 66.41 65.23 1ftj h THR 68 Cb 1.66 1.63 0.00 0.00 -1.07 0.00 0.00 68.15 70.37 1ftj h THR 68 CO 0.17 0.01 0.00 0.29 -0.01 0.00 0.00 175.52 175.98 1ftj n LYS 69 N -2.78 -1.38 -3.02 0.00 4.76 0.10 -4.97 118.16 110.86 1ftj n LYS 69 Ca 0.01 0.35 -0.38 0.00 -2.87 0.00 0.00 58.31 55.42 1ftj n LYS 69 Cb 0.55 -4.55 -0.06 0.00 -1.84 0.00 0.00 35.03 29.13 1ftj n LYS 69 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1ftj s ILE 70 N -1.25 4.45 -0.12 -0.18 1.01 -1.26 -4.66 121.20 119.19 1ftj s ILE 70 Ca 0.00 1.53 -0.18 0.00 0.00 0.00 0.00 60.65 62.00 1ftj s ILE 70 Cb 0.00 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 1ftj s ILE 70 CO 0.00 0.37 0.47 0.26 0.00 0.00 0.00 174.94 176.05 1ftj s TRP 71 N -1.33 3.51 0.32 3.97 0.52 -1.26 -1.23 118.94 123.44 1ftj s TRP 71 Ca 0.39 0.88 0.04 0.00 0.02 0.00 0.00 56.10 57.43 1ftj s TRP 71 Cb -0.20 -2.55 0.04 0.00 -1.15 0.00 0.00 33.47 29.61 1ftj s TRP 71 CO 0.24 0.16 0.32 0.27 0.02 0.00 0.00 176.95 177.96 1ftj n ASN 72 N 3.71 1.68 -0.14 2.95 0.23 -0.37 -4.19 115.26 119.12 1ftj n ASN 72 Ca -0.07 -2.00 0.00 0.00 -0.53 0.00 0.00 54.58 51.98 1ftj n ASN 72 Cb 0.52 -0.11 0.00 0.00 -2.08 0.00 0.00 39.78 38.10 1ftj n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ftj n GLY 73 N 1.11 0.11 0.37 4.83 0.00 -1.26 -1.44 105.19 108.92 1ftj n GLY 73 Ca 0.03 -0.97 -0.00 0.00 0.00 0.00 0.00 46.02 45.08 1ftj n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1ftj h MET 74 N 0.00 1.23 -0.46 1.61 2.86 -0.95 -2.14 114.93 117.08 1ftj h MET 74 Ca 0.00 -0.07 0.04 0.00 -2.06 0.00 0.00 59.70 57.61 1ftj h MET 74 Cb 0.00 -0.28 -0.04 0.00 0.06 0.00 0.00 31.60 31.34 1ftj h MET 74 CO 0.00 0.81 0.21 0.28 1.06 0.00 0.00 176.91 179.27 1ftj h VAL 75 N 1.26 0.93 -0.82 -2.22 2.07 -1.58 -1.90 116.25 113.98 1ftj h VAL 75 Ca 0.38 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.75 1ftj h VAL 75 Cb -0.05 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 1ftj h VAL 75 CO -0.11 0.08 0.48 1.23 0.02 0.00 0.00 177.57 179.27 1ftj h GLY 76 N 0.42 1.21 2.00 2.17 0.00 -0.63 0.34 103.07 108.58 1ftj h GLY 76 Ca 0.20 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1ftj h GLY 76 CO -0.17 0.50 -0.10 0.83 0.00 0.00 0.00 176.54 177.61 1ftj h GLU 77 N 1.14 0.00 0.14 4.80 5.08 -0.78 -0.34 114.58 124.62 1ftj h GLU 77 Ca 0.29 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.46 1ftj h GLU 77 Cb -0.02 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.26 1ftj h GLU 77 CO -0.05 0.10 -0.83 -0.07 -1.00 0.00 0.00 179.01 177.16 1ftj h LEU 78 N 0.00 0.48 -0.97 1.33 4.07 -0.77 0.65 115.31 120.10 1ftj h LEU 78 Ca -0.00 -0.95 -0.02 0.00 0.08 0.00 0.00 57.88 56.99 1ftj h LEU 78 Cb 0.18 -0.16 -0.04 0.00 1.08 0.00 0.00 40.66 41.72 1ftj h LEU 78 CO 0.01 1.40 0.44 0.58 -1.08 0.00 0.00 178.44 179.79 1ftj h VAL 79 N -0.35 1.25 -0.45 1.22 2.07 -0.48 -2.42 116.25 117.09 1ftj h VAL 79 Ca -0.14 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1ftj h VAL 79 Cb 1.65 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1ftj h VAL 79 CO 0.16 0.28 0.00 -1.22 0.02 0.00 0.00 177.57 176.81 1ftj n TYR 80 N -4.33 0.59 -1.19 1.57 4.01 -0.18 -4.95 117.16 112.68 1ftj n TYR 80 Ca 0.09 -0.30 -0.07 0.00 -0.16 0.00 0.00 57.90 57.46 1ftj n TYR 80 Cb 0.11 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.11 1ftj n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ftj n GLY 81 N 1.39 0.89 0.14 2.72 0.00 -0.91 -4.92 105.19 104.52 1ftj n GLY 81 Ca 0.19 -0.70 0.02 0.00 0.00 0.00 0.00 46.02 45.53 1ftj n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ftj h LYS 82 N 0.03 0.00 -5.00 1.61 1.79 -0.03 -3.46 116.57 111.51 1ftj h LYS 82 Ca -0.14 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.02 1ftj h LYS 82 Cb 0.45 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 30.95 1ftj h LYS 82 CO 0.20 0.55 -0.72 0.00 -1.08 0.00 0.00 179.45 178.41 1ftj s ALA 83 N -3.25 1.29 -0.12 3.86 0.00 -0.25 -4.97 121.76 118.32 1ftj s ALA 83 Ca 0.01 -1.38 0.20 0.00 0.00 0.00 0.00 51.96 50.79 1ftj s ALA 83 Cb 0.10 0.05 -0.23 0.00 0.00 0.00 0.00 23.12 23.04 1ftj s ALA 83 CO 0.74 -0.09 0.54 -0.25 0.00 0.00 0.00 175.76 176.70 1ftj n ASP 84 N 0.07 0.31 -3.53 0.00 8.00 -0.23 -4.43 116.55 116.74 1ftj n ASP 84 Ca -0.12 0.13 -0.17 0.00 0.71 0.00 0.00 54.79 55.33 1ftj n ASP 84 Cb 0.60 1.14 -0.06 0.00 -0.02 0.00 0.00 41.12 42.78 1ftj n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1ftj s ILE 85 N -3.13 0.00 -0.19 0.53 2.07 -1.09 -4.21 121.20 115.17 1ftj s ILE 85 Ca -0.06 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.19 1ftj s ILE 85 Cb 0.10 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.72 1ftj s ILE 85 CO 0.85 0.00 -0.18 0.00 -1.91 0.00 0.00 174.94 173.70 1ftj s ALA 86 N -1.01 2.38 -0.49 1.50 0.00 0.07 -0.33 121.76 123.88 1ftj s ALA 86 Ca -0.09 -1.32 0.03 0.00 0.00 0.00 0.00 51.96 50.58 1ftj s ALA 86 Cb -0.01 -1.26 0.13 0.00 0.00 0.00 0.00 23.12 21.98 1ftj s ALA 86 CO 0.09 -0.50 0.24 0.42 0.00 0.00 0.00 175.76 176.01 1ftj s ILE 87 N 1.26 2.73 0.27 0.00 1.01 -1.01 -1.84 121.20 123.62 1ftj s ILE 87 Ca 0.03 -3.00 -0.17 0.00 0.00 0.00 0.00 60.65 57.51 1ftj s ILE 87 Cb -0.14 -2.90 0.01 0.00 0.01 0.00 0.00 42.46 39.44 1ftj s ILE 87 CO -0.12 -0.76 0.61 0.00 0.00 0.00 0.00 174.94 174.67 1ftj s ALA 88 N 0.07 -0.74 -1.28 9.38 0.00 -1.26 -4.63 121.76 123.30 1ftj s ALA 88 Ca 0.15 -0.59 -0.10 0.00 0.00 0.00 0.00 51.96 51.42 1ftj s ALA 88 Cb -0.23 0.95 -0.07 0.00 0.00 0.00 0.00 23.12 23.77 1ftj s ALA 88 CO -0.02 -0.95 2.48 -0.35 0.00 0.00 0.00 175.76 176.92 1ftj n PRO 89 N -0.43 2.84 -3.36 0.00 -0.04 -1.26 -4.68 135.00 128.07 1ftj n PRO 89 Ca -0.03 -1.96 -0.41 0.00 -0.04 0.00 0.00 63.50 61.06 1ftj n PRO 89 Cb 0.60 -2.75 -0.09 0.00 -0.04 0.00 0.00 33.50 31.22 1ftj n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ftj s LEU 90 N 0.50 4.51 0.18 1.53 2.96 -1.26 -5.03 118.68 122.07 1ftj s LEU 90 Ca 0.55 -0.29 -0.31 0.00 -0.22 0.00 0.00 54.13 53.87 1ftj s LEU 90 Cb 0.14 -2.39 -0.09 0.00 0.50 0.00 0.00 46.19 44.35 1ftj s LEU 90 CO -0.04 -0.41 1.39 -0.89 -1.32 0.00 0.00 176.35 175.07 1ftj s THR 91 N 2.11 3.07 -0.35 3.68 2.01 -1.26 -1.73 115.64 123.16 1ftj s THR 91 Ca 0.13 0.83 -0.29 0.00 0.31 0.00 0.00 61.69 62.67 1ftj s THR 91 Cb -0.16 -3.53 0.00 0.00 0.01 0.00 0.00 72.50 68.82 1ftj s THR 91 CO 0.12 0.10 1.38 -0.63 -0.69 0.00 0.00 174.62 174.90 1ftj s ILE 92 N 0.49 3.99 0.23 1.82 1.01 -0.15 -4.87 121.20 123.71 1ftj s ILE 92 Ca 0.61 1.07 0.06 0.00 0.00 0.00 0.00 60.65 62.39 1ftj s ILE 92 Cb -0.38 -4.15 -0.05 0.00 0.01 0.00 0.00 42.46 37.88 1ftj s ILE 92 CO 0.36 -0.61 -0.09 0.42 0.00 0.00 0.00 174.94 175.02 1ftj s THR 93 N 4.97 1.51 0.09 2.92 -4.23 -1.26 -4.71 115.64 114.93 1ftj s THR 93 Ca 0.60 -2.13 -0.20 0.00 -1.18 0.00 0.00 61.69 58.77 1ftj s THR 93 Cb -0.16 -2.20 -0.09 0.00 1.34 0.00 0.00 72.50 71.40 1ftj s THR 93 CO 0.28 -0.47 1.64 0.25 -0.54 0.00 0.00 174.62 175.78 1ftj h LEU 94 N 2.48 0.27 -1.79 4.79 5.85 -1.98 -1.02 115.31 123.92 1ftj h LEU 94 Ca -0.38 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.15 1ftj h LEU 94 Cb 1.22 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 1ftj h LEU 94 CO 0.64 0.35 -0.14 -0.37 -0.34 0.00 0.00 178.44 178.59 1ftj h VAL 95 N 0.17 0.99 0.22 1.05 -1.51 -2.00 -2.42 116.25 112.75 1ftj h VAL 95 Ca 0.07 -0.49 -0.29 0.00 -1.23 0.00 0.00 66.70 64.76 1ftj h VAL 95 Cb 0.17 1.27 0.03 0.00 -2.13 0.00 0.00 31.29 30.63 1ftj h VAL 95 CO -0.01 0.13 -1.28 0.03 -1.23 0.00 0.00 177.57 175.22 1ftj h ARG 96 N 0.00 0.46 0.00 5.19 3.08 -1.93 -3.29 114.38 117.89 1ftj h ARG 96 Ca -0.00 -0.79 0.00 0.00 0.07 0.00 0.00 59.98 59.26 1ftj h ARG 96 Cb 0.26 0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1ftj h ARG 96 CO 0.02 1.38 0.00 -1.91 -1.07 0.00 0.00 179.97 178.38 1ftj n GLU 97 N -3.85 0.15 0.16 0.04 2.13 -0.40 -0.74 120.64 118.13 1ftj n GLU 97 Ca -0.16 0.52 0.13 0.00 0.66 0.00 0.00 57.16 58.31 1ftj n GLU 97 Cb 1.01 -1.87 0.34 0.00 0.27 0.00 0.00 31.44 31.19 1ftj n GLU 97 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1ftj h GLU 98 N 0.00 0.00 0.00 5.31 5.08 -1.52 -3.36 114.58 120.10 1ftj h GLU 98 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ftj h GLU 98 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1ftj h GLU 98 CO 0.00 0.00 -0.86 1.33 -1.00 0.00 0.00 179.01 178.48 1ftj n VAL 99 N -2.61 0.00 -4.25 3.13 0.24 0.08 -5.08 118.33 109.84 1ftj n VAL 99 Ca 0.04 -0.03 -0.14 0.00 -2.04 0.00 0.00 64.34 62.18 1ftj n VAL 99 Cb 0.45 0.49 -0.10 0.00 -1.47 0.00 0.00 33.84 33.21 1ftj n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1ftj s ILE 100 N -1.77 0.55 0.01 1.34 -4.36 -0.08 -4.09 121.20 112.81 1ftj s ILE 100 Ca 0.00 -1.98 -0.01 0.00 -0.26 0.00 0.00 60.65 58.40 1ftj s ILE 100 Cb 0.00 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.41 1ftj s ILE 100 CO 0.00 -0.33 0.17 -1.81 0.24 0.00 0.00 174.94 173.20 1ftj s ASP 101 N -3.19 6.21 0.02 4.36 1.01 -0.18 -4.29 116.67 120.61 1ftj s ASP 101 Ca 0.28 0.27 0.06 0.00 0.71 0.00 0.00 52.55 53.87 1ftj s ASP 101 Cb 0.07 -1.90 -0.02 0.00 1.01 0.00 0.00 42.92 42.08 1ftj s ASP 101 CO 0.06 0.24 -0.18 -0.36 0.21 0.00 0.00 175.17 175.15 1ftj s PHE 102 N -1.35 1.55 0.95 4.23 0.08 -1.26 -1.12 117.98 121.06 1ftj s PHE 102 Ca 0.28 -0.34 -0.15 0.00 0.12 0.00 0.00 56.93 56.85 1ftj s PHE 102 Cb -0.13 -0.95 0.17 0.00 -0.57 0.00 0.00 43.02 41.55 1ftj s PHE 102 CO 0.20 0.04 1.21 -1.54 -0.10 0.00 0.00 175.22 175.03 1ftj s SER 103 N -0.89 3.18 0.80 1.36 1.04 -0.30 -4.95 113.70 113.94 1ftj s SER 103 Ca 0.06 0.62 -0.12 0.00 0.48 0.00 0.00 55.95 56.99 1ftj s SER 103 Cb -0.08 -0.93 0.08 0.00 0.10 0.00 0.00 66.02 65.19 1ftj s SER 103 CO 0.01 -2.73 1.14 -0.54 0.98 0.00 0.00 173.24 172.11 1ftj s LYS 104 N -5.58 1.85 0.33 4.02 -0.14 -1.26 -4.55 119.74 114.40 1ftj s LYS 104 Ca 0.68 1.49 -0.29 0.00 -1.36 0.00 0.00 55.97 56.49 1ftj s LYS 104 Cb -0.09 -1.83 -0.12 0.00 -1.68 0.00 0.00 37.83 34.12 1ftj s LYS 104 CO 0.53 -2.00 1.49 -0.35 -0.76 0.00 0.00 175.35 174.25 1ftj n PRO 105 N -3.44 2.55 0.00 -1.68 -0.04 -1.26 -4.63 135.00 126.50 1ftj n PRO 105 Ca 0.11 0.90 0.11 0.00 -0.04 0.00 0.00 63.50 64.58 1ftj n PRO 105 Cb 0.52 -2.62 -0.01 0.00 -0.04 0.00 0.00 33.50 31.35 1ftj n PRO 105 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1ftj n PHE 106 N 1.08 0.00 -3.69 0.54 1.16 -0.25 -4.93 117.46 111.36 1ftj n PHE 106 Ca 0.05 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.51 1ftj n PHE 106 Cb 0.37 -0.07 -0.09 0.00 -1.61 0.00 0.00 39.48 38.08 1ftj n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1ftj s MET 107 N -3.00 0.56 -0.12 3.97 0.00 -1.25 -4.97 119.30 114.49 1ftj s MET 107 Ca 0.09 0.78 -0.05 0.00 0.00 0.00 0.00 55.69 56.51 1ftj s MET 107 Cb 0.16 0.20 -0.04 0.00 0.00 0.00 0.00 34.83 35.16 1ftj s MET 107 CO 0.82 -0.10 0.06 -1.12 0.00 0.00 0.00 175.02 174.69 1ftj s SER 108 N 0.68 5.74 0.21 1.11 0.01 -1.26 -1.63 113.70 118.54 1ftj s SER 108 Ca -0.03 0.25 -0.05 0.00 1.31 0.00 0.00 55.95 57.42 1ftj s SER 108 Cb -0.05 -1.79 0.02 0.00 0.21 0.00 0.00 66.02 64.41 1ftj s SER 108 CO -0.05 0.35 0.36 0.00 0.41 0.00 0.00 173.24 174.31 1ftj n LEU 109 N 2.38 0.00 -3.51 2.44 -0.00 -0.40 -4.90 117.00 113.01 1ftj n LEU 109 Ca -0.19 -1.48 -0.11 0.00 -0.00 0.00 0.00 56.01 54.23 1ftj n LEU 109 Cb 0.54 1.81 -0.03 0.00 -0.00 0.00 0.00 43.42 45.73 1ftj n LEU 109 CO 0.31 -0.42 0.63 -0.83 -0.00 0.00 0.00 177.39 177.07 1ftj s GLY 110 N -2.16 -0.46 0.35 1.47 0.00 -1.26 -1.06 107.32 104.20 1ftj s GLY 110 Ca 0.12 1.21 -0.28 0.00 0.00 0.00 0.00 44.72 45.77 1ftj s GLY 110 CO 0.09 0.55 1.31 -0.42 0.00 0.00 0.00 173.10 174.63 1ftj s ILE 111 N -2.49 2.69 0.30 0.90 1.01 -1.26 0.31 121.20 122.65 1ftj s ILE 111 Ca 0.01 0.67 0.02 0.00 0.00 0.00 0.00 60.65 61.35 1ftj s ILE 111 Cb -0.01 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.04 1ftj s ILE 111 CO -0.05 0.14 0.34 -1.54 0.00 0.00 0.00 174.94 173.84 1ftj n SER 112 N 0.60 -0.92 -4.44 3.58 3.41 0.76 0.02 113.62 116.63 1ftj n SER 112 Ca 0.01 -2.78 -0.33 0.00 -0.26 0.00 0.00 58.87 55.50 1ftj n SER 112 Cb 0.42 1.86 -0.13 0.00 -0.26 0.00 0.00 64.21 66.10 1ftj n SER 112 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1ftj s ILE 113 N -2.97 3.38 -0.22 -1.33 1.01 -1.25 -2.20 121.20 117.62 1ftj s ILE 113 Ca 0.30 -0.55 -0.04 0.00 0.00 0.00 0.00 60.65 60.36 1ftj s ILE 113 Cb 0.00 -2.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 1ftj s ILE 113 CO 0.21 0.52 -0.02 -0.32 0.00 0.00 0.00 174.94 175.33 1ftj s MET 114 N 0.19 3.45 0.25 2.79 -2.45 0.11 -1.44 119.30 122.20 1ftj s MET 114 Ca -0.06 -0.59 0.12 0.00 -1.25 0.00 0.00 55.69 53.91 1ftj s MET 114 Cb -0.15 -3.05 -0.05 0.00 1.25 0.00 0.00 34.83 32.84 1ftj s MET 114 CO 0.04 -0.14 -0.20 0.96 1.05 0.00 0.00 175.02 176.73 1ftj s ILE 115 N 1.37 2.53 0.15 10.11 -4.36 -0.55 -0.68 121.20 129.76 1ftj s ILE 115 Ca 0.04 -2.25 -0.30 0.00 -0.26 0.00 0.00 60.65 57.88 1ftj s ILE 115 Cb -0.14 -2.30 -0.07 0.00 1.25 0.00 0.00 42.46 41.20 1ftj s ILE 115 CO -0.01 -0.31 1.13 -0.75 0.24 0.00 0.00 174.94 175.23 1ftj s LYS 116 N -3.27 4.55 0.08 0.37 2.47 -1.26 -1.29 119.74 121.39 1ftj s LYS 116 Ca 0.27 1.73 -0.36 0.00 -1.56 0.00 0.00 55.97 56.06 1ftj s LYS 116 Cb -0.06 -3.29 -0.16 0.00 -1.46 0.00 0.00 37.83 32.86 1ftj s LYS 116 CO 0.14 -0.02 1.44 1.63 0.16 0.00 0.00 175.35 178.70 1ftj n LYS 117 N 2.75 1.45 0.00 4.03 5.02 0.45 -1.81 118.16 130.05 1ftj n LYS 117 Ca 0.04 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.86 1ftj n LYS 117 Cb 0.46 -2.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.26 1ftj n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ftj n GLY 118 N 2.90 0.27 3.70 0.72 0.00 -1.26 -4.98 105.19 106.54 1ftj n GLY 118 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1ftj n GLY 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ftj s THR 119 N -2.00 3.52 -0.74 2.61 2.01 -0.75 -4.88 115.64 115.41 1ftj s THR 119 Ca 0.00 1.04 -0.05 0.00 0.31 0.00 0.00 61.69 62.99 1ftj s THR 119 Cb 0.00 -3.66 -0.06 0.00 0.01 0.00 0.00 72.50 68.79 1ftj s THR 119 CO 0.00 0.05 2.02 -2.65 -0.69 0.00 0.00 174.62 173.34 1ftj n PRO 120 N 4.51 1.80 -3.87 4.92 -0.02 -1.26 -4.79 135.00 136.29 1ftj n PRO 120 Ca 0.12 -1.27 -0.19 0.00 -2.02 0.00 0.00 63.50 60.14 1ftj n PRO 120 Cb 0.43 -2.34 -0.17 0.00 -0.02 0.00 0.00 33.50 31.41 1ftj n PRO 120 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ftj s ILE 121 N 3.38 0.18 -0.17 4.25 -1.09 -1.26 -5.02 121.20 121.47 1ftj s ILE 121 Ca 0.36 0.14 0.05 0.00 -2.23 0.00 0.00 60.65 58.96 1ftj s ILE 121 Cb 0.10 -0.31 -0.05 0.00 -1.58 0.00 0.00 42.46 40.61 1ftj s ILE 121 CO -0.03 0.17 0.18 -0.62 -1.23 0.00 0.00 174.94 173.41 1ftj n GLU 122 N 4.50 4.36 -3.83 2.79 -0.58 -1.26 -4.94 120.64 121.68 1ftj n GLU 122 Ca -0.19 -0.01 -0.07 0.00 -0.42 0.00 0.00 57.16 56.47 1ftj n GLU 122 Cb 0.50 -0.80 0.02 0.00 -0.57 0.00 0.00 31.44 30.59 1ftj n GLU 122 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1ftj s SER 123 N -1.67 -0.03 0.21 1.62 1.04 -1.26 -3.22 113.70 110.40 1ftj s SER 123 Ca 0.01 -0.93 -0.02 0.00 0.48 0.00 0.00 55.95 55.48 1ftj s SER 123 Cb 0.03 0.73 0.17 0.00 0.10 0.00 0.00 66.02 67.05 1ftj s SER 123 CO 0.19 -1.43 1.56 0.00 0.98 0.00 0.00 173.24 174.54 1ftj h ALA 124 N 2.00 0.79 -0.72 5.32 0.00 -1.95 -2.65 119.26 122.05 1ftj h ALA 124 Ca -0.29 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.17 1ftj h ALA 124 Cb 1.24 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1ftj h ALA 124 CO 0.37 0.66 0.46 1.49 0.00 0.00 0.00 179.25 182.23 1ftj h GLU 125 N 0.47 0.88 -0.55 0.00 4.81 -1.96 -1.64 114.58 116.60 1ftj h GLU 125 Ca 0.03 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1ftj h GLU 125 Cb 0.97 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 30.11 1ftj h GLU 125 CO 0.09 0.58 0.31 -0.44 -0.73 0.00 0.00 179.01 178.82 1ftj h ASP 126 N 0.91 0.49 -0.38 1.04 3.45 -1.89 -1.51 116.42 118.54 1ftj h ASP 126 Ca 0.28 0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.75 1ftj h ASP 126 Cb -0.02 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 38.65 1ftj h ASP 126 CO -0.09 0.34 0.23 -0.07 -1.57 0.00 0.00 179.24 178.08 1ftj h LEU 127 N 0.61 0.45 -0.87 1.55 3.38 -1.06 -3.03 115.31 116.34 1ftj h LEU 127 Ca 0.23 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1ftj h LEU 127 Cb 0.07 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1ftj h LEU 127 CO -0.12 0.36 0.43 0.77 0.09 0.00 0.00 178.44 179.96 1ftj h SER 128 N 0.50 1.12 0.00 -0.43 4.64 -1.00 -3.01 113.55 115.37 1ftj h SER 128 Ca 0.14 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1ftj h SER 128 Cb -0.01 -0.29 0.00 0.00 -0.31 0.00 0.00 62.40 61.79 1ftj h SER 128 CO -0.03 0.94 0.00 0.29 -0.87 0.00 0.00 176.83 177.16 1ftj n LYS 129 N -4.31 0.78 -3.98 4.77 5.02 -0.60 -4.86 118.16 114.99 1ftj n LYS 129 Ca 0.09 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.29 1ftj n LYS 129 Cb 0.13 -1.09 -0.05 0.00 -0.02 0.00 0.00 35.03 34.00 1ftj n LYS 129 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1ftj s GLN 130 N -1.77 1.54 0.00 1.97 1.03 -1.14 -5.07 119.66 116.22 1ftj s GLN 130 Ca 0.00 -1.22 0.00 0.00 0.04 0.00 0.00 55.36 54.18 1ftj s GLN 130 Cb 0.00 0.48 0.00 0.00 0.03 0.00 0.00 33.01 33.52 1ftj s GLN 130 CO 0.00 -0.64 0.00 0.25 -2.54 0.00 0.00 175.29 172.36 1ftj n THR 131 N -0.38 0.00 -0.12 3.63 -2.24 -1.26 -4.83 114.28 109.08 1ftj n THR 131 Ca -0.02 -0.15 -0.06 0.00 -2.27 0.00 0.00 64.05 61.55 1ftj n THR 131 Cb 0.62 0.64 0.02 0.00 -2.10 0.00 0.00 70.33 69.51 1ftj n THR 131 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1ftj h GLU 132 N 0.00 0.36 -5.31 -0.78 -0.00 -1.97 -3.39 114.58 103.50 1ftj h GLU 132 Ca 0.00 -0.02 -0.62 0.00 -0.00 0.00 0.00 59.36 58.71 1ftj h GLU 132 Cb 0.00 -0.08 -0.14 0.00 -0.00 0.00 0.00 28.75 28.53 1ftj h GLU 132 CO 0.00 0.24 -0.05 0.42 -0.00 0.00 0.00 179.01 179.62 1ftj s ILE 133 N -6.15 5.07 0.60 -1.06 1.01 -1.26 -4.92 121.20 114.48 1ftj s ILE 133 Ca -0.13 0.72 -0.13 0.00 0.00 0.00 0.00 60.65 61.11 1ftj s ILE 133 Cb 0.12 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 1ftj s ILE 133 CO 0.72 0.02 1.02 0.00 0.00 0.00 0.00 174.94 176.70 1ftj s ALA 134 N 2.31 3.06 -0.18 9.38 0.00 0.06 -4.88 121.76 131.50 1ftj s ALA 134 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 51.96 51.95 1ftj s ALA 134 Cb -0.16 -3.10 0.05 0.00 0.00 0.00 0.00 23.12 19.92 1ftj s ALA 134 CO 0.10 -0.60 0.56 1.52 0.00 0.00 0.00 175.76 177.35 1ftj s TYR 135 N -3.01 -0.60 0.24 0.00 1.13 -1.26 -0.50 117.35 113.35 1ftj s TYR 135 Ca 0.56 1.40 -0.02 0.00 -1.41 0.00 0.00 57.07 57.60 1ftj s TYR 135 Cb -0.11 0.23 0.01 0.00 -1.10 0.00 0.00 41.96 40.98 1ftj s TYR 135 CO 0.48 -0.34 0.34 0.41 -2.51 0.00 0.00 175.55 173.93 1ftj n GLY 136 N 2.47 2.39 3.52 5.49 0.00 -1.17 -4.80 105.19 113.08 1ftj n GLY 136 Ca -0.15 -1.52 -0.26 0.00 0.00 0.00 0.00 46.02 44.09 1ftj n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ftj s THR 137 N -2.67 0.52 0.02 2.61 -4.23 -1.25 -1.10 115.64 109.54 1ftj s THR 137 Ca 0.19 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.40 1ftj s THR 137 Cb -0.01 -2.30 -0.06 0.00 1.34 0.00 0.00 72.50 71.47 1ftj s THR 137 CO 0.14 0.00 1.34 -0.22 -0.54 0.00 0.00 174.62 175.34 1ftj s LEU 138 N -3.62 4.33 0.24 4.79 2.96 -1.26 -2.06 118.68 124.06 1ftj s LEU 138 Ca 0.23 2.10 -0.16 0.00 -0.22 0.00 0.00 54.13 56.07 1ftj s LEU 138 Cb 0.02 -3.57 0.27 0.00 0.50 0.00 0.00 46.19 43.41 1ftj s LEU 138 CO 0.15 -0.65 1.55 -0.78 -1.32 0.00 0.00 176.35 175.30 1ftj h ASP 139 N 7.43 -1.38 -3.22 3.68 -0.00 -0.82 -3.37 116.42 118.75 1ftj h ASP 139 Ca -0.39 0.31 -0.66 0.00 -0.00 0.00 0.00 57.03 56.30 1ftj h ASP 139 Cb 1.19 0.74 -0.36 0.00 -0.00 0.00 0.00 39.33 40.90 1ftj h ASP 139 CO 0.88 -0.29 -0.84 -0.44 -0.00 0.00 0.00 179.24 178.54 1ftj s SER 140 N -5.35 3.29 0.00 2.28 0.01 -1.26 -4.91 113.70 107.76 1ftj s SER 140 Ca -0.14 -0.76 0.00 0.00 1.31 0.00 0.00 55.95 56.36 1ftj s SER 140 Cb 0.21 -1.43 0.00 0.00 0.21 0.00 0.00 66.02 65.01 1ftj s SER 140 CO 0.72 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.93 1ftj n GLY 141 N 4.62 -2.27 0.16 3.44 0.00 -1.26 -4.53 105.19 105.35 1ftj n GLY 141 Ca -0.19 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1ftj n GLY 141 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ftj h SER 142 N 0.00 0.00 -0.09 1.61 4.64 -1.91 -2.91 113.55 114.88 1ftj h SER 142 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1ftj h SER 142 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ftj h SER 142 CO 0.00 0.52 0.01 0.74 -0.87 0.00 0.00 176.83 177.23 1ftj h THR 143 N 0.00 1.23 -0.82 2.95 2.02 -1.94 -1.29 112.91 115.06 1ftj h THR 143 Ca -0.01 -0.73 0.11 0.00 0.77 0.00 0.00 66.41 66.56 1ftj h THR 143 Cb 0.93 1.53 -0.08 0.00 -1.74 0.00 0.00 68.15 68.80 1ftj h THR 143 CO 0.07 0.21 0.45 0.50 0.37 0.00 0.00 175.52 177.11 1ftj h LYS 144 N -0.09 0.70 -0.11 6.66 1.63 -1.75 -1.43 116.57 122.18 1ftj h LYS 144 Ca 0.03 -0.04 -0.14 0.00 -0.85 0.00 0.00 60.65 59.64 1ftj h LYS 144 Cb 0.31 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.78 1ftj h LYS 144 CO 0.00 0.46 -0.54 0.93 -3.45 0.00 0.00 179.45 176.85 1ftj h GLU 145 N 0.72 0.33 -0.64 1.90 4.39 -1.42 -2.00 114.58 117.87 1ftj h GLU 145 Ca 0.41 -0.20 0.06 0.00 0.34 0.00 0.00 59.36 59.97 1ftj h GLU 145 Cb 0.44 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.06 1ftj h GLU 145 CO -0.28 0.79 0.34 0.35 -1.16 0.00 0.00 179.01 179.05 1ftj h PHE 146 N 0.26 0.62 -0.09 4.33 3.57 -0.12 -1.32 116.94 124.19 1ftj h PHE 146 Ca 0.00 0.02 -0.22 0.00 3.53 0.00 0.00 57.97 61.31 1ftj h PHE 146 Cb 1.04 -0.18 0.01 0.00 2.79 0.00 0.00 35.95 39.61 1ftj h PHE 146 CO 0.03 0.29 -0.79 0.74 -2.23 0.00 0.00 178.31 176.34 1ftj h PHE 147 N 0.63 0.98 -0.11 0.41 0.04 -1.44 -2.52 116.94 114.92 1ftj h PHE 147 Ca 0.29 -0.47 0.03 0.00 2.80 0.00 0.00 57.97 60.63 1ftj h PHE 147 Cb 0.21 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1ftj h PHE 147 CO -0.09 1.29 0.08 -0.09 -0.60 0.00 0.00 178.31 178.90 1ftj h ARG 148 N 0.39 0.00 -0.05 1.51 2.43 -0.89 -2.92 114.38 114.85 1ftj h ARG 148 Ca -0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1ftj h ARG 148 Cb 1.44 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1ftj h ARG 148 CO 0.16 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.16 1ftj n ARG 149 N -4.48 1.09 -2.10 0.20 1.74 -0.54 -5.04 116.66 107.54 1ftj n ARG 149 Ca -0.00 -1.40 -0.42 0.00 -0.77 0.00 0.00 57.85 55.26 1ftj n ARG 149 Cb 0.20 -1.27 -0.03 0.00 -1.02 0.00 0.00 32.46 30.34 1ftj n ARG 149 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ftj s SER 150 N -1.15 6.75 0.04 0.55 0.15 -0.95 -4.92 113.70 114.17 1ftj s SER 150 Ca 0.17 2.42 0.23 0.00 0.70 0.00 0.00 55.95 59.47 1ftj s SER 150 Cb 0.12 -2.59 0.10 0.00 -1.71 0.00 0.00 66.02 61.94 1ftj s SER 150 CO 0.18 -0.70 1.08 0.29 1.20 0.00 0.00 173.24 175.28 1ftj n LYS 151 N 3.93 0.20 -2.24 5.44 4.01 -1.26 -4.40 118.16 123.84 1ftj n LYS 151 Ca 0.12 -0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.50 1ftj n LYS 151 Cb 0.41 -1.57 -0.03 0.00 -0.51 0.00 0.00 35.03 33.33 1ftj n LYS 151 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1ftj s ILE 152 N -3.14 3.32 0.19 -0.18 1.09 -1.26 -4.92 121.20 116.30 1ftj s ILE 152 Ca 0.05 1.05 -0.13 0.00 -1.10 0.00 0.00 60.65 60.52 1ftj s ILE 152 Cb 0.15 -3.67 0.14 0.00 -1.06 0.00 0.00 42.46 38.02 1ftj s ILE 152 CO 0.79 0.14 1.69 0.00 -0.10 0.00 0.00 174.94 177.45 1ftj h ALA 153 N 5.75 0.51 -0.63 9.38 0.00 -1.99 -0.52 119.26 131.76 1ftj h ALA 153 Ca -0.44 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1ftj h ALA 153 Cb 1.21 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1ftj h ALA 153 CO 0.79 -0.37 0.26 0.28 0.00 0.00 0.00 179.25 180.21 1ftj h VAL 154 N 0.14 1.23 -0.01 0.00 2.07 -1.99 -1.91 116.25 115.78 1ftj h VAL 154 Ca 0.26 -0.70 -0.17 0.00 0.82 0.00 0.00 66.70 66.91 1ftj h VAL 154 Cb 0.40 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1ftj h VAL 154 CO -0.42 0.28 -0.76 -0.26 0.02 0.00 0.00 177.57 176.43 1ftj h PHE 155 N 0.88 0.11 -0.53 1.57 0.04 -1.88 -1.79 116.94 115.34 1ftj h PHE 155 Ca 0.21 -0.05 -0.11 0.00 2.80 0.00 0.00 57.97 60.82 1ftj h PHE 155 Cb 0.19 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.30 1ftj h PHE 155 CO 0.01 0.80 -0.10 0.22 -0.60 0.00 0.00 178.31 178.64 1ftj h ASP 156 N 0.05 1.02 -0.39 2.17 -0.00 -0.97 -0.44 116.42 117.86 1ftj h ASP 156 Ca -0.02 -0.35 -0.04 0.00 -0.00 0.00 0.00 57.03 56.62 1ftj h ASP 156 Cb 1.34 -0.28 -0.02 0.00 -0.00 0.00 0.00 39.33 40.38 1ftj h ASP 156 CO 0.11 1.13 0.07 0.50 -0.00 0.00 0.00 179.24 181.05 1ftj h LYS 157 N 0.89 0.64 -0.80 0.28 3.64 -1.25 -0.17 116.57 119.80 1ftj h LYS 157 Ca 0.14 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1ftj h LYS 157 Cb 0.67 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 1ftj h LYS 157 CO 0.05 0.68 0.38 0.52 -2.27 0.00 0.00 179.45 178.81 1ftj h MET 158 N 0.49 1.15 -0.31 1.90 2.86 -1.15 -2.29 114.93 117.58 1ftj h MET 158 Ca 0.12 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1ftj h MET 158 Cb 0.35 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1ftj h MET 158 CO 0.01 0.90 0.03 2.35 1.06 0.00 0.00 176.91 181.25 1ftj h TRP 159 N 1.13 0.57 -0.51 -0.22 -0.00 -0.87 -0.79 115.95 115.27 1ftj h TRP 159 Ca 0.27 -0.09 0.06 0.00 -0.00 0.00 0.00 58.89 59.14 1ftj h TRP 159 Cb 0.13 -0.15 -0.05 0.00 -0.00 0.00 0.00 29.16 29.08 1ftj h TRP 159 CO 0.01 0.64 0.20 1.15 -0.00 0.00 0.00 178.44 180.44 1ftj h THR 160 N 0.35 0.86 0.20 2.65 2.02 -0.84 0.60 112.91 118.75 1ftj h THR 160 Ca 0.09 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1ftj h THR 160 Cb 0.39 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1ftj h THR 160 CO 0.01 0.07 -0.10 0.22 0.37 0.00 0.00 175.52 176.10 1ftj h TYR 161 N 0.40 -0.25 -0.81 3.16 3.20 -1.34 -3.05 116.97 118.27 1ftj h TYR 161 Ca 0.24 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.18 1ftj h TYR 161 Cb 0.23 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.52 1ftj h TYR 161 CO -0.14 0.02 0.48 0.52 -1.64 0.00 0.00 178.16 177.39 1ftj h MET 162 N -0.51 0.81 -0.01 1.82 2.86 -0.83 0.56 114.93 119.63 1ftj h MET 162 Ca -0.03 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.46 1ftj h MET 162 Cb 0.39 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 1ftj h MET 162 CO 0.05 0.53 -0.49 0.07 1.06 0.00 0.00 176.91 178.13 1ftj h ARG 163 N 0.83 0.02 -0.00 1.72 0.11 -0.94 -3.18 114.38 112.94 1ftj h ARG 163 Ca 0.38 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.45 1ftj h ARG 163 Cb 0.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.36 1ftj h ARG 163 CO -0.22 0.51 -0.66 -1.13 0.10 0.00 0.00 179.97 178.57 1ftj n SER 164 N -3.96 1.11 -4.77 0.08 3.41 -0.93 -4.97 113.62 103.59 1ftj n SER 164 Ca -0.02 -0.92 -0.41 0.00 -0.26 0.00 0.00 58.87 57.26 1ftj n SER 164 Cb 0.51 0.58 -0.01 0.00 -0.26 0.00 0.00 64.21 65.03 1ftj n SER 164 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ftj s ALA 165 N -2.81 3.59 -0.02 7.33 0.00 0.14 -5.04 121.76 124.95 1ftj s ALA 165 Ca 0.13 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1ftj s ALA 165 Cb 0.17 -3.57 0.02 0.00 0.00 0.00 0.00 23.12 19.74 1ftj s ALA 165 CO 0.71 -0.88 0.01 -1.21 0.00 0.00 0.00 175.76 174.39 1ftj s GLU 166 N -1.50 0.14 1.12 0.00 2.02 -1.26 -3.89 118.70 115.33 1ftj s GLU 166 Ca 0.54 0.09 -0.14 0.00 0.02 0.00 0.00 54.97 55.48 1ftj s GLU 166 Cb -0.44 -0.32 0.25 0.00 0.10 0.00 0.00 34.13 33.72 1ftj s GLU 166 CO 0.55 -0.11 1.06 -1.25 0.02 0.00 0.00 175.26 175.53 1ftj s PRO 167 N 0.82 -0.53 0.36 0.39 0.04 -1.26 -5.07 135.00 129.75 1ftj s PRO 167 Ca -0.08 0.50 -0.27 0.00 0.04 0.00 0.00 61.00 61.20 1ftj s PRO 167 Cb -0.11 -1.63 -0.12 0.00 0.04 0.00 0.00 34.50 32.69 1ftj s PRO 167 CO -0.02 -3.38 1.18 0.45 0.04 0.00 0.00 177.00 175.27 1ftj n SER 168 N -4.62 2.15 -0.44 6.66 2.88 -1.25 -4.92 113.62 114.07 1ftj n SER 168 Ca 0.05 1.15 0.11 0.00 -1.33 0.00 0.00 58.87 58.86 1ftj n SER 168 Cb 0.57 -1.42 0.02 0.00 -0.75 0.00 0.00 64.21 62.63 1ftj n SER 168 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1ftj n VAL 169 N 0.07 0.00 -3.40 2.46 0.24 -1.26 -4.94 118.33 111.50 1ftj n VAL 169 Ca 0.07 -0.23 -0.33 0.00 -2.04 0.00 0.00 64.34 61.80 1ftj n VAL 169 Cb 0.36 1.16 -0.06 0.00 -1.47 0.00 0.00 33.84 33.84 1ftj n VAL 169 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1ftj s PHE 170 N -2.52 3.50 0.21 6.34 0.08 -1.26 -3.75 117.98 120.59 1ftj s PHE 170 Ca 0.18 0.95 0.11 0.00 0.12 0.00 0.00 56.93 58.29 1ftj s PHE 170 Cb 0.18 -2.30 -0.05 0.00 -0.57 0.00 0.00 43.02 40.28 1ftj s PHE 170 CO 0.59 0.34 -0.22 0.14 -0.10 0.00 0.00 175.22 175.97 1ftj s VAL 171 N -1.66 2.31 0.20 -0.44 -7.23 -0.87 -4.81 120.40 107.89 1ftj s VAL 171 Ca 0.43 -2.13 -0.03 0.00 -1.81 0.00 0.00 61.98 58.44 1ftj s VAL 171 Cb -0.13 -2.14 -0.05 0.00 0.56 0.00 0.00 36.38 34.62 1ftj s VAL 171 CO 0.20 -0.23 1.52 0.08 -0.31 0.00 0.00 175.10 176.36 1ftj h ARG 172 N 2.93 0.54 -4.47 4.82 -0.00 -1.96 0.23 114.38 116.48 1ftj h ARG 172 Ca -0.44 -0.34 -0.19 0.00 -0.00 0.00 0.00 59.98 59.02 1ftj h ARG 172 Cb 1.22 0.04 -0.15 0.00 -0.00 0.00 0.00 29.97 31.08 1ftj h ARG 172 CO 0.52 0.94 -0.67 0.95 -0.00 0.00 0.00 179.97 181.71 1ftj s THR 173 N -4.01 0.37 0.17 0.08 -4.23 -1.26 -4.75 115.64 102.01 1ftj s THR 173 Ca -0.07 -1.89 -0.15 0.00 -1.18 0.00 0.00 61.69 58.40 1ftj s THR 173 Cb 0.11 -1.79 0.05 0.00 1.34 0.00 0.00 72.50 72.21 1ftj s THR 173 CO 0.84 -0.75 1.80 0.74 -0.54 0.00 0.00 174.62 176.71 1ftj h THR 174 N 2.96 1.02 -0.97 3.99 2.02 -1.96 -2.37 112.91 117.59 1ftj h THR 174 Ca -0.35 -0.17 0.11 0.00 0.77 0.00 0.00 66.41 66.77 1ftj h THR 174 Cb 1.17 0.46 -0.08 0.00 -1.74 0.00 0.00 68.15 67.97 1ftj h THR 174 CO 0.63 0.09 0.62 0.00 0.37 0.00 0.00 175.52 177.23 1ftj h ALA 175 N 1.22 1.56 -0.60 6.16 0.00 -1.97 0.11 119.26 125.75 1ftj h ALA 175 Ca 0.19 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1ftj h ALA 175 Cb 0.05 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1ftj h ALA 175 CO -0.10 0.21 0.18 1.49 0.00 0.00 0.00 179.25 181.03 1ftj h GLU 176 N 0.96 0.90 -0.36 0.00 4.81 -1.85 -1.05 114.58 117.99 1ftj h GLU 176 Ca 0.47 -0.17 -0.11 0.00 -0.13 0.00 0.00 59.36 59.42 1ftj h GLU 176 Cb 0.46 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1ftj h GLU 176 CO -0.23 0.78 -0.21 0.78 -0.73 0.00 0.00 179.01 179.41 1ftj h GLY 177 N 1.00 0.84 1.05 1.92 0.00 -0.51 -2.26 103.07 105.12 1ftj h GLY 177 Ca 0.20 -0.78 -0.06 0.00 0.00 0.00 0.00 47.33 46.69 1ftj h GLY 177 CO -0.01 0.71 0.23 -2.08 0.00 0.00 0.00 176.54 175.39 1ftj h VAL 178 N 0.56 1.26 -0.46 4.60 2.07 -0.81 -1.48 116.25 121.99 1ftj h VAL 178 Ca 0.08 -0.90 -0.13 0.00 0.82 0.00 0.00 66.70 66.57 1ftj h VAL 178 Cb 0.76 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1ftj h VAL 178 CO 0.06 0.35 -0.22 0.00 0.02 0.00 0.00 177.57 177.79 1ftj h ALA 179 N 1.12 0.74 -0.85 1.67 0.00 -1.18 -1.35 119.26 119.41 1ftj h ALA 179 Ca 0.24 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ftj h ALA 179 Cb 0.30 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1ftj h ALA 179 CO -0.01 0.67 0.47 -0.09 0.00 0.00 0.00 179.25 180.29 1ftj h ARG 180 N 0.82 1.19 0.19 0.00 2.43 -1.11 0.11 114.38 118.01 1ftj h ARG 180 Ca 0.11 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1ftj h ARG 180 Cb 0.78 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1ftj h ARG 180 CO 0.06 0.87 -0.09 0.28 -1.51 0.00 0.00 179.97 179.58 1ftj h VAL 181 N 1.19 0.86 -0.08 0.20 2.07 -1.05 -1.89 116.25 117.56 1ftj h VAL 181 Ca 0.30 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 1ftj h VAL 181 Cb 0.02 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1ftj h VAL 181 CO -0.05 0.06 -0.00 0.03 0.02 0.00 0.00 177.57 177.63 1ftj h ARG 182 N -0.39 0.10 -0.01 1.57 3.08 -0.81 -2.75 114.38 115.18 1ftj h ARG 182 Ca -0.03 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1ftj h ARG 182 Cb 0.30 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1ftj h ARG 182 CO 0.04 0.12 -0.60 1.63 -1.07 0.00 0.00 179.97 180.09 1ftj n LYS 183 N -4.47 0.55 -0.15 0.04 4.01 0.34 -4.41 118.16 114.08 1ftj n LYS 183 Ca -0.02 -0.42 0.08 0.00 -0.51 0.00 0.00 58.31 57.45 1ftj n LYS 183 Cb 0.13 -1.49 0.26 0.00 -0.51 0.00 0.00 35.03 33.42 1ftj n LYS 183 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1ftj n SER 184 N -0.86 1.97 -3.61 4.39 7.64 -0.72 -4.95 113.62 117.49 1ftj n SER 184 Ca 0.08 -1.88 -0.27 0.00 1.01 0.00 0.00 58.87 57.81 1ftj n SER 184 Cb 0.38 -0.19 0.02 0.00 -1.01 0.00 0.00 64.21 63.40 1ftj n SER 184 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1ftj n LYS 185 N 0.55 -4.74 -0.86 1.43 5.02 -1.26 -1.03 118.16 117.26 1ftj n LYS 185 Ca 0.15 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 1ftj n LYS 185 Cb 0.34 -5.44 0.00 0.00 -0.02 0.00 0.00 35.03 29.92 1ftj n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ftj n GLY 186 N -1.50 0.65 0.72 0.72 0.00 -1.26 -4.92 105.19 99.60 1ftj n GLY 186 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1ftj n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ftj n LYS 187 N -2.66 1.99 -3.68 1.61 4.76 -0.20 -4.82 118.16 115.16 1ftj n LYS 187 Ca 0.00 -1.44 -0.18 0.00 -2.87 0.00 0.00 58.31 53.81 1ftj n LYS 187 Cb 0.00 -1.47 -0.17 0.00 -1.84 0.00 0.00 35.03 31.55 1ftj n LYS 187 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1ftj s TYR 188 N -1.96 -0.03 0.08 2.13 5.04 -1.26 -0.76 117.35 120.59 1ftj s TYR 188 Ca 0.34 0.39 0.04 0.00 -2.44 0.00 0.00 57.07 55.39 1ftj s TYR 188 Cb 0.20 -0.38 -0.04 0.00 0.35 0.00 0.00 41.96 42.10 1ftj s TYR 188 CO 0.32 -0.21 0.06 0.00 -1.34 0.00 0.00 175.55 174.37 1ftj s ALA 189 N 2.13 3.49 -0.09 3.97 0.00 0.34 -4.52 121.76 127.08 1ftj s ALA 189 Ca 0.03 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 50.99 1ftj s ALA 189 Cb -0.12 -1.36 0.00 0.00 0.00 0.00 0.00 23.12 21.64 1ftj s ALA 189 CO -0.04 0.74 -0.21 -0.47 0.00 0.00 0.00 175.76 175.77 1ftj s TYR 190 N -1.37 2.29 -0.36 0.00 5.04 0.15 -3.02 117.35 120.07 1ftj s TYR 190 Ca 0.28 -0.90 -0.16 0.00 -2.44 0.00 0.00 57.07 53.85 1ftj s TYR 190 Cb -0.12 -1.55 -0.00 0.00 0.35 0.00 0.00 41.96 40.64 1ftj s TYR 190 CO 0.21 -0.37 0.41 -0.51 -1.34 0.00 0.00 175.55 173.96 1ftj s LEU 191 N 0.36 4.53 0.24 6.97 1.43 -0.26 0.04 118.68 131.99 1ftj s LEU 191 Ca -0.17 -0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 52.54 1ftj s LEU 191 Cb -0.17 -2.41 -0.01 0.00 0.03 0.00 0.00 46.19 43.63 1ftj s LEU 191 CO 0.07 -0.43 0.39 -1.48 0.23 0.00 0.00 176.35 175.13 1ftj s LEU 192 N 2.13 0.58 0.31 1.79 2.34 -0.93 -4.31 118.68 120.59 1ftj s LEU 192 Ca 0.13 -1.09 -0.29 0.00 0.06 0.00 0.00 54.13 52.95 1ftj s LEU 192 Cb -0.16 1.38 -0.10 0.00 -0.56 0.00 0.00 46.19 46.75 1ftj s LEU 192 CO 0.13 -1.07 1.22 -1.61 -1.06 0.00 0.00 176.35 173.95 1ftj s GLU 193 N -3.99 4.47 0.34 1.48 2.02 -1.26 -0.17 118.70 121.59 1ftj s GLU 193 Ca 0.27 2.05 0.13 0.00 0.02 0.00 0.00 54.97 57.44 1ftj s GLU 193 Cb 0.01 -3.12 1.00 0.00 0.10 0.00 0.00 34.13 32.13 1ftj s GLU 193 CO 0.11 -0.02 1.71 0.66 0.02 0.00 0.00 175.26 177.73 1ftj h SER 194 N 3.57 0.58 -0.31 -0.19 4.64 -0.44 -1.77 113.55 119.62 1ftj h SER 194 Ca -0.48 0.15 0.04 0.00 -0.47 0.00 0.00 61.79 61.02 1ftj h SER 194 Cb 1.22 0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.34 1ftj h SER 194 CO 0.66 0.02 0.09 0.71 -0.87 0.00 0.00 176.83 177.44 1ftj h THR 195 N 0.46 0.89 -0.18 2.95 1.35 -1.91 -0.36 112.91 116.11 1ftj h THR 195 Ca 0.67 -0.07 -0.16 0.00 -0.55 0.00 0.00 66.41 66.30 1ftj h THR 195 Cb 1.46 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 1ftj h THR 195 CO -0.49 0.04 -0.54 0.24 -0.25 0.00 0.00 175.52 174.53 1ftj h MET 196 N 0.22 0.52 0.08 4.72 2.86 -1.72 -2.54 114.93 119.07 1ftj h MET 196 Ca 0.14 -0.32 -0.00 0.00 -2.06 0.00 0.00 59.70 57.46 1ftj h MET 196 Cb 0.13 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1ftj h MET 196 CO -0.16 0.92 -0.04 -0.97 1.06 0.00 0.00 176.91 177.73 1ftj h ASN 197 N 0.40 -0.09 -0.41 1.22 -0.73 -1.10 -1.04 115.58 113.84 1ftj h ASN 197 Ca 0.01 -0.05 -0.02 0.00 1.87 0.00 0.00 56.30 58.11 1ftj h ASN 197 Cb 1.07 0.02 -0.02 0.00 0.27 0.00 0.00 38.32 39.66 1ftj h ASN 197 CO 0.10 -0.01 0.18 -0.33 -0.37 0.00 0.00 177.43 177.00 1ftj h GLU 198 N -0.16 0.65 -0.00 6.67 5.08 -1.10 -0.25 114.58 125.48 1ftj h GLU 198 Ca -0.01 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1ftj h GLU 198 Cb 0.13 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 1ftj h GLU 198 CO 0.02 0.54 0.00 -0.92 -1.00 0.00 0.00 179.01 177.65 1ftj h TYR 199 N 0.65 0.00 -0.13 4.33 3.20 -1.19 -3.15 116.97 120.68 1ftj h TYR 199 Ca 0.16 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 1ftj h TYR 199 Cb 0.13 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 1ftj h TYR 199 CO 0.01 0.31 -0.16 0.82 -1.64 0.00 0.00 178.16 177.50 1ftj h ILE 200 N -0.30 1.18 0.00 1.81 1.08 -0.84 -2.02 117.51 118.42 1ftj h ILE 200 Ca 0.00 -0.83 -0.01 0.00 -0.39 0.00 0.00 64.86 63.63 1ftj h ILE 200 Cb 0.31 1.26 -0.00 0.00 -3.07 0.00 0.00 36.82 35.32 1ftj h ILE 200 CO 0.00 0.26 -0.04 -0.08 -0.69 0.00 0.00 178.15 177.60 1ftj h GLU 201 N 0.20 0.00 -0.71 2.37 4.81 -1.04 -1.43 114.58 118.78 1ftj h GLU 201 Ca 0.04 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1ftj h GLU 201 Cb 0.40 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1ftj h GLU 201 CO 0.03 0.04 0.00 1.04 -0.73 0.00 0.00 179.01 179.38 1ftj n GLN 202 N -3.45 3.14 -4.62 1.92 1.13 -0.76 -4.84 117.38 109.90 1ftj n GLN 202 Ca -0.02 -2.77 -0.32 0.00 -1.94 0.00 0.00 57.00 51.95 1ftj n GLN 202 Cb 0.15 -1.70 -0.12 0.00 0.11 0.00 0.00 30.24 28.68 1ftj n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1ftj s ARG 203 N -1.34 2.47 0.65 -1.09 1.81 -0.54 -0.26 118.95 120.65 1ftj s ARG 203 Ca 0.50 -0.74 -0.18 0.00 -1.72 0.00 0.00 55.73 53.59 1ftj s ARG 203 Cb 0.29 -2.42 -0.01 0.00 -0.45 0.00 0.00 34.95 32.35 1ftj s ARG 203 CO 0.30 0.60 1.25 0.15 -0.68 0.00 0.00 175.30 176.93 1ftj s LYS 204 N -1.19 2.59 0.00 3.54 1.02 -1.26 -0.76 119.74 123.69 1ftj s LYS 204 Ca 0.15 1.94 0.00 0.00 0.02 0.00 0.00 55.97 58.07 1ftj s LYS 204 Cb -0.11 -1.87 0.00 0.00 -0.52 0.00 0.00 37.83 35.33 1ftj s LYS 204 CO 0.05 -1.53 0.61 -0.35 -0.92 0.00 0.00 175.35 173.21 1ftj n PRO 205 N -1.97 0.87 -3.95 -1.68 -0.04 -1.26 -4.95 135.00 122.02 1ftj n PRO 205 Ca 0.15 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.29 1ftj n PRO 205 Cb 0.49 -1.29 -0.02 0.00 -0.04 0.00 0.00 33.50 32.64 1ftj n PRO 205 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ftj n ASP 207 N -2.51 2.89 -4.63 0.00 5.75 -1.26 -4.98 116.55 111.81 1ftj n ASP 207 Ca 0.05 -1.85 -0.25 0.00 -0.01 0.00 0.00 54.79 52.73 1ftj n ASP 207 Cb 0.50 -0.18 -0.09 0.00 -1.03 0.00 0.00 41.12 40.32 1ftj n ASP 207 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1ftj s THR 208 N -1.16 2.42 -0.09 2.12 -4.23 -1.26 -0.41 115.64 113.02 1ftj s THR 208 Ca 0.27 -1.98 -0.25 0.00 -1.18 0.00 0.00 61.69 58.54 1ftj s THR 208 Cb 0.16 -2.83 0.06 0.00 1.34 0.00 0.00 72.50 71.23 1ftj s THR 208 CO 0.22 -0.14 0.59 -0.32 -0.54 0.00 0.00 174.62 174.42 1ftj s MET 209 N -3.72 0.90 -0.15 3.99 1.75 -0.41 -4.71 119.30 116.95 1ftj s MET 209 Ca 0.35 0.31 -0.18 0.00 -1.25 0.00 0.00 55.69 54.92 1ftj s MET 209 Cb 0.02 0.42 -0.04 0.00 2.84 0.00 0.00 34.83 38.08 1ftj s MET 209 CO 0.19 -0.24 0.48 0.21 -0.65 0.00 0.00 175.02 175.01 1ftj s LYS 210 N -0.85 4.29 0.09 4.11 2.36 -1.26 -1.48 119.74 127.00 1ftj s LYS 210 Ca -0.09 0.42 0.10 0.00 -2.55 0.00 0.00 55.97 53.85 1ftj s LYS 210 Cb -0.02 -3.48 -0.03 0.00 -1.05 0.00 0.00 37.83 33.25 1ftj s LYS 210 CO 0.07 0.06 -0.25 0.14 1.55 0.00 0.00 175.35 176.92 1ftj s VAL 211 N 0.94 2.09 0.08 4.02 -7.23 -0.52 -5.00 120.40 114.77 1ftj s VAL 211 Ca 0.25 -1.57 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 1ftj s VAL 211 Cb -0.15 -1.83 0.00 0.00 0.56 0.00 0.00 36.38 34.96 1ftj s VAL 211 CO 0.10 0.16 0.00 0.61 -0.31 0.00 0.00 175.10 175.66 1ftj n GLY 212 N 1.28 -2.03 3.96 2.32 0.00 -1.20 -3.93 105.19 105.60 1ftj n GLY 212 Ca -0.18 -1.38 -0.26 0.00 0.00 0.00 0.00 46.02 44.21 1ftj n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ftj s GLY 213 N -3.36 1.75 0.35 -0.02 0.00 -1.26 -4.92 107.32 99.85 1ftj s GLY 213 Ca 0.00 -1.39 -0.26 0.00 0.00 0.00 0.00 44.72 43.06 1ftj s GLY 213 CO 0.00 -0.81 1.07 -1.31 0.00 0.00 0.00 173.10 172.04 1ftj s ASN 214 N -4.72 6.99 0.32 1.64 0.01 -1.26 -4.74 114.94 113.18 1ftj s ASN 214 Ca 0.67 2.13 0.17 0.00 -0.71 0.00 0.00 52.86 55.12 1ftj s ASN 214 Cb -0.06 -2.60 0.30 0.00 0.41 0.00 0.00 41.25 39.30 1ftj s ASN 214 CO 0.47 -0.33 1.55 -0.07 -1.51 0.00 0.00 177.10 177.21 1ftj h LEU 215 N 3.09 0.00 0.00 0.60 4.07 -0.72 -3.48 115.31 118.87 1ftj h LEU 215 Ca -0.48 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.39 1ftj h LEU 215 Cb 1.21 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.94 1ftj h LEU 215 CO 0.64 0.44 0.03 -0.90 -1.08 0.00 0.00 178.44 177.57 1ftj n ASP 216 N -3.30 -1.07 -3.88 -0.43 5.68 -1.26 -4.94 116.55 107.34 1ftj n ASP 216 Ca 0.01 -2.04 -0.18 0.00 -0.50 0.00 0.00 54.79 52.08 1ftj n ASP 216 Cb 0.65 1.87 -0.16 0.00 -1.14 0.00 0.00 41.12 42.33 1ftj n ASP 216 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1ftj s SER 217 N -2.26 0.73 0.11 -1.12 0.01 -1.26 -4.20 113.70 105.70 1ftj s SER 217 Ca 0.14 -0.09 -0.05 0.00 1.31 0.00 0.00 55.95 57.25 1ftj s SER 217 Cb -0.02 -0.33 0.02 0.00 0.21 0.00 0.00 66.02 65.91 1ftj s SER 217 CO 0.10 -0.05 0.25 2.29 0.41 0.00 0.00 173.24 176.24 1ftj n LYS 218 N 3.89 0.31 -3.98 12.44 2.85 -0.23 -5.00 118.16 128.45 1ftj n LYS 218 Ca -0.24 -0.62 -0.09 0.00 -1.05 0.00 0.00 58.31 56.31 1ftj n LYS 218 Cb 0.52 0.79 -0.08 0.00 -0.65 0.00 0.00 35.03 35.60 1ftj n LYS 218 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1ftj s GLY 219 N -1.75 0.44 -0.13 2.58 0.00 -1.26 -1.27 107.32 105.92 1ftj s GLY 219 Ca 0.05 -0.94 -0.06 0.00 0.00 0.00 0.00 44.72 43.76 1ftj s GLY 219 CO 0.03 -0.98 0.10 -0.19 0.00 0.00 0.00 173.10 172.06 1ftj s TYR 220 N -3.94 3.46 0.12 1.90 2.02 -0.65 -0.98 117.35 119.28 1ftj s TYR 220 Ca 0.13 0.39 0.05 0.00 -0.37 0.00 0.00 57.07 57.28 1ftj s TYR 220 Cb 0.05 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.62 1ftj s TYR 220 CO -0.05 0.57 -0.13 0.20 -1.57 0.00 0.00 175.55 174.58 1ftj s GLY 221 N -0.68 1.02 -0.08 0.71 0.00 -0.70 -1.10 107.32 106.48 1ftj s GLY 221 Ca 0.13 -1.28 -0.30 0.00 0.00 0.00 0.00 44.72 43.27 1ftj s GLY 221 CO 0.03 -1.34 1.07 -0.42 0.00 0.00 0.00 173.10 172.43 1ftj s ILE 222 N -2.29 4.60 0.02 0.90 -1.09 -1.26 -4.58 121.20 117.49 1ftj s ILE 222 Ca 0.08 1.88 0.01 0.00 -2.23 0.00 0.00 60.65 60.40 1ftj s ILE 222 Cb -0.04 -4.21 -0.04 0.00 -1.58 0.00 0.00 42.46 36.59 1ftj s ILE 222 CO 0.02 0.01 0.06 0.00 -1.23 0.00 0.00 174.94 173.80 1ftj s ALA 223 N 2.04 3.51 0.11 9.38 0.00 -0.77 -1.14 121.76 134.89 1ftj s ALA 223 Ca 0.51 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1ftj s ALA 223 Cb -0.21 -1.49 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 1ftj s ALA 223 CO 0.20 0.70 0.00 0.95 0.00 0.00 0.00 175.76 177.60 1ftj s THR 224 N -1.22 0.35 0.57 0.00 -4.23 -0.27 -0.75 115.64 110.09 1ftj s THR 224 Ca 0.24 -1.90 -0.19 0.00 -1.18 0.00 0.00 61.69 58.66 1ftj s THR 224 Cb -0.12 -1.85 -0.05 0.00 1.34 0.00 0.00 72.50 71.82 1ftj s THR 224 CO 0.15 -0.68 1.16 -2.84 -0.54 0.00 0.00 174.62 171.87 1ftj s PRO 225 N -3.95 3.17 0.09 3.99 0.02 -1.26 -1.01 135.00 136.06 1ftj s PRO 225 Ca 0.17 1.68 -0.35 0.00 0.02 0.00 0.00 61.00 62.52 1ftj s PRO 225 Cb 0.07 -1.97 -0.15 0.00 0.02 0.00 0.00 34.50 32.47 1ftj s PRO 225 CO -0.02 -1.01 1.51 1.17 -0.33 0.00 0.00 177.00 178.32 1ftj n LYS 226 N -1.48 1.69 -1.86 5.54 3.00 -1.26 -1.26 118.16 122.52 1ftj n LYS 226 Ca 0.12 0.61 -0.10 0.00 -0.00 0.00 0.00 58.31 58.94 1ftj n LYS 226 Cb 0.50 -2.33 -0.02 0.00 0.00 0.00 0.00 35.03 33.19 1ftj n LYS 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ftj n GLY 227 N 3.15 0.39 3.79 3.14 0.00 -1.26 -5.00 105.19 109.40 1ftj n GLY 227 Ca 0.18 -0.50 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 1ftj n GLY 227 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ftj s SER 228 N -2.67 5.50 0.18 1.61 0.15 -0.39 -4.96 113.70 113.12 1ftj s SER 228 Ca 0.00 1.84 -0.00 0.00 0.70 0.00 0.00 55.95 58.49 1ftj s SER 228 Cb 0.00 -2.53 0.07 0.00 -1.71 0.00 0.00 66.02 61.85 1ftj s SER 228 CO 0.00 -1.36 1.44 -1.28 1.20 0.00 0.00 173.24 173.24 1ftj h SER 229 N 0.13 0.43 0.81 5.45 0.87 -1.94 -3.27 113.55 116.04 1ftj h SER 229 Ca -0.46 -0.29 -0.06 0.00 -1.23 0.00 0.00 61.79 59.75 1ftj h SER 229 Cb 1.23 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 63.05 1ftj h SER 229 CO 0.56 1.03 -0.27 -0.07 -0.53 0.00 0.00 176.83 177.55 1ftj h LEU 230 N 0.25 0.00 -0.81 2.23 3.38 -1.95 -3.39 115.31 115.02 1ftj h LEU 230 Ca -0.03 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.04 1ftj h LEU 230 Cb 1.31 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.94 1ftj h LEU 230 CO 0.12 0.27 -0.49 1.23 0.09 0.00 0.00 178.44 179.67 1ftj h GLY 231 N 1.89 -0.50 0.89 0.83 0.00 -1.93 -1.63 103.07 102.62 1ftj h GLY 231 Ca -0.00 0.65 0.01 0.00 0.00 0.00 0.00 47.33 47.99 1ftj h GLY 231 CO 0.04 -0.10 0.05 -0.57 0.00 0.00 0.00 176.54 175.96 1ftj h ASN 232 N -0.11 0.06 -0.59 0.19 -1.24 -1.84 -1.83 115.58 110.22 1ftj h ASN 232 Ca 0.21 0.01 -0.06 0.00 0.71 0.00 0.00 56.30 57.16 1ftj h ASN 232 Cb 0.52 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.56 1ftj h ASN 232 CO -0.84 0.06 0.11 0.00 -1.29 0.00 0.00 177.43 175.47 1ftj h ALA 233 N 1.09 0.78 -0.10 1.57 0.00 -1.78 -2.26 119.26 118.56 1ftj h ALA 233 Ca 0.06 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 1ftj h ALA 233 Cb 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1ftj h ALA 233 CO -0.06 0.51 -0.36 -0.39 0.00 0.00 0.00 179.25 178.95 1ftj h VAL 234 N 0.86 1.28 -0.44 0.00 -1.51 -1.15 -0.76 116.25 114.54 1ftj h VAL 234 Ca 0.18 -1.37 -0.07 0.00 -1.23 0.00 0.00 66.70 64.21 1ftj h VAL 234 Cb 0.39 1.62 -0.02 0.00 -2.13 0.00 0.00 31.29 31.15 1ftj h VAL 234 CO 0.01 0.41 0.01 -1.13 -1.23 0.00 0.00 177.57 175.64 1ftj h ASN 235 N 0.17 0.74 -0.42 4.19 -1.24 -1.13 -0.94 115.58 116.95 1ftj h ASN 235 Ca 0.02 -0.30 -0.06 0.00 0.71 0.00 0.00 56.30 56.67 1ftj h ASN 235 Cb 0.72 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.55 1ftj h ASN 235 CO 0.05 0.86 0.04 -0.07 -1.29 0.00 0.00 177.43 177.03 1ftj h LEU 236 N 0.60 0.75 -0.35 0.34 3.38 -1.06 -1.87 115.31 117.09 1ftj h LEU 236 Ca 0.13 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1ftj h LEU 236 Cb 0.47 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1ftj h LEU 236 CO 0.02 0.79 0.11 0.00 0.09 0.00 0.00 178.44 179.44 1ftj h ALA 237 N 1.30 0.46 -0.44 1.53 0.00 -0.77 -0.01 119.26 121.33 1ftj h ALA 237 Ca 0.15 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1ftj h ALA 237 Cb 0.39 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1ftj h ALA 237 CO 0.01 0.10 0.26 0.28 0.00 0.00 0.00 179.25 179.90 1ftj h VAL 238 N 0.41 1.05 -0.42 0.00 2.07 -0.89 0.12 116.25 118.59 1ftj h VAL 238 Ca 0.11 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1ftj h VAL 238 Cb 0.25 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1ftj h VAL 238 CO -0.00 0.10 0.13 -0.07 0.02 0.00 0.00 177.57 177.74 1ftj h LEU 239 N 0.53 0.61 -0.32 2.57 3.38 -1.17 -1.09 115.31 119.82 1ftj h LEU 239 Ca 0.18 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1ftj h LEU 239 Cb 0.01 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1ftj h LEU 239 CO -0.08 0.66 0.18 0.50 0.09 0.00 0.00 178.44 179.79 1ftj h LYS 240 N 0.53 0.45 -0.07 1.13 1.63 -0.73 -1.44 116.57 118.07 1ftj h LYS 240 Ca 0.13 -0.05 -0.09 0.00 -0.85 0.00 0.00 60.65 59.79 1ftj h LYS 240 Cb 0.27 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.80 1ftj h LYS 240 CO -0.00 0.37 -0.38 -0.07 -3.45 0.00 0.00 179.45 175.92 1ftj h LEU 241 N 0.40 0.14 -0.11 5.20 3.38 -0.68 -1.59 115.31 122.04 1ftj h LEU 241 Ca 0.11 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1ftj h LEU 241 Cb 0.05 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1ftj h LEU 241 CO -0.02 0.51 -0.32 -1.13 0.09 0.00 0.00 178.44 177.57 1ftj h ASN 242 N 0.12 0.47 -0.26 -0.43 -1.24 -0.97 -2.38 115.58 110.88 1ftj h ASN 242 Ca 0.01 -0.60 -0.01 0.00 0.71 0.00 0.00 56.30 56.42 1ftj h ASN 242 Cb 0.72 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 39.62 1ftj h ASN 242 CO 0.05 0.98 0.16 -0.33 -1.29 0.00 0.00 177.43 177.00 1ftj h GLU 243 N -0.02 0.39 0.00 6.67 5.08 -1.09 -1.86 114.58 123.74 1ftj h GLU 243 Ca -0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1ftj h GLU 243 Cb 0.94 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1ftj h GLU 243 CO 0.07 0.29 0.00 1.04 -1.00 0.00 0.00 179.01 179.41 1ftj n GLN 244 N -4.46 0.53 -0.42 2.33 1.13 -0.62 -4.90 117.38 110.97 1ftj n GLN 244 Ca 0.01 0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 1ftj n GLN 244 Cb 0.10 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.95 1ftj n GLN 244 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ftj n GLY 245 N 1.18 0.80 0.26 1.08 0.00 -0.70 -4.98 105.19 102.83 1ftj n GLY 245 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 1ftj n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ftj h LEU 246 N 0.00 0.80 -0.78 0.99 5.85 -1.64 -1.82 115.31 118.71 1ftj h LEU 246 Ca 0.00 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1ftj h LEU 246 Cb 0.00 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.79 1ftj h LEU 246 CO 0.00 0.71 0.39 -0.07 -0.34 0.00 0.00 178.44 179.13 1ftj h LEU 247 N 0.83 1.00 -0.57 2.25 3.38 -1.84 0.88 115.31 121.26 1ftj h LEU 247 Ca 0.21 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 1ftj h LEU 247 Cb 0.13 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1ftj h LEU 247 CO -0.03 0.84 -0.13 0.44 0.09 0.00 0.00 178.44 179.66 1ftj h ASP 248 N 1.09 1.02 -0.51 -0.43 3.32 -1.88 -1.71 116.42 117.32 1ftj h ASP 248 Ca 0.27 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1ftj h ASP 248 Cb 0.09 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 1ftj h ASP 248 CO -0.04 1.14 0.33 0.50 -1.72 0.00 0.00 179.24 179.45 1ftj h LYS 249 N 0.90 0.69 -0.29 3.56 3.64 -0.88 -1.25 116.57 122.93 1ftj h LYS 249 Ca 0.14 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.36 1ftj h LYS 249 Cb 0.69 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1ftj h LYS 249 CO 0.05 0.48 -0.26 -0.07 -2.27 0.00 0.00 179.45 177.38 1ftj h LEU 250 N 0.69 0.58 -0.35 5.20 4.07 -0.67 -0.64 115.31 124.19 1ftj h LEU 250 Ca 0.19 -0.21 -0.14 0.00 0.08 0.00 0.00 57.88 57.80 1ftj h LEU 250 Cb -0.05 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.53 1ftj h LEU 250 CO -0.04 0.83 -0.31 0.50 -1.08 0.00 0.00 178.44 178.34 1ftj h LYS 251 N 0.50 0.83 -0.83 1.13 3.64 -1.01 -2.57 116.57 118.25 1ftj h LYS 251 Ca 0.07 -0.42 -0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1ftj h LYS 251 Cb 0.71 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 1ftj h LYS 251 CO 0.05 1.06 0.51 -0.91 -2.27 0.00 0.00 179.45 177.90 1ftj h ASN 252 N 0.62 0.99 -0.22 4.20 2.35 -0.90 -0.60 115.58 122.02 1ftj h ASN 252 Ca 0.06 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ftj h ASN 252 Cb 0.89 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 1ftj h ASN 252 CO 0.08 0.75 0.12 0.50 -1.65 0.00 0.00 177.43 177.24 1ftj h LYS 253 N 1.14 0.30 0.00 0.81 3.64 -1.02 0.29 116.57 121.73 1ftj h LYS 253 Ca 0.30 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1ftj h LYS 253 Cb -0.07 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1ftj h LYS 253 CO -0.06 0.27 -0.77 -1.49 -2.27 0.00 0.00 179.45 175.12 1ftj h TRP 254 N 0.25 0.00 0.00 1.91 4.06 -1.37 -3.23 115.95 117.58 1ftj h TRP 254 Ca 0.08 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.82 1ftj h TRP 254 Cb 0.05 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.18 1ftj h TRP 254 CO -0.04 0.00 -1.64 0.91 -3.56 0.00 0.00 178.44 174.11 1ftj n TRP 255 N -2.44 0.00 -0.11 0.49 8.01 -0.24 -4.80 117.44 118.36 1ftj n TRP 255 Ca 0.02 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 56.04 1ftj n TRP 255 Cb 0.50 -0.67 -0.09 0.00 -2.01 0.00 0.00 31.31 29.03 1ftj n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1ftj n TYR 256 N -4.25 0.00 -0.33 -5.99 4.01 -0.98 -3.90 117.16 105.71 1ftj n TYR 256 Ca -0.31 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.45 1ftj n TYR 256 Cb 0.66 -0.81 0.16 0.00 -0.31 0.00 0.00 39.34 39.03 1ftj n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1ftj h ASP 257 N -0.18 0.91 -0.45 7.72 3.32 -0.59 -0.96 116.42 126.19 1ftj h ASP 257 Ca -0.49 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1ftj h ASP 257 Cb 1.68 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 41.06 1ftj h ASP 257 CO -0.13 0.58 0.00 0.29 -1.72 0.00 0.00 179.24 178.25 1ftj n LYS 258 N -4.58 3.84 -1.79 3.56 5.02 -1.22 -5.00 118.16 117.99 1ftj n LYS 258 Ca 0.14 -2.38 -0.41 0.00 -2.02 0.00 0.00 58.31 53.64 1ftj n LYS 258 Cb 0.19 -2.03 -0.01 0.00 -0.02 0.00 0.00 35.03 33.16 1ftj n LYS 258 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1ftj s GLY 259 N -0.63 2.63 0.00 0.72 0.00 -0.37 -4.94 107.32 104.73 1ftj s GLY 259 Ca 0.41 1.57 0.22 0.00 0.00 0.00 0.00 44.72 46.93 1ftj s GLY 259 CO 0.13 2.37 1.20 1.18 0.00 0.00 0.00 173.10 177.98 1ftj n GLU 260 N 1.11 2.04 0.00 2.90 1.02 0.64 -5.05 120.64 123.29 1ftj n GLU 260 Ca 0.04 -1.82 0.05 0.00 -0.02 0.00 0.00 57.16 55.41 1ftj n GLU 260 Cb 0.39 -1.42 0.05 0.00 -0.02 0.00 0.00 31.44 30.43 1ftj n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31