#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f8r n GLU 14 N 0.00 0.00 -4.24 1.61 2.13 -1.26 -4.62 120.64 114.26 3f8r n GLU 14 Ca 0.00 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.47 3f8r n GLU 14 Cb 0.00 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 31.62 3f8r n GLU 14 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 3f8r s LYS 15 N -5.33 3.11 0.17 5.31 2.20 -1.26 -1.46 119.74 122.48 3f8r s LYS 15 Ca 0.00 -0.33 0.09 0.00 -0.36 0.00 0.00 55.97 55.36 3f8r s LYS 15 Cb 0.00 -2.90 -0.04 0.00 -1.51 0.00 0.00 37.83 33.38 3f8r s LYS 15 CO 0.00 0.72 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.47 3f8r s PHE 16 N -0.92 1.83 0.21 4.03 0.40 -0.16 -4.98 117.98 118.40 3f8r s PHE 16 Ca 0.14 -0.47 -0.00 0.00 -0.60 0.00 0.00 56.93 55.99 3f8r s PHE 16 Cb -0.12 -0.91 0.18 0.00 0.51 0.00 0.00 43.02 42.69 3f8r s PHE 16 CO 0.03 0.34 1.54 -0.44 0.70 0.00 0.00 175.22 177.40 3f8r h ASP 17 N 3.17 0.51 -3.67 1.36 3.32 -1.09 -1.41 116.42 118.61 3f8r h ASP 17 Ca -0.42 -0.26 -0.14 0.00 0.02 0.00 0.00 57.03 56.23 3f8r h ASP 17 Cb 1.21 -0.15 -0.26 0.00 0.22 0.00 0.00 39.33 40.36 3f8r h ASP 17 CO 0.52 0.94 -0.32 0.54 -1.72 0.00 0.00 179.24 179.20 3f8r s VAL 18 N -3.99 -0.01 -0.12 -1.35 0.11 -0.94 -1.01 120.40 113.09 3f8r s VAL 18 Ca -0.06 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.03 3f8r s VAL 18 Cb 0.12 -0.51 -0.01 0.00 -1.53 0.00 0.00 36.38 34.45 3f8r s VAL 18 CO 0.82 0.01 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.82 3f8r s ILE 19 N 0.57 2.75 -0.21 7.04 1.01 -0.69 -1.86 121.20 129.80 3f8r s ILE 19 Ca -0.03 -0.77 -0.08 0.00 0.00 0.00 0.00 60.65 59.77 3f8r s ILE 19 Cb -0.05 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 3f8r s ILE 19 CO -0.03 0.53 0.09 -0.63 0.00 0.00 0.00 174.94 174.90 3f8r s ILE 20 N 0.38 4.85 -0.32 2.92 1.01 0.54 -1.33 121.20 129.24 3f8r s ILE 20 Ca -0.13 -0.00 -0.11 0.00 0.00 0.00 0.00 60.65 60.41 3f8r s ILE 20 Cb -0.16 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.07 3f8r s ILE 20 CO 0.06 0.41 0.19 -0.69 0.00 0.00 0.00 174.94 174.90 3f8r s VAL 21 N 0.80 4.88 0.00 2.92 1.01 0.46 -0.90 120.40 129.57 3f8r s VAL 21 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.71 3f8r s VAL 21 Cb -0.13 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.76 3f8r s VAL 21 CO 0.02 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.78 3f8r n GLY 22 N 5.03 2.98 2.68 4.51 0.00 -0.23 0.10 105.19 120.27 3f8r n GLY 22 Ca -0.13 -2.04 -0.00 0.00 0.00 0.00 0.00 46.02 43.85 3f8r n GLY 22 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3f8r n LEU 23 N 0.00 0.79 0.00 0.99 7.94 -1.26 -4.23 117.00 121.23 3f8r n LEU 23 Ca 0.00 -2.98 0.00 0.00 -1.11 0.00 0.00 56.01 51.92 3f8r n LEU 23 Cb 0.00 0.35 0.00 0.00 0.53 0.00 0.00 43.42 44.30 3f8r n LEU 23 CO 0.00 1.16 0.00 0.61 -1.11 0.00 0.00 177.39 178.05 3f8r n GLY 24 N -0.74 2.22 0.35 -3.96 0.00 -1.26 -0.08 105.19 101.73 3f8r n GLY 24 Ca 0.01 -2.13 0.10 0.00 0.00 0.00 0.00 46.02 43.99 3f8r n GLY 24 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3f8r h PRO 25 N 0.00 0.81 -0.32 1.61 0.11 -1.95 -0.91 132.00 131.36 3f8r h PRO 25 Ca 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 3f8r h PRO 25 Cb 0.00 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 3f8r h PRO 25 CO 0.00 0.54 0.16 0.00 -0.21 0.00 0.00 178.00 178.48 3f8r h ALA 26 N 1.59 0.41 -0.31 -0.75 0.00 -1.89 0.08 119.26 118.38 3f8r h ALA 26 Ca 0.53 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 3f8r h ALA 26 Cb 0.70 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3f8r h ALA 26 CO -0.33 -0.03 0.18 0.00 0.00 0.00 0.00 179.25 179.06 3f8r h ALA 27 N 1.01 0.40 -0.34 0.00 0.00 -1.66 0.32 119.26 119.00 3f8r h ALA 27 Ca 0.11 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3f8r h ALA 27 Cb 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3f8r h ALA 27 CO -0.01 -0.08 0.16 1.88 0.00 0.00 0.00 179.25 181.19 3f8r h TYR 28 N 0.39 0.29 -0.65 0.00 0.05 -0.90 0.28 116.97 116.43 3f8r h TYR 28 Ca 0.11 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.88 3f8r h TYR 28 Cb 0.05 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.68 3f8r h TYR 28 CO -0.03 0.15 0.29 0.78 -1.05 0.00 0.00 178.16 178.29 3f8r h GLY 29 N 0.33 0.99 1.12 3.88 0.00 -0.75 -1.03 103.07 107.61 3f8r h GLY 29 Ca 0.14 -0.49 -0.18 0.00 0.00 0.00 0.00 47.33 46.81 3f8r h GLY 29 CO -0.11 0.46 -0.50 0.00 0.00 0.00 0.00 176.54 176.39 3f8r h ALA 30 N 1.40 0.46 -0.68 3.60 0.00 -0.47 -3.01 119.26 120.56 3f8r h ALA 30 Ca 0.22 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 3f8r h ALA 30 Cb 0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3f8r h ALA 30 CO -0.03 0.64 0.32 0.00 0.00 0.00 0.00 179.25 180.19 3f8r h ALA 31 N 0.68 0.87 -0.12 0.00 0.00 -0.06 0.14 119.26 120.78 3f8r h ALA 31 Ca 0.02 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.80 3f8r h ALA 31 Cb 1.11 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3f8r h ALA 31 CO 0.11 0.44 0.02 1.25 0.00 0.00 0.00 179.25 181.08 3f8r h LEU 32 N 0.94 0.01 -0.48 0.00 5.85 -1.17 -1.18 115.31 119.28 3f8r h LEU 32 Ca 0.23 0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.81 3f8r h LEU 32 Cb 0.13 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3f8r h LEU 32 CO -0.03 0.02 -0.48 1.88 -0.34 0.00 0.00 178.44 179.50 3f8r h TYR 33 N 0.07 0.88 -0.39 1.25 -1.99 -1.45 -1.53 116.97 113.81 3f8r h TYR 33 Ca 0.05 -0.29 0.02 0.00 2.00 0.00 0.00 58.73 60.51 3f8r h TYR 33 Cb 0.04 -0.17 -0.03 0.00 2.00 0.00 0.00 36.73 38.57 3f8r h TYR 33 CO -0.12 1.05 0.23 0.77 -0.00 0.00 0.00 178.16 180.09 3f8r h SER 34 N 0.57 0.36 -0.48 3.88 0.02 -0.75 -1.06 113.55 116.09 3f8r h SER 34 Ca 0.03 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.94 3f8r h SER 34 Cb 1.04 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 3f8r h SER 34 CO 0.10 0.26 0.14 0.00 -1.14 0.00 0.00 176.83 176.19 3f8r h ALA 35 N 1.17 0.63 0.00 3.77 0.00 -1.17 -2.01 119.26 121.65 3f8r h ALA 35 Ca 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3f8r h ALA 35 Cb 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3f8r h ALA 35 CO -0.07 0.30 -0.06 0.00 0.00 0.00 0.00 179.25 179.41 3f8r h ARG 36 N 0.64 0.00 -0.19 0.00 3.08 -0.94 0.23 114.38 117.21 3f8r h ARG 36 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 3f8r h ARG 36 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3f8r h ARG 36 CO -0.00 0.06 0.00 0.66 -1.07 0.00 0.00 179.97 179.62 3f8r n TYR 37 N -3.40 0.25 -2.98 3.04 4.01 -0.43 -4.89 117.16 112.76 3f8r n TYR 37 Ca -0.02 -0.13 -0.22 0.00 -0.16 0.00 0.00 57.90 57.37 3f8r n TYR 37 Cb 0.21 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.27 3f8r n TYR 37 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3f8r n MET 38 N 0.12 -4.72 -3.05 -0.72 2.81 0.82 -4.98 117.12 107.40 3f8r n MET 38 Ca 0.11 0.92 -0.39 0.00 -1.81 0.00 0.00 57.70 56.54 3f8r n MET 38 Cb 0.23 -5.78 -0.06 0.00 -0.71 0.00 0.00 33.22 26.90 3f8r n MET 38 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3f8r s LEU 39 N -6.66 4.55 -0.51 4.03 1.43 -0.78 -4.98 118.68 115.75 3f8r s LEU 39 Ca 0.29 1.54 -0.28 0.00 -1.03 0.00 0.00 54.13 54.65 3f8r s LEU 39 Cb -0.13 -3.26 0.01 0.00 0.03 0.00 0.00 46.19 42.85 3f8r s LEU 39 CO 0.35 0.20 1.41 -0.75 0.23 0.00 0.00 176.35 177.79 3f8r s LYS 40 N -1.26 3.40 0.09 1.70 2.20 -1.26 -4.49 119.74 120.11 3f8r s LYS 40 Ca 0.35 0.62 0.06 0.00 -0.36 0.00 0.00 55.97 56.65 3f8r s LYS 40 Cb -0.21 -4.09 -0.04 0.00 -1.51 0.00 0.00 37.83 31.98 3f8r s LYS 40 CO 0.24 -1.81 -0.08 0.99 -0.36 0.00 0.00 175.35 174.34 3f8r s THR 41 N 5.84 3.52 -0.03 3.43 2.01 -1.26 -0.48 115.64 128.67 3f8r s THR 41 Ca 0.55 -1.15 -0.01 0.00 0.31 0.00 0.00 61.69 61.40 3f8r s THR 41 Cb -0.12 -2.64 0.03 0.00 0.01 0.00 0.00 72.50 69.79 3f8r s THR 41 CO 0.28 0.15 0.06 -0.22 -0.69 0.00 0.00 174.62 174.20 3f8r s LEU 42 N -2.11 1.11 -0.14 4.42 2.96 -0.78 -4.22 118.68 119.91 3f8r s LEU 42 Ca 0.22 0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 54.20 3f8r s LEU 42 Cb -0.11 0.06 -0.03 0.00 0.50 0.00 0.00 46.19 46.61 3f8r s LEU 42 CO 0.14 -0.12 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.33 3f8r s VAL 43 N 0.94 3.93 -0.26 1.68 1.01 -0.50 -0.34 120.40 126.86 3f8r s VAL 43 Ca -0.08 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.56 3f8r s VAL 43 Cb -0.11 -2.71 0.08 0.00 0.00 0.00 0.00 36.38 33.64 3f8r s VAL 43 CO -0.03 0.51 0.01 -0.63 0.00 0.00 0.00 175.10 174.96 3f8r s ILE 44 N 0.16 1.35 0.02 2.22 1.01 -0.08 0.02 121.20 125.91 3f8r s ILE 44 Ca -0.01 -1.35 -0.02 0.00 0.00 0.00 0.00 60.65 59.27 3f8r s ILE 44 Cb -0.14 -1.80 -0.01 0.00 0.01 0.00 0.00 42.46 40.51 3f8r s ILE 44 CO 0.03 -0.34 0.01 -0.83 0.00 0.00 0.00 174.94 173.81 3f8r s GLY 45 N 1.43 0.19 0.08 6.18 0.00 -0.51 -1.06 107.32 113.63 3f8r s GLY 45 Ca 0.01 -0.46 -0.02 0.00 0.00 0.00 0.00 44.72 44.25 3f8r s GLY 45 CO -0.11 -0.55 1.17 -2.09 0.00 0.00 0.00 173.10 171.52 3f8r h GLU 46 N 4.62 0.22 -3.59 2.90 4.57 -1.79 -2.54 114.58 118.97 3f8r h GLU 46 Ca -0.31 -0.38 -0.51 0.00 -1.18 0.00 0.00 59.36 56.98 3f8r h GLU 46 Cb 1.21 0.14 -0.40 0.00 -0.16 0.00 0.00 28.75 29.54 3f8r h GLU 46 CO 0.41 1.18 -0.77 0.99 -1.18 0.00 0.00 179.01 179.64 3f8r s THR 47 N -2.67 0.55 -0.08 0.32 2.01 -1.26 -4.70 115.64 109.80 3f8r s THR 47 Ca -0.03 -0.53 -0.34 0.00 0.31 0.00 0.00 61.69 61.10 3f8r s THR 47 Cb 0.08 -1.02 -0.12 0.00 0.01 0.00 0.00 72.50 71.45 3f8r s THR 47 CO 0.87 -0.17 1.88 -2.65 -0.69 0.00 0.00 174.62 173.86 3f8r n PRO 48 N 5.04 2.18 0.00 4.92 -0.02 -1.26 -0.90 135.00 144.96 3f8r n PRO 48 Ca -0.09 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3f8r n PRO 48 Cb 0.47 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 3f8r n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f8r n GLY 49 N 4.38 3.42 7.00 -1.23 0.00 0.89 -4.72 105.19 114.94 3f8r n GLY 49 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3f8r n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f8r n GLY 50 N -1.81 3.02 0.00 -0.02 0.00 -0.08 -1.43 105.19 104.87 3f8r n GLY 50 Ca 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 46.02 45.79 3f8r n GLY 50 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3f8r n GLN 51 N 14.00 0.02 0.26 1.61 6.02 -1.26 -1.26 117.38 136.77 3f8r n GLN 51 Ca 0.00 0.35 0.17 0.00 -0.01 0.00 0.00 57.00 57.51 3f8r n GLN 51 Cb 0.00 -1.50 0.64 0.00 1.02 0.00 0.00 30.24 30.40 3f8r n GLN 51 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3f8r h LEU 52 N 0.00 0.00 -1.05 1.08 3.38 -1.61 -2.36 115.31 114.75 3f8r h LEU 52 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3f8r h LEU 52 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3f8r h LEU 52 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.88 3f8r n THR 53 N -3.03 0.91 -0.08 0.22 -2.24 -0.39 -2.10 114.28 107.57 3f8r n THR 53 Ca 0.01 0.45 0.05 0.00 -2.27 0.00 0.00 64.05 62.28 3f8r n THR 53 Cb 0.31 -1.42 0.11 0.00 -2.10 0.00 0.00 70.33 67.24 3f8r n THR 53 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3f8r n GLU 54 N -2.27 2.59 -3.99 -0.78 1.02 -0.89 -5.02 120.64 111.29 3f8r n GLU 54 Ca 0.01 -1.84 -0.21 0.00 -0.02 0.00 0.00 57.16 55.09 3f8r n GLU 54 Cb 0.15 -1.21 -0.02 0.00 -0.02 0.00 0.00 31.44 30.33 3f8r n GLU 54 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3f8r s ALA 55 N -0.97 3.88 0.00 0.62 0.00 -0.89 -4.61 121.76 119.79 3f8r s ALA 55 Ca 0.18 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.89 3f8r s ALA 55 Cb 0.10 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.55 3f8r s ALA 55 CO 0.13 0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.55 3f8r n GLY 56 N -1.34 0.25 3.74 0.00 0.00 -1.26 -4.44 105.19 102.14 3f8r n GLY 56 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 3f8r n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f8r s ILE 57 N 2.29 4.86 -0.23 -0.61 -1.09 -1.26 -0.20 121.20 124.96 3f8r s ILE 57 Ca 0.00 1.48 -0.06 0.00 -2.23 0.00 0.00 60.65 59.84 3f8r s ILE 57 Cb 0.00 -4.05 -0.03 0.00 -1.58 0.00 0.00 42.46 36.81 3f8r s ILE 57 CO 0.00 0.35 0.04 -0.69 -1.23 0.00 0.00 174.94 173.41 3f8r s VAL 58 N 0.11 4.13 -0.07 2.92 1.01 0.73 -4.91 120.40 124.32 3f8r s VAL 58 Ca 0.36 -0.24 0.10 0.00 0.00 0.00 0.00 61.98 62.20 3f8r s VAL 58 Cb -0.19 -2.90 0.16 0.00 0.00 0.00 0.00 36.38 33.44 3f8r s VAL 58 CO 0.20 0.38 1.08 -0.67 0.00 0.00 0.00 175.10 176.09 3f8r n ASP 59 N 4.64 1.28 -0.32 3.32 2.03 -1.26 -1.67 116.55 124.56 3f8r n ASP 59 Ca -0.17 -2.58 0.04 0.00 0.52 0.00 0.00 54.79 52.61 3f8r n ASP 59 Cb 0.51 -0.32 0.10 0.00 -0.72 0.00 0.00 41.12 40.69 3f8r n ASP 59 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 3f8r n ASP 60 N -0.78 2.57 -4.24 1.67 5.68 -1.26 -4.86 116.55 115.33 3f8r n ASP 60 Ca 0.09 -2.25 -0.39 0.00 -0.50 0.00 0.00 54.79 51.73 3f8r n ASP 60 Cb 0.66 -0.19 -0.10 0.00 -1.14 0.00 0.00 41.12 40.34 3f8r n ASP 60 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3f8r s TYR 61 N -1.45 3.37 -0.11 2.11 5.04 -1.26 -4.79 117.35 120.27 3f8r s TYR 61 Ca 0.17 -1.69 -0.39 0.00 -2.44 0.00 0.00 57.07 52.72 3f8r s TYR 61 Cb 0.11 -2.99 -0.17 0.00 0.35 0.00 0.00 41.96 39.27 3f8r s TYR 61 CO 0.07 -0.87 1.52 -0.11 -1.34 0.00 0.00 175.55 174.82 3f8r n LEU 62 N 4.86 1.89 0.00 6.97 7.94 -1.26 -1.73 117.00 135.67 3f8r n LEU 62 Ca -0.09 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 55.91 3f8r n LEU 62 Cb 0.43 -1.14 0.00 0.00 0.53 0.00 0.00 43.42 43.23 3f8r n LEU 62 CO 0.38 -0.80 0.00 0.61 -1.11 0.00 0.00 177.39 176.47 3f8r n GLY 63 N 3.29 2.81 3.13 -3.96 0.00 -1.26 -4.99 105.19 104.21 3f8r n GLY 63 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 3f8r n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f8r s LEU 64 N 0.00 5.50 -0.03 0.99 1.43 -0.70 -5.06 118.68 120.81 3f8r s LEU 64 Ca 0.00 -3.00 -0.30 0.00 -1.03 0.00 0.00 54.13 49.80 3f8r s LEU 64 Cb 0.00 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 3f8r s LEU 64 CO 0.00 -0.36 1.15 -0.63 0.23 0.00 0.00 176.35 176.74 3f8r s ILE 65 N -0.27 4.35 -1.40 -0.59 1.01 -1.26 -3.96 121.20 119.08 3f8r s ILE 65 Ca 0.19 1.67 -0.08 0.00 0.00 0.00 0.00 60.65 62.43 3f8r s ILE 65 Cb -0.17 -4.07 0.01 0.00 0.01 0.00 0.00 42.46 38.24 3f8r s ILE 65 CO -0.06 0.04 0.35 -0.62 0.00 0.00 0.00 174.94 174.66 3f8r n GLU 66 N 4.73 -1.69 -3.43 2.79 1.02 -1.21 -4.92 120.64 117.92 3f8r n GLU 66 Ca 0.10 0.24 -0.38 0.00 -0.02 0.00 0.00 57.16 57.10 3f8r n GLU 66 Cb 0.47 -3.80 -0.06 0.00 -0.02 0.00 0.00 31.44 28.03 3f8r n GLU 66 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 3f8r s ILE 67 N -3.99 5.15 0.47 -3.67 2.07 -0.67 -4.82 121.20 115.75 3f8r s ILE 67 Ca 0.14 0.82 -0.24 0.00 -1.41 0.00 0.00 60.65 59.96 3f8r s ILE 67 Cb -0.07 -3.74 -0.07 0.00 0.13 0.00 0.00 42.46 38.71 3f8r s ILE 67 CO 0.94 0.44 1.41 -1.10 -1.91 0.00 0.00 174.94 174.72 3f8r s GLN 68 N -0.06 3.57 0.33 3.50 -1.52 -1.26 -0.19 119.66 124.02 3f8r s GLN 68 Ca 0.23 2.38 0.01 0.00 -1.95 0.00 0.00 55.36 56.03 3f8r s GLN 68 Cb -0.15 -2.57 0.56 0.00 -0.22 0.00 0.00 33.01 30.63 3f8r s GLN 68 CO 0.10 -0.90 1.95 0.00 -0.25 0.00 0.00 175.29 176.19 3f8r h ALA 69 N 2.13 1.44 -0.16 6.09 0.00 -0.80 -0.71 119.26 127.26 3f8r h ALA 69 Ca -0.51 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.25 3f8r h ALA 69 Cb 1.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3f8r h ALA 69 CO 0.60 0.46 -0.14 0.66 0.00 0.00 0.00 179.25 180.83 3f8r h SER 70 N 0.83 0.24 0.88 0.00 4.64 -1.83 -0.70 113.55 117.61 3f8r h SER 70 Ca 0.21 -0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 61.29 3f8r h SER 70 Cb 0.04 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.04 3f8r h SER 70 CO -0.03 0.41 -0.92 0.44 -0.87 0.00 0.00 176.83 175.86 3f8r h ASP 71 N 0.24 0.03 -0.30 4.97 3.32 -1.62 -2.79 116.42 120.27 3f8r h ASP 71 Ca 0.05 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 3f8r h ASP 71 Cb 0.40 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 3f8r h ASP 71 CO 0.02 0.93 0.04 -0.03 -1.72 0.00 0.00 179.24 178.49 3f8r h MET 72 N 0.01 0.50 -0.78 3.56 4.05 -0.25 -1.16 114.93 120.86 3f8r h MET 72 Ca -0.02 -0.14 0.07 0.00 -0.28 0.00 0.00 59.70 59.33 3f8r h MET 72 Cb 1.61 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 32.29 3f8r h MET 72 CO 0.12 0.61 0.46 0.82 0.23 0.00 0.00 176.91 179.15 3f8r h ILE 73 N 0.32 0.99 -0.50 1.77 2.04 -1.18 0.13 117.51 121.09 3f8r h ILE 73 Ca 0.09 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 3f8r h ILE 73 Cb 0.35 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 3f8r h ILE 73 CO 0.01 0.15 0.21 0.11 0.00 0.00 0.00 178.15 178.63 3f8r h LYS 74 N 0.83 0.75 0.00 2.37 1.57 -1.19 -0.03 116.57 120.86 3f8r h LYS 74 Ca 0.35 -0.13 -0.10 0.00 -1.87 0.00 0.00 60.65 58.90 3f8r h LYS 74 Cb 0.21 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 3f8r h LYS 74 CO -0.19 0.65 -0.47 -0.24 -0.57 0.00 0.00 179.45 178.64 3f8r h VAL 75 N 0.67 0.92 -0.37 0.50 3.04 -0.75 0.59 116.25 120.86 3f8r h VAL 75 Ca 0.17 -1.96 -0.12 0.00 -1.01 0.00 0.00 66.70 63.78 3f8r h VAL 75 Cb 0.18 2.21 -0.01 0.00 -2.01 0.00 0.00 31.29 31.66 3f8r h VAL 75 CO -0.02 0.46 -0.23 -0.26 -1.01 0.00 0.00 177.57 176.51 3f8r h PHE 76 N 0.00 0.94 -0.35 3.17 -1.00 -0.77 -0.82 116.94 118.10 3f8r h PHE 76 Ca -0.00 -0.25 -0.14 0.00 2.81 0.00 0.00 57.97 60.39 3f8r h PHE 76 Cb 1.18 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 40.52 3f8r h PHE 76 CO 0.00 1.01 -0.34 -0.97 -1.61 0.00 0.00 178.31 176.40 3f8r h ASN 77 N 0.60 0.82 -0.86 2.17 -0.73 -0.79 -2.82 115.58 113.96 3f8r h ASN 77 Ca 0.07 -0.35 -0.02 0.00 1.87 0.00 0.00 56.30 57.88 3f8r h ASN 77 Cb 0.79 -0.23 -0.04 0.00 0.27 0.00 0.00 38.32 39.11 3f8r h ASN 77 CO 0.06 1.08 0.47 0.50 -0.37 0.00 0.00 177.43 179.18 3f8r h LYS 78 N 0.65 1.21 -0.26 6.67 3.64 -0.70 -1.45 116.57 126.33 3f8r h LYS 78 Ca 0.07 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 3f8r h LYS 78 Cb 0.88 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3f8r h LYS 78 CO 0.08 0.88 0.09 1.25 -2.27 0.00 0.00 179.45 179.48 3f8r h HIS 79 N 1.21 0.42 0.00 1.91 2.76 -0.94 -1.59 115.15 118.91 3f8r h HIS 79 Ca 0.30 -0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.38 3f8r h HIS 79 Cb 0.03 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.86 3f8r h HIS 79 CO 0.01 0.45 -0.28 -0.84 -1.30 0.00 0.00 177.93 175.97 3f8r h ILE 80 N 0.26 0.60 0.00 6.26 3.07 -1.35 -2.61 117.51 123.74 3f8r h ILE 80 Ca 0.09 -1.38 -0.02 0.00 1.55 0.00 0.00 64.86 65.09 3f8r h ILE 80 Cb 0.22 1.94 -0.00 0.00 -0.27 0.00 0.00 36.82 38.71 3f8r h ILE 80 CO -0.00 0.28 -0.10 -0.33 -1.05 0.00 0.00 178.15 176.94 3f8r h GLU 81 N 0.00 0.00 0.00 0.16 4.39 -0.93 -1.60 114.58 116.60 3f8r h GLU 81 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 3f8r h GLU 81 Cb 0.92 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.57 3f8r h GLU 81 CO 0.04 0.10 -0.07 -0.22 -1.16 0.00 0.00 179.01 177.70 3f8r h LYS 82 N 0.00 0.00 -0.54 2.33 3.64 -0.89 0.12 116.57 121.23 3f8r h LYS 82 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3f8r h LYS 82 Cb 0.76 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 3f8r h LYS 82 CO 0.01 0.07 0.00 0.66 -2.27 0.00 0.00 179.45 177.92 3f8r n TYR 83 N -3.39 0.71 -3.84 1.91 4.01 -0.63 -4.97 117.16 110.95 3f8r n TYR 83 Ca -0.01 -0.37 -0.27 0.00 -0.16 0.00 0.00 57.90 57.08 3f8r n TYR 83 Cb 0.22 -0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.28 3f8r n TYR 83 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3f8r n GLU 84 N 1.52 -5.34 -2.61 -0.72 1.02 0.43 -4.94 120.64 109.99 3f8r n GLU 84 Ca 0.21 0.60 -0.42 0.00 -0.02 0.00 0.00 57.16 57.53 3f8r n GLU 84 Cb 0.60 -5.38 -0.03 0.00 -0.02 0.00 0.00 31.44 26.62 3f8r n GLU 84 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3f8r s VAL 85 N -3.43 4.61 0.27 2.62 1.01 -1.12 -5.00 120.40 119.36 3f8r s VAL 85 Ca 0.44 1.88 -0.29 0.00 0.00 0.00 0.00 61.98 64.01 3f8r s VAL 85 Cb -0.22 -4.21 -0.09 0.00 0.00 0.00 0.00 36.38 31.86 3f8r s VAL 85 CO 0.82 0.05 1.12 -2.16 0.00 0.00 0.00 175.10 174.93 3f8r s PRO 86 N 1.76 4.60 -0.10 2.72 0.04 -1.26 -4.80 135.00 137.97 3f8r s PRO 86 Ca 0.52 1.84 0.01 0.00 0.04 0.00 0.00 61.00 63.41 3f8r s PRO 86 Cb -0.21 -3.19 0.02 0.00 0.04 0.00 0.00 34.50 31.16 3f8r s PRO 86 CO 0.22 0.15 -0.13 0.08 0.04 0.00 0.00 177.00 177.37 3f8r s VAL 87 N -1.04 1.29 -0.15 -0.36 1.01 -1.26 -1.41 120.40 118.48 3f8r s VAL 87 Ca 0.46 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.91 3f8r s VAL 87 Cb -0.33 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 3f8r s VAL 87 CO 0.42 0.40 -0.10 -0.76 0.00 0.00 0.00 175.10 175.06 3f8r s LEU 88 N 1.08 2.83 -0.59 3.92 1.43 0.10 -4.99 118.68 122.46 3f8r s LEU 88 Ca -0.06 -0.31 -0.22 0.00 -1.03 0.00 0.00 54.13 52.51 3f8r s LEU 88 Cb -0.15 -1.66 0.06 0.00 0.03 0.00 0.00 46.19 44.47 3f8r s LEU 88 CO -0.02 0.13 0.88 -0.76 0.23 0.00 0.00 176.35 176.81 3f8r s LEU 89 N 0.60 4.45 0.16 1.79 1.43 -1.26 -1.42 118.68 124.43 3f8r s LEU 89 Ca -0.06 -0.79 -0.25 0.00 -1.03 0.00 0.00 54.13 52.00 3f8r s LEU 89 Cb -0.15 -2.55 0.06 0.00 0.03 0.00 0.00 46.19 43.58 3f8r s LEU 89 CO 0.03 -1.26 0.92 -0.62 0.23 0.00 0.00 176.35 175.65 3f8r s ASP 90 N 3.23 -0.20 -0.17 2.29 2.15 -0.96 -4.92 116.67 118.09 3f8r s ASP 90 Ca 0.23 -0.40 -0.12 0.00 0.43 0.00 0.00 52.55 52.69 3f8r s ASP 90 Cb -0.16 0.51 -0.05 0.00 -0.30 0.00 0.00 42.92 42.92 3f8r s ASP 90 CO 0.13 -0.94 0.21 -0.63 -0.17 0.00 0.00 175.17 173.77 3f8r s ILE 91 N -3.36 5.36 -0.23 4.11 1.09 -1.26 -2.67 121.20 124.24 3f8r s ILE 91 Ca 0.12 0.36 -0.24 0.00 -1.10 0.00 0.00 60.65 59.78 3f8r s ILE 91 Cb -0.02 -3.54 -0.01 0.00 -1.06 0.00 0.00 42.46 37.83 3f8r s ILE 91 CO 0.02 0.43 0.82 -0.69 -0.10 0.00 0.00 174.94 175.42 3f8r s VAL 92 N 0.30 4.85 -0.06 2.92 1.01 -1.26 -1.38 120.40 126.77 3f8r s VAL 92 Ca 0.12 1.56 0.08 0.00 0.00 0.00 0.00 61.98 63.74 3f8r s VAL 92 Cb -0.12 -4.11 -0.24 0.00 0.00 0.00 0.00 36.38 31.91 3f8r s VAL 92 CO 0.01 -0.06 0.59 -0.62 0.00 0.00 0.00 175.10 175.02 3f8r n GLU 93 N 5.90 0.66 -3.61 2.72 1.02 0.17 -4.95 120.64 122.56 3f8r n GLU 93 Ca 0.05 0.29 -0.13 0.00 -0.02 0.00 0.00 57.16 57.35 3f8r n GLU 93 Cb 0.48 -1.77 -0.06 0.00 -0.02 0.00 0.00 31.44 30.07 3f8r n GLU 93 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3f8r s LYS 94 N -2.59 1.00 -0.24 3.49 2.47 -0.95 -5.01 119.74 117.91 3f8r s LYS 94 Ca -0.09 -0.31 -0.00 0.00 -1.56 0.00 0.00 55.97 54.01 3f8r s LYS 94 Cb 0.08 0.45 0.07 0.00 -1.46 0.00 0.00 37.83 36.96 3f8r s LYS 94 CO 0.81 -0.36 -0.00 0.42 0.16 0.00 0.00 175.35 176.38 3f8r s ILE 95 N -2.55 1.19 -0.13 5.43 1.01 -1.26 -1.31 121.20 123.58 3f8r s ILE 95 Ca -0.05 -1.11 -0.10 0.00 0.00 0.00 0.00 60.65 59.40 3f8r s ILE 95 Cb -0.01 -1.60 -0.05 0.00 0.01 0.00 0.00 42.46 40.82 3f8r s ILE 95 CO -0.03 -0.23 0.21 -0.70 0.00 0.00 0.00 174.94 174.19 3f8r s GLU 96 N 1.53 3.83 -0.67 2.79 2.12 0.13 -4.88 118.70 123.57 3f8r s GLU 96 Ca -0.02 -0.03 -0.16 0.00 0.36 0.00 0.00 54.97 55.13 3f8r s GLU 96 Cb -0.18 -3.29 0.15 0.00 0.26 0.00 0.00 34.13 31.07 3f8r s GLU 96 CO -0.09 0.56 0.66 1.21 -0.54 0.00 0.00 175.26 177.06 3f8r s ASN 97 N -0.44 6.40 0.00 -1.70 3.84 -1.26 -0.49 114.94 121.29 3f8r s ASN 97 Ca 0.15 -2.04 0.00 0.00 0.21 0.00 0.00 52.86 51.18 3f8r s ASN 97 Cb -0.13 -2.24 0.00 0.00 -0.55 0.00 0.00 41.25 38.34 3f8r s ASN 97 CO 0.04 -0.82 0.87 -1.14 -2.79 0.00 0.00 177.10 173.26 3f8r n ARG 98 N 5.10 0.98 0.00 0.43 0.63 0.88 -4.86 116.66 119.82 3f8r n ARG 98 Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 3f8r n ARG 98 Cb 0.43 -1.12 0.00 0.00 0.45 0.00 0.00 32.46 32.22 3f8r n ARG 98 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3f8r n GLY 99 N 0.40 0.52 0.15 5.14 0.00 -1.26 -3.73 105.19 106.41 3f8r n GLY 99 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.04 3f8r n GLY 99 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3f8r h ASP 100 N 0.00 0.00 -5.14 1.61 1.82 -2.00 -3.47 116.42 109.24 3f8r h ASP 100 Ca 0.00 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.55 3f8r h ASP 100 Cb 0.00 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 39.99 3f8r h ASP 100 CO 0.00 0.49 0.16 -1.83 -1.61 0.00 0.00 179.24 176.45 3f8r s GLU 101 N -3.08 2.16 0.09 0.28 -1.05 -1.24 -4.97 118.70 110.90 3f8r s GLU 101 Ca 0.03 -1.53 0.05 0.00 -0.15 0.00 0.00 54.97 53.37 3f8r s GLU 101 Cb 0.08 0.58 -0.04 0.00 -0.44 0.00 0.00 34.13 34.31 3f8r s GLU 101 CO 0.73 -0.99 0.00 -0.06 0.95 0.00 0.00 175.26 175.90 3f8r s PHE 102 N -2.48 2.99 -0.16 4.83 0.08 -0.50 -0.08 117.98 122.66 3f8r s PHE 102 Ca 0.19 -0.03 0.01 0.00 0.12 0.00 0.00 56.93 57.22 3f8r s PHE 102 Cb -0.04 -1.53 0.03 0.00 -0.57 0.00 0.00 43.02 40.90 3f8r s PHE 102 CO 0.14 0.48 -0.15 0.08 -0.10 0.00 0.00 175.22 175.67 3f8r s VAL 103 N -1.32 1.70 -0.34 -0.44 1.01 0.36 -1.42 120.40 119.95 3f8r s VAL 103 Ca 0.26 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 3f8r s VAL 103 Cb -0.12 -1.61 -0.00 0.00 0.00 0.00 0.00 36.38 34.65 3f8r s VAL 103 CO 0.18 0.43 0.21 -0.69 0.00 0.00 0.00 175.10 175.23 3f8r s VAL 104 N 1.42 4.93 -0.22 2.92 1.01 0.86 -0.69 120.40 130.63 3f8r s VAL 104 Ca 0.04 -0.43 -0.12 0.00 0.00 0.00 0.00 61.98 61.47 3f8r s VAL 104 Cb -0.13 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 3f8r s VAL 104 CO -0.11 -0.05 0.24 -0.54 0.00 0.00 0.00 175.10 174.64 3f8r s LYS 105 N 1.65 4.12 0.35 2.72 1.02 -0.43 -1.21 119.74 127.96 3f8r s LYS 105 Ca 0.05 -0.10 0.07 0.00 0.02 0.00 0.00 55.97 56.01 3f8r s LYS 105 Cb -0.18 -3.52 -0.02 0.00 -0.52 0.00 0.00 37.83 33.59 3f8r s LYS 105 CO 0.08 0.06 0.34 0.95 -0.92 0.00 0.00 175.35 175.87 3f8r s THR 106 N 1.04 3.47 0.02 2.17 -4.23 -0.89 0.43 115.64 117.65 3f8r s THR 106 Ca 0.11 -1.29 -0.22 0.00 -1.18 0.00 0.00 61.69 59.12 3f8r s THR 106 Cb -0.14 -3.19 -0.17 0.00 1.34 0.00 0.00 72.50 70.35 3f8r s THR 106 CO 0.05 -0.14 1.30 0.50 -0.54 0.00 0.00 174.62 175.79 3f8r h LYS 107 N 1.13 0.26 0.00 3.99 3.64 -1.53 -3.39 116.57 120.68 3f8r h LYS 107 Ca -0.44 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 58.75 3f8r h LYS 107 Cb 1.26 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 3f8r h LYS 107 CO 0.57 0.71 -1.30 0.54 -2.27 0.00 0.00 179.45 177.69 3f8r n ARG 108 N -4.61 1.41 -0.19 1.90 3.00 -1.26 -4.75 116.66 112.16 3f8r n ARG 108 Ca -0.07 -0.03 0.09 0.00 -0.01 0.00 0.00 57.85 57.83 3f8r n ARG 108 Cb 0.35 -1.13 0.25 0.00 0.00 0.00 0.00 32.46 31.93 3f8r n ARG 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3f8r n LYS 109 N -1.90 2.06 0.00 5.56 4.76 -1.26 -5.06 118.16 122.31 3f8r n LYS 109 Ca -0.04 -1.63 0.00 0.00 -2.87 0.00 0.00 58.31 53.77 3f8r n LYS 109 Cb 0.37 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.16 3f8r n LYS 109 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3f8r n GLY 110 N 1.26 -1.72 3.54 0.72 0.00 -1.26 -4.96 105.19 102.77 3f8r n GLY 110 Ca 0.16 -1.53 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 3f8r n GLY 110 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3f8r s GLU 111 N 0.00 1.94 0.07 1.61 -1.05 -1.26 -2.11 118.70 117.91 3f8r s GLU 111 Ca 0.00 -1.24 0.03 0.00 -0.15 0.00 0.00 54.97 53.61 3f8r s GLU 111 Cb 0.00 -2.14 -0.03 0.00 -0.44 0.00 0.00 34.13 31.52 3f8r s GLU 111 CO 0.00 0.45 -0.09 -0.06 0.95 0.00 0.00 175.26 176.51 3f8r s PHE 112 N -1.49 0.90 0.13 4.83 0.40 -0.35 -3.58 117.98 118.82 3f8r s PHE 112 Ca 0.22 -0.59 0.05 0.00 -0.60 0.00 0.00 56.93 56.01 3f8r s PHE 112 Cb -0.09 -0.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.88 3f8r s PHE 112 CO 0.13 -0.04 0.08 0.15 0.70 0.00 0.00 175.22 176.24 3f8r s LYS 113 N -2.23 2.77 -0.05 0.44 1.02 -0.53 -0.10 119.74 121.06 3f8r s LYS 113 Ca -0.02 -0.85 -0.28 0.00 0.02 0.00 0.00 55.97 54.84 3f8r s LYS 113 Cb -0.06 -2.61 0.06 0.00 -0.52 0.00 0.00 37.83 34.70 3f8r s LYS 113 CO -0.00 0.51 0.62 0.00 -0.92 0.00 0.00 175.35 175.56 3f8r s ALA 114 N -1.59 -1.61 -0.00 5.17 0.00 -0.51 -0.99 121.76 122.24 3f8r s ALA 114 Ca 0.29 1.16 0.13 0.00 0.00 0.00 0.00 51.96 53.54 3f8r s ALA 114 Cb -0.11 0.01 0.09 0.00 0.00 0.00 0.00 23.12 23.11 3f8r s ALA 114 CO 0.22 -0.35 1.45 -0.44 0.00 0.00 0.00 175.76 176.63 3f8r h ASP 115 N 3.15 0.00 -5.18 0.00 3.32 -1.14 -1.32 116.42 115.25 3f8r h ASP 115 Ca -0.27 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.68 3f8r h ASP 115 Cb 1.15 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.56 3f8r h ASP 115 CO 0.39 0.64 -0.41 -0.94 -1.72 0.00 0.00 179.24 177.21 3f8r s SER 116 N -6.55 0.16 -0.01 6.45 1.04 -0.18 -4.79 113.70 109.82 3f8r s SER 116 Ca 0.02 -0.72 0.02 0.00 0.48 0.00 0.00 55.95 55.75 3f8r s SER 116 Cb 0.09 0.33 -0.00 0.00 0.10 0.00 0.00 66.02 66.54 3f8r s SER 116 CO 0.76 -0.73 -0.08 -0.69 0.98 0.00 0.00 173.24 173.48 3f8r s VAL 117 N -3.88 0.62 -0.16 5.02 1.01 -0.19 -1.71 120.40 121.11 3f8r s VAL 117 Ca 0.07 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.73 3f8r s VAL 117 Cb 0.05 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 35.92 3f8r s VAL 117 CO -0.10 0.18 -0.21 -0.63 0.00 0.00 0.00 175.10 174.34 3f8r s ILE 118 N -0.14 2.06 -0.22 2.22 1.01 -0.44 -0.58 121.20 125.10 3f8r s ILE 118 Ca 0.02 -0.96 -0.15 0.00 0.00 0.00 0.00 60.65 59.57 3f8r s ILE 118 Cb -0.04 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 3f8r s ILE 118 CO -0.00 0.54 0.35 -0.76 0.00 0.00 0.00 174.94 175.07 3f8r s LEU 119 N 1.08 4.12 -0.38 2.97 1.43 0.16 -0.40 118.68 127.65 3f8r s LEU 119 Ca -0.00 0.39 0.12 0.00 -1.03 0.00 0.00 54.13 53.61 3f8r s LEU 119 Cb -0.14 -2.42 0.43 0.00 0.03 0.00 0.00 46.19 44.09 3f8r s LEU 119 CO -0.08 -0.08 1.01 0.61 0.23 0.00 0.00 176.35 178.04 3f8r n GLY 120 N 4.17 3.60 0.08 -3.19 0.00 0.12 -0.38 105.19 109.59 3f8r n GLY 120 Ca -0.09 -1.97 0.16 0.00 0.00 0.00 0.00 46.02 44.11 3f8r n GLY 120 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3f8r n ILE 121 N -0.23 0.00 -3.64 -0.61 -5.35 -1.21 -4.40 119.36 103.93 3f8r n ILE 121 Ca 0.23 -0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.67 3f8r n ILE 121 Cb 0.73 -0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.30 3f8r n ILE 121 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3f8r n GLY 122 N 1.05 0.83 3.25 3.28 0.00 -1.26 -4.89 105.19 107.45 3f8r n GLY 122 Ca 0.22 -0.84 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 3f8r n GLY 122 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3f8r s VAL 123 N 0.00 0.60 -0.17 1.61 -7.23 -1.26 -4.03 120.40 109.91 3f8r s VAL 123 Ca 0.00 -1.98 -0.17 0.00 -1.81 0.00 0.00 61.98 58.02 3f8r s VAL 123 Cb 0.00 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.66 3f8r s VAL 123 CO 0.00 -0.35 0.46 -0.54 -0.31 0.00 0.00 175.10 174.36 3f8r s LYS 124 N -3.96 4.24 0.01 4.82 -0.14 -0.91 -4.93 119.74 118.87 3f8r s LYS 124 Ca 0.28 0.35 -0.30 0.00 -1.36 0.00 0.00 55.97 54.93 3f8r s LYS 124 Cb 0.07 -3.51 -0.06 0.00 -1.68 0.00 0.00 37.83 32.64 3f8r s LYS 124 CO 0.06 -0.00 1.50 0.50 -0.76 0.00 0.00 175.35 176.65 3f8r s ARG 125 N 1.17 4.24 0.33 1.68 3.52 -1.26 -1.22 118.95 127.42 3f8r s ARG 125 Ca 0.23 2.09 -0.28 0.00 -0.13 0.00 0.00 55.73 57.64 3f8r s ARG 125 Cb -0.15 -3.63 -0.10 0.00 -1.56 0.00 0.00 34.95 29.52 3f8r s ARG 125 CO 0.09 -0.65 1.24 0.50 -0.81 0.00 0.00 175.30 175.67 3f8r s ARG 126 N 2.66 4.37 -0.04 5.12 3.52 -1.06 -4.91 118.95 128.61 3f8r s ARG 126 Ca 0.68 2.08 -0.00 0.00 -0.13 0.00 0.00 55.73 58.35 3f8r s ARG 126 Cb -0.34 -3.04 -0.03 0.00 -1.56 0.00 0.00 34.95 29.98 3f8r s ARG 126 CO 0.28 -0.13 0.01 0.15 -0.81 0.00 0.00 175.30 174.81 3f8r s LYS 127 N -1.79 2.92 0.04 5.12 1.02 -1.26 -4.88 119.74 120.91 3f8r s LYS 127 Ca 0.49 -0.49 -0.18 0.00 0.02 0.00 0.00 55.97 55.82 3f8r s LYS 127 Cb -0.37 -2.76 -0.21 0.00 -0.52 0.00 0.00 37.83 33.97 3f8r s LYS 127 CO 0.48 0.67 1.18 1.25 -0.92 0.00 0.00 175.35 178.01 3f8r h LEU 128 N 4.73 0.66 -1.09 3.17 5.85 -2.01 -3.48 115.31 123.13 3f8r h LEU 128 Ca -0.50 -0.70 -0.15 0.00 0.84 0.00 0.00 57.88 57.37 3f8r h LEU 128 Cb 1.19 -0.20 0.06 0.00 0.37 0.00 0.00 40.66 42.07 3f8r h LEU 128 CO 0.56 1.27 -0.26 0.61 -0.34 0.00 0.00 178.44 180.28 3f8r n GLY 129 N 0.91 0.34 3.45 3.75 0.00 -1.26 -5.05 105.19 107.32 3f8r n GLY 129 Ca -0.09 -0.31 -0.28 0.00 0.00 0.00 0.00 46.02 45.33 3f8r n GLY 129 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3f8r s VAL 130 N -3.12 2.55 0.24 1.61 -7.23 -1.26 -5.07 120.40 108.11 3f8r s VAL 130 Ca 0.19 -1.76 -0.32 0.00 -1.81 0.00 0.00 61.98 58.29 3f8r s VAL 130 Cb -0.08 -2.18 -0.13 0.00 0.56 0.00 0.00 36.38 34.55 3f8r s VAL 130 CO 0.28 0.01 1.58 -2.65 -0.31 0.00 0.00 175.10 174.01 3f8r n PRO 131 N 0.60 2.47 0.00 4.82 -0.02 -1.26 -1.54 135.00 140.07 3f8r n PRO 131 Ca -0.15 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3f8r n PRO 131 Cb 0.54 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 3f8r n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f8r n GLY 132 N 2.84 2.81 0.37 -1.23 0.00 -1.26 -1.46 105.19 107.26 3f8r n GLY 132 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 3f8r n GLY 132 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3f8r h GLU 133 N 0.66 0.72 0.17 1.61 4.81 -1.56 -1.20 114.58 119.79 3f8r h GLU 133 Ca 0.00 -0.04 -0.30 0.00 -0.13 0.00 0.00 59.36 58.88 3f8r h GLU 133 Cb 0.00 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.23 3f8r h GLU 133 CO 0.00 0.47 -1.48 1.96 -0.73 0.00 0.00 179.01 179.24 3f8r h GLN 134 N 0.74 0.36 -0.08 1.92 4.20 -1.92 -3.37 115.11 116.95 3f8r h GLN 134 Ca 0.52 -0.61 0.02 0.00 0.06 0.00 0.00 58.65 58.64 3f8r h GLN 134 Cb 0.84 0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 3f8r h GLN 134 CO -0.29 1.29 0.06 1.49 -0.67 0.00 0.00 178.83 180.71 3f8r h GLU 135 N -0.08 0.03 -0.25 1.46 4.81 -1.78 -3.17 114.58 115.60 3f8r h GLU 135 Ca -0.29 -0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.83 3f8r h GLU 135 Cb 1.94 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 31.25 3f8r h GLU 135 CO 0.15 0.02 -0.14 1.19 -0.73 0.00 0.00 179.01 179.50 3f8r n PHE 136 N -4.52 0.78 -2.29 0.92 3.72 -0.52 -4.91 117.46 110.64 3f8r n PHE 136 Ca -0.01 -1.43 -0.41 0.00 -0.05 0.00 0.00 57.45 55.55 3f8r n PHE 136 Cb 0.14 -0.39 -0.03 0.00 -0.94 0.00 0.00 39.48 38.26 3f8r n PHE 136 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3f8r s ALA 137 N -3.16 3.46 0.00 4.37 0.00 -1.20 -1.49 121.76 123.75 3f8r s ALA 137 Ca 0.42 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.45 3f8r s ALA 137 Cb 0.38 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 20.08 3f8r s ALA 137 CO 0.00 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.75 3f8r n GLY 138 N 1.31 0.17 1.78 0.00 0.00 -1.25 -4.73 105.19 102.48 3f8r n GLY 138 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 3f8r n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f8r n ARG 139 N -1.53 2.08 0.00 1.61 1.74 -0.55 -4.89 116.66 115.11 3f8r n ARG 139 Ca 0.00 -3.45 0.00 0.00 -0.77 0.00 0.00 57.85 53.63 3f8r n ARG 139 Cb 0.08 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 3f8r n ARG 139 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3f8r n GLY 140 N -0.59 1.28 3.67 -0.13 0.00 -1.12 -1.93 105.19 106.38 3f8r n GLY 140 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 3f8r n GLY 140 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f8r s ILE 141 N -1.50 4.12 0.02 -0.61 1.01 -0.75 -0.07 121.20 123.43 3f8r s ILE 141 Ca 0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 60.65 60.06 3f8r s ILE 141 Cb 0.00 -2.80 -0.00 0.00 0.01 0.00 0.00 42.46 39.66 3f8r s ILE 141 CO 0.00 0.44 0.12 -0.55 0.00 0.00 0.00 174.94 174.95 3f8r s SER 142 N -1.35 0.10 -0.01 3.58 0.15 0.38 -3.75 113.70 112.80 3f8r s SER 142 Ca 0.17 -0.38 0.05 0.00 0.70 0.00 0.00 55.95 56.50 3f8r s SER 142 Cb -0.11 0.22 0.14 0.00 -1.71 0.00 0.00 66.02 64.55 3f8r s SER 142 CO 0.08 -0.45 1.11 -1.22 1.20 0.00 0.00 173.24 173.96 3f8r n TYR 143 N 1.08 0.20 -3.42 3.44 4.01 -1.26 0.13 117.16 121.34 3f8r n TYR 143 Ca -0.21 -0.53 -0.18 0.00 -0.16 0.00 0.00 57.90 56.83 3f8r n TYR 143 Cb 0.57 -0.05 -0.10 0.00 -0.31 0.00 0.00 39.34 39.45 3f8r n TYR 143 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3f8r h SER 145 N 8.28 0.82 -0.91 0.00 0.02 -1.92 -1.92 113.55 117.91 3f8r h SER 145 Ca -0.15 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.57 3f8r h SER 145 Cb 1.09 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 63.37 3f8r h SER 145 CO 0.33 0.83 0.52 -0.37 -1.14 0.00 0.00 176.83 176.99 3f8r h VAL 146 N 0.77 1.26 0.02 2.27 -1.51 -1.94 -1.00 116.25 116.11 3f8r h VAL 146 Ca 0.17 -0.62 -0.00 0.00 -1.23 0.00 0.00 66.70 65.03 3f8r h VAL 146 Cb 0.32 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.48 3f8r h VAL 146 CO -0.00 0.29 -0.01 0.00 -1.23 0.00 0.00 177.57 176.61 3f8r n ASP 148 N -4.92 1.39 -0.30 0.00 8.00 -0.75 -4.55 116.55 115.43 3f8r n ASP 148 Ca -0.08 -1.20 0.14 0.00 0.71 0.00 0.00 54.79 54.36 3f8r n ASP 148 Cb 0.21 0.77 0.31 0.00 -0.02 0.00 0.00 41.12 42.39 3f8r n ASP 148 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3f8r h ALA 149 N 3.23 1.42 -0.09 2.24 0.00 -1.37 0.12 119.26 124.81 3f8r h ALA 149 Ca 0.00 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.11 3f8r h ALA 149 Cb 0.58 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 3f8r h ALA 149 CO 0.00 -0.38 0.11 -1.35 0.00 0.00 0.00 179.25 177.63 3f8r h PRO 150 N 0.35 0.00 0.00 0.00 0.11 -1.84 0.20 132.00 130.82 3f8r h PRO 150 Ca 0.56 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.67 3f8r h PRO 150 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3f8r h PRO 150 CO -0.56 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.51 3f8r n LEU 151 N -3.74 0.07 -1.72 2.35 4.77 0.43 -3.60 117.00 115.56 3f8r n LEU 151 Ca -0.01 0.52 -0.18 0.00 -0.03 0.00 0.00 56.01 56.31 3f8r n LEU 151 Cb 0.21 -0.50 0.07 0.00 -2.33 0.00 0.00 43.42 40.87 3f8r n LEU 151 CO 0.26 -0.23 0.34 0.49 -1.33 0.00 0.00 177.39 176.92 3f8r n PHE 152 N -1.58 2.16 -1.94 -1.77 3.01 0.70 -5.03 117.46 113.02 3f8r n PHE 152 Ca 0.04 -2.11 -0.42 0.00 1.01 0.00 0.00 57.45 55.98 3f8r n PHE 152 Cb 0.21 -0.41 -0.02 0.00 -0.01 0.00 0.00 39.48 39.24 3f8r n PHE 152 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 3f8r s LYS 153 N -3.53 4.22 -1.34 -1.08 2.20 -1.24 -2.74 119.74 116.24 3f8r s LYS 153 Ca 0.49 2.38 -0.00 0.00 -0.36 0.00 0.00 55.97 58.48 3f8r s LYS 153 Cb 0.41 -3.11 -0.00 0.00 -1.51 0.00 0.00 37.83 33.62 3f8r s LYS 153 CO 0.01 -0.54 0.60 0.09 -0.36 0.00 0.00 175.35 175.15 3f8r n ASN 154 N 3.00 -0.89 -3.77 1.43 3.02 0.27 -4.87 115.26 113.45 3f8r n ASN 154 Ca 0.10 -0.89 -0.18 0.00 -0.03 0.00 0.00 54.58 53.59 3f8r n ASN 154 Cb 0.39 -3.70 -0.09 0.00 -0.61 0.00 0.00 39.78 35.77 3f8r n ASN 154 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3f8r s ARG 155 N -6.18 1.58 -0.15 3.52 1.81 -1.11 -4.68 118.95 113.75 3f8r s ARG 155 Ca 0.01 -1.90 -0.02 0.00 -1.72 0.00 0.00 55.73 52.10 3f8r s ARG 155 Cb -0.00 0.15 -0.02 0.00 -0.45 0.00 0.00 34.95 34.63 3f8r s ARG 155 CO 0.84 -0.52 -0.09 0.08 -0.68 0.00 0.00 175.30 174.92 3f8r s VAL 156 N -3.66 3.32 0.18 3.52 1.01 -1.26 -0.08 120.40 123.42 3f8r s VAL 156 Ca 0.38 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.82 3f8r s VAL 156 Cb 0.04 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 3f8r s VAL 156 CO 0.20 0.50 -0.00 0.68 0.00 0.00 0.00 175.10 176.48 3f8r s VAL 157 N 0.53 0.72 -0.02 2.92 -7.23 -0.87 0.15 120.40 116.60 3f8r s VAL 157 Ca -0.06 -1.99 0.05 0.00 -1.81 0.00 0.00 61.98 58.17 3f8r s VAL 157 Cb -0.15 -2.13 -0.01 0.00 0.56 0.00 0.00 36.38 34.65 3f8r s VAL 157 CO 0.03 -0.47 -0.18 0.00 -0.31 0.00 0.00 175.10 174.18 3f8r s ALA 158 N -3.63 1.49 -0.09 1.32 0.00 -0.13 -2.02 121.76 118.70 3f8r s ALA 158 Ca 0.24 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.48 3f8r s ALA 158 Cb 0.06 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 3f8r s ALA 158 CO 0.04 0.34 -0.17 0.08 0.00 0.00 0.00 175.76 176.05 3f8r s VAL 159 N -0.28 2.78 -0.17 0.00 1.01 0.64 -0.18 120.40 124.20 3f8r s VAL 159 Ca 0.04 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 3f8r s VAL 159 Cb -0.08 -2.11 -0.00 0.00 0.00 0.00 0.00 36.38 34.18 3f8r s VAL 159 CO 0.00 0.55 -0.13 -0.63 0.00 0.00 0.00 175.10 174.90 3f8r s ILE 160 N -0.04 2.82 0.00 2.22 1.01 -0.02 -0.69 121.20 126.51 3f8r s ILE 160 Ca -0.04 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.90 3f8r s ILE 160 Cb -0.14 -2.22 0.00 0.00 0.01 0.00 0.00 42.46 40.11 3f8r s ILE 160 CO 0.04 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.09 3f8r n GLY 161 N 4.24 2.73 0.35 6.18 0.00 -0.72 -0.90 105.19 117.08 3f8r n GLY 161 Ca -0.19 -1.80 0.01 0.00 0.00 0.00 0.00 46.02 44.04 3f8r n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f8r n GLY 162 N -1.93 0.71 0.00 -0.02 0.00 -1.26 -4.50 105.19 98.19 3f8r n GLY 162 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3f8r n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f8r n GLY 163 N -0.22 2.02 0.20 -0.02 0.00 -1.26 -1.84 105.19 104.05 3f8r n GLY 163 Ca 0.02 -2.07 -0.08 0.00 0.00 0.00 0.00 46.02 43.90 3f8r n GLY 163 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3f8r h ASP 164 N 0.00 0.54 -0.58 1.61 3.32 -1.92 -2.05 116.42 117.34 3f8r h ASP 164 Ca 0.00 -0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.03 3f8r h ASP 164 Cb 0.00 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 3f8r h ASP 164 CO 0.00 0.43 0.34 0.28 -1.72 0.00 0.00 179.24 178.58 3f8r h SER 165 N 0.59 0.54 -0.39 6.45 0.02 -1.95 0.16 113.55 118.98 3f8r h SER 165 Ca 0.16 0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.03 3f8r h SER 165 Cb -0.00 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 3f8r h SER 165 CO -0.03 0.38 -0.12 0.00 -1.14 0.00 0.00 176.83 175.91 3f8r h ALA 166 N 1.27 0.54 0.21 3.77 0.00 -1.69 -0.61 119.26 122.74 3f8r h ALA 166 Ca 0.24 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3f8r h ALA 166 Cb 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3f8r h ALA 166 CO -0.12 0.43 -0.10 -0.07 0.00 0.00 0.00 179.25 179.40 3f8r h LEU 167 N 0.58 -0.23 -1.57 0.00 -0.00 -1.18 0.13 115.31 113.03 3f8r h LEU 167 Ca 0.10 -0.26 0.04 0.00 -0.00 0.00 0.00 57.88 57.76 3f8r h LEU 167 Cb 0.66 0.06 -0.03 0.00 -0.00 0.00 0.00 40.66 41.35 3f8r h LEU 167 CO 0.04 0.18 0.35 -0.08 -0.00 0.00 0.00 178.44 178.93 3f8r h GLU 168 N -0.69 0.53 0.07 1.13 4.81 -1.04 -0.58 114.58 118.80 3f8r h GLU 168 Ca -0.03 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3f8r h GLU 168 Cb 0.48 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.75 3f8r h GLU 168 CO 0.05 0.35 -0.03 0.78 -0.73 0.00 0.00 179.01 179.42 3f8r h GLY 169 N 0.54 -0.09 0.54 1.92 0.00 -0.88 -1.50 103.07 103.59 3f8r h GLY 169 Ca 0.22 0.04 0.10 0.00 0.00 0.00 0.00 47.33 47.68 3f8r h GLY 169 CO -0.06 -0.03 0.57 0.00 0.00 0.00 0.00 176.54 177.01 3f8r h ALA 170 N 0.79 1.35 -0.26 3.60 0.00 0.35 -0.88 119.26 124.21 3f8r h ALA 170 Ca -0.01 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.96 3f8r h ALA 170 Cb 0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3f8r h ALA 170 CO 0.02 0.21 0.04 1.49 0.00 0.00 0.00 179.25 181.00 3f8r h GLU 171 N 0.94 0.12 -0.14 0.00 4.57 -0.60 0.70 114.58 120.17 3f8r h GLU 171 Ca 0.44 -0.01 -0.11 0.00 -1.18 0.00 0.00 59.36 58.50 3f8r h GLU 171 Cb 0.38 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.95 3f8r h GLU 171 CO -0.24 0.08 -0.35 0.82 -1.18 0.00 0.00 179.01 178.14 3f8r h ILE 172 N 0.13 1.36 -0.76 2.32 2.04 -0.94 -3.13 117.51 118.53 3f8r h ILE 172 Ca 0.12 -1.63 0.05 0.00 1.00 0.00 0.00 64.86 64.40 3f8r h ILE 172 Cb 0.13 2.04 -0.05 0.00 -0.74 0.00 0.00 36.82 38.20 3f8r h ILE 172 CO -0.17 0.49 0.50 -0.07 0.00 0.00 0.00 178.15 178.90 3f8r h LEU 173 N 0.10 0.75 -1.57 1.44 3.38 -1.04 -1.23 115.31 117.15 3f8r h LEU 173 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3f8r h LEU 173 Cb 0.96 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3f8r h LEU 173 CO 0.08 0.50 0.00 0.77 0.09 0.00 0.00 178.44 179.88 3f8r h SER 174 N 0.86 0.00 0.99 -0.43 4.64 -0.80 0.26 113.55 119.07 3f8r h SER 174 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3f8r h SER 174 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3f8r h SER 174 CO -0.10 0.00 -0.48 -1.20 -0.87 0.00 0.00 176.83 174.18 3f8r n SER 175 N -2.52 0.71 -0.05 4.97 7.64 -0.47 -4.47 113.62 119.44 3f8r n SER 175 Ca -0.01 0.22 -0.11 0.00 1.01 0.00 0.00 58.87 59.98 3f8r n SER 175 Cb 0.12 -0.06 -0.04 0.00 -1.01 0.00 0.00 64.21 63.23 3f8r n SER 175 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3f8r n TYR 176 N -2.12 0.00 -2.42 1.43 4.01 -0.05 -5.00 117.16 113.00 3f8r n TYR 176 Ca 0.04 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.45 3f8r n TYR 176 Cb 0.43 -0.36 -0.03 0.00 -0.31 0.00 0.00 39.34 39.07 3f8r n TYR 176 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3f8r s SER 177 N -5.93 6.40 -0.01 7.72 0.01 0.71 0.95 113.70 123.55 3f8r s SER 177 Ca -0.14 1.74 -0.25 0.00 1.31 0.00 0.00 55.95 58.60 3f8r s SER 177 Cb 0.05 -2.53 -0.19 0.00 0.21 0.00 0.00 66.02 63.56 3f8r s SER 177 CO 0.18 -0.74 1.30 0.74 0.41 0.00 0.00 173.24 175.13 3f8r h THR 178 N 1.14 1.27 -3.92 1.44 2.02 -0.76 -3.44 112.91 110.67 3f8r h THR 178 Ca -0.48 -0.98 -0.32 0.00 0.77 0.00 0.00 66.41 65.40 3f8r h THR 178 Cb 1.20 1.93 -0.27 0.00 -1.74 0.00 0.00 68.15 69.27 3f8r h THR 178 CO 0.60 0.25 -0.75 -0.75 0.37 0.00 0.00 175.52 175.24 3f8r s LYS 179 N -4.46 0.44 -0.17 6.66 2.20 -1.19 -4.80 119.74 118.42 3f8r s LYS 179 Ca -0.15 -0.27 -0.00 0.00 -0.36 0.00 0.00 55.97 55.18 3f8r s LYS 179 Cb 0.02 -0.40 0.04 0.00 -1.51 0.00 0.00 37.83 35.99 3f8r s LYS 179 CO 0.66 0.10 -0.05 0.08 -0.36 0.00 0.00 175.35 175.78 3f8r s VAL 180 N -0.30 1.12 -0.20 4.02 1.01 0.18 -2.04 120.40 124.19 3f8r s VAL 180 Ca 0.00 -0.66 -0.18 0.00 0.00 0.00 0.00 61.98 61.14 3f8r s VAL 180 Cb -0.03 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 3f8r s VAL 180 CO -0.00 0.11 0.49 -0.31 0.00 0.00 0.00 175.10 175.39 3f8r s TYR 181 N 1.62 3.37 -0.49 5.22 2.02 -0.86 0.77 117.35 129.01 3f8r s TYR 181 Ca 0.00 0.74 -0.16 0.00 -0.37 0.00 0.00 57.07 57.29 3f8r s TYR 181 Cb -0.15 -2.64 0.09 0.00 -0.40 0.00 0.00 41.96 38.85 3f8r s TYR 181 CO -0.08 -0.08 0.42 -1.17 -1.57 0.00 0.00 175.55 173.07 3f8r s LEU 182 N 1.57 5.77 -0.33 -1.29 2.96 0.41 -0.26 118.68 127.51 3f8r s LEU 182 Ca 0.23 -1.45 -0.14 0.00 -0.22 0.00 0.00 54.13 52.55 3f8r s LEU 182 Cb -0.15 -2.19 -0.02 0.00 0.50 0.00 0.00 46.19 44.33 3f8r s LEU 182 CO 0.09 -0.70 0.30 -0.63 -1.32 0.00 0.00 176.35 174.09 3f8r s ILE 183 N 1.63 5.23 -0.06 6.68 1.01 0.14 0.41 121.20 136.23 3f8r s ILE 183 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.65 3f8r s ILE 183 Cb -0.26 -3.75 0.02 0.00 0.01 0.00 0.00 42.46 38.48 3f8r s ILE 183 CO 0.06 -0.03 -0.03 -2.28 0.00 0.00 0.00 174.94 172.66 3f8r s HIS 184 N 1.87 0.78 0.38 3.97 2.46 -0.78 -1.75 115.29 122.23 3f8r s HIS 184 Ca 0.09 -0.24 0.08 0.00 0.47 0.00 0.00 55.06 55.46 3f8r s HIS 184 Cb -0.17 -0.76 0.81 0.00 -0.13 0.00 0.00 32.58 32.33 3f8r s HIS 184 CO 0.11 -0.27 1.96 0.07 -2.47 0.00 0.00 174.74 174.14 3f8r h ARG 185 N 7.69 0.65 0.00 2.88 0.11 -1.58 0.05 114.38 124.19 3f8r h ARG 185 Ca -0.30 -0.04 -0.18 0.00 0.10 0.00 0.00 59.98 59.56 3f8r h ARG 185 Cb 1.14 -0.15 0.09 0.00 1.11 0.00 0.00 29.97 32.16 3f8r h ARG 185 CO 0.39 0.43 0.09 0.54 0.10 0.00 0.00 179.97 181.52 3f8r n ARG 186 N -4.48 -1.58 -0.08 0.08 3.00 -1.26 -3.47 116.66 108.86 3f8r n ARG 186 Ca 0.11 -0.82 -0.06 0.00 -0.01 0.00 0.00 57.85 57.06 3f8r n ARG 186 Cb 0.28 -0.70 -0.16 0.00 0.00 0.00 0.00 32.46 31.88 3f8r n ARG 186 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 3f8r n ASP 187 N -3.71 0.01 -4.08 0.55 2.03 -1.26 0.10 116.55 110.19 3f8r n ASP 187 Ca 0.07 0.00 -0.27 0.00 0.52 0.00 0.00 54.79 55.11 3f8r n ASP 187 Cb 0.26 1.16 -0.07 0.00 -0.72 0.00 0.00 41.12 41.75 3f8r n ASP 187 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3f8r n THR 188 N -2.67 0.00 -4.27 5.18 -2.24 -1.26 -4.81 114.28 104.21 3f8r n THR 188 Ca -0.28 -2.47 -0.23 0.00 -2.27 0.00 0.00 64.05 58.80 3f8r n THR 188 Cb 1.06 0.83 -0.07 0.00 -2.10 0.00 0.00 70.33 70.05 3f8r n THR 188 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3f8r s PHE 189 N -3.11 2.76 -0.93 4.78 0.08 -1.26 -5.00 117.98 115.30 3f8r s PHE 189 Ca 0.18 -0.20 0.08 0.00 0.12 0.00 0.00 56.93 57.11 3f8r s PHE 189 Cb 0.01 -1.23 0.12 0.00 -0.57 0.00 0.00 43.02 41.35 3f8r s PHE 189 CO 0.13 0.60 0.91 0.36 -0.10 0.00 0.00 175.22 177.12 3f8r n LYS 190 N -0.87 1.09 -2.52 0.44 2.85 -0.77 -4.99 118.16 113.39 3f8r n LYS 190 Ca -0.07 -1.31 -0.35 0.00 -1.05 0.00 0.00 58.31 55.53 3f8r n LYS 190 Cb 0.58 -1.17 -0.03 0.00 -0.65 0.00 0.00 35.03 33.76 3f8r n LYS 190 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3f8r s ALA 191 N -0.80 2.95 0.10 0.58 0.00 -0.96 -4.75 121.76 118.88 3f8r s ALA 191 Ca 0.12 0.66 -0.26 0.00 0.00 0.00 0.00 51.96 52.49 3f8r s ALA 191 Cb 0.08 -3.27 -0.15 0.00 0.00 0.00 0.00 23.12 19.78 3f8r s ALA 191 CO 0.11 -0.31 0.57 1.04 0.00 0.00 0.00 175.76 177.17 3f8r n GLN 192 N -0.64 0.00 -0.27 0.00 6.02 -1.26 -4.63 117.38 116.59 3f8r n GLN 192 Ca 0.08 0.00 0.15 0.00 -0.01 0.00 0.00 57.00 57.22 3f8r n GLN 192 Cb 0.51 -0.94 0.42 0.00 1.02 0.00 0.00 30.24 31.25 3f8r n GLN 192 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 3f8r h PRO 193 N 1.37 0.58 -0.53 -1.09 0.11 -1.96 -1.44 132.00 129.04 3f8r h PRO 193 Ca -0.29 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.74 3f8r h PRO 193 Cb 1.15 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 3f8r h PRO 193 CO 0.48 0.38 0.16 0.97 -0.21 0.00 0.00 178.00 179.78 3f8r h ILE 194 N 0.60 1.23 0.38 4.15 6.09 -2.00 -2.08 117.51 125.89 3f8r h ILE 194 Ca 0.48 -0.79 -0.02 0.00 -1.37 0.00 0.00 64.86 63.15 3f8r h ILE 194 Cb 0.92 0.76 0.00 0.00 0.47 0.00 0.00 36.82 38.97 3f8r h ILE 194 CO -0.22 0.29 -0.18 1.88 -3.07 0.00 0.00 178.15 176.84 3f8r h TYR 195 N 0.72 -0.48 -0.20 2.19 -1.99 -1.60 -2.09 116.97 113.53 3f8r h TYR 195 Ca 0.17 -0.01 0.06 0.00 2.00 0.00 0.00 58.73 60.95 3f8r h TYR 195 Cb 0.29 0.16 -0.01 0.00 2.00 0.00 0.00 36.73 39.17 3f8r h TYR 195 CO 0.02 -0.25 0.16 0.28 -0.00 0.00 0.00 178.16 178.37 3f8r h VAL 196 N -0.60 0.76 0.50 -2.88 2.07 -1.44 -2.32 116.25 112.34 3f8r h VAL 196 Ca -0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 3f8r h VAL 196 Cb 0.45 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 3f8r h VAL 196 CO 0.09 0.00 -0.24 -0.33 0.02 0.00 0.00 177.57 177.11 3f8r h GLU 197 N 0.00 -0.65 -0.71 1.57 4.39 -0.94 -2.66 114.58 115.57 3f8r h GLU 197 Ca 0.09 0.04 0.16 0.00 0.34 0.00 0.00 59.36 60.00 3f8r h GLU 197 Cb 0.41 0.15 -0.11 0.00 -0.10 0.00 0.00 28.75 29.10 3f8r h GLU 197 CO -0.00 -0.43 0.09 1.15 -1.16 0.00 0.00 179.01 178.66 3f8r h THR 198 N -0.98 0.46 -0.74 1.13 2.02 -1.14 -2.04 112.91 111.62 3f8r h THR 198 Ca -0.07 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.01 3f8r h THR 198 Cb 0.52 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 3f8r h THR 198 CO 0.11 0.03 0.33 0.58 0.37 0.00 0.00 175.52 176.94 3f8r h VAL 199 N 0.18 1.25 -0.50 3.16 2.07 -1.50 -2.88 116.25 118.03 3f8r h VAL 199 Ca 0.40 -0.74 0.09 0.00 0.82 0.00 0.00 66.70 67.27 3f8r h VAL 199 Cb 0.68 0.35 -0.10 0.00 -1.52 0.00 0.00 31.29 30.70 3f8r h VAL 199 CO -0.56 0.30 -0.33 0.50 0.02 0.00 0.00 177.57 177.50 3f8r h LYS 200 N 1.06 -0.19 0.00 1.57 3.64 -1.00 0.18 116.57 121.83 3f8r h LYS 200 Ca 0.25 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 3f8r h LYS 200 Cb 0.17 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3f8r h LYS 200 CO -0.03 -0.13 0.00 1.63 -2.27 0.00 0.00 179.45 178.65 3f8r n LYS 201 N -5.42 0.02 -2.87 1.90 5.02 -1.09 -4.61 118.16 111.11 3f8r n LYS 201 Ca 0.03 0.21 -0.42 0.00 -2.02 0.00 0.00 58.31 56.10 3f8r n LYS 201 Cb 0.35 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.81 3f8r n LYS 201 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3f8r s LYS 202 N -2.43 3.79 0.00 1.97 -0.14 0.63 -4.96 119.74 118.60 3f8r s LYS 202 Ca 0.01 0.45 0.10 0.00 -1.36 0.00 0.00 55.97 55.17 3f8r s LYS 202 Cb 0.01 -3.81 0.46 0.00 -1.68 0.00 0.00 37.83 32.80 3f8r s LYS 202 CO 0.01 -0.92 1.26 -0.35 -0.76 0.00 0.00 175.35 174.60 3f8r n PRO 203 N 6.64 0.07 -0.11 -1.68 -0.04 -1.26 -2.84 135.00 135.77 3f8r n PRO 203 Ca 0.05 0.27 0.05 0.00 -0.04 0.00 0.00 63.50 63.83 3f8r n PRO 203 Cb 0.48 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.54 3f8r n PRO 203 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3f8r n ASN 204 N -1.40 2.51 -4.47 3.54 6.94 -1.26 -4.95 115.26 116.17 3f8r n ASN 204 Ca 0.03 -2.38 -0.35 0.00 -0.02 0.00 0.00 54.58 51.87 3f8r n ASN 204 Cb 0.10 -0.22 -0.12 0.00 -2.36 0.00 0.00 39.78 37.18 3f8r n ASN 204 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3f8r s VAL 205 N -1.67 3.98 -0.24 3.53 1.01 -1.13 0.48 120.40 126.36 3f8r s VAL 205 Ca 0.18 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 3f8r s VAL 205 Cb 0.13 -2.79 0.03 0.00 0.00 0.00 0.00 36.38 33.75 3f8r s VAL 205 CO 0.05 0.44 -0.09 -0.70 0.00 0.00 0.00 175.10 174.81 3f8r s GLU 206 N 0.85 2.76 -0.07 2.72 2.12 0.23 -4.93 118.70 122.38 3f8r s GLU 206 Ca 0.01 -1.02 -0.30 0.00 0.36 0.00 0.00 54.97 54.02 3f8r s GLU 206 Cb -0.14 -2.92 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 3f8r s GLU 206 CO 0.02 -0.40 1.41 -0.06 -0.54 0.00 0.00 175.26 175.68 3f8r s PHE 207 N 1.29 2.65 -0.73 5.30 0.40 -1.26 -0.44 117.98 125.18 3f8r s PHE 207 Ca -0.01 0.75 0.02 0.00 -0.60 0.00 0.00 56.93 57.09 3f8r s PHE 207 Cb -0.17 -3.66 0.18 0.00 0.51 0.00 0.00 43.02 39.88 3f8r s PHE 207 CO -0.06 -2.48 0.55 0.08 0.70 0.00 0.00 175.22 174.01 3f8r s VAL 208 N 3.16 3.36 0.76 -0.44 1.01 0.17 -4.90 120.40 123.52 3f8r s VAL 208 Ca 0.63 -3.95 -0.10 0.00 0.00 0.00 0.00 61.98 58.56 3f8r s VAL 208 Cb -0.28 -3.17 0.06 0.00 0.00 0.00 0.00 36.38 32.99 3f8r s VAL 208 CO 0.23 -1.00 1.11 -0.76 0.00 0.00 0.00 175.10 174.68 3f8r s LEU 209 N -1.18 2.67 -1.31 3.92 1.43 -1.26 -1.86 118.68 121.09 3f8r s LEU 209 Ca 0.24 0.71 -0.11 0.00 -1.03 0.00 0.00 54.13 53.94 3f8r s LEU 209 Cb -0.09 -3.30 0.09 0.00 0.03 0.00 0.00 46.19 42.92 3f8r s LEU 209 CO -0.12 -1.72 0.52 0.59 0.23 0.00 0.00 176.35 175.84 3f8r n ASN 210 N -3.13 -3.40 -4.18 2.29 3.02 0.12 -4.85 115.26 105.13 3f8r n ASN 210 Ca 0.08 -0.49 -0.15 0.00 -0.03 0.00 0.00 54.58 53.99 3f8r n ASN 210 Cb 0.60 -2.82 -0.11 0.00 -0.61 0.00 0.00 39.78 36.84 3f8r n ASN 210 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3f8r s SER 211 N -2.80 1.52 0.15 6.41 0.01 -1.04 0.64 113.70 118.59 3f8r s SER 211 Ca 0.46 -0.77 0.05 0.00 1.31 0.00 0.00 55.95 57.00 3f8r s SER 211 Cb -0.25 -0.01 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 3f8r s SER 211 CO 0.56 -0.22 -0.11 0.68 0.41 0.00 0.00 173.24 174.57 3f8r s VAL 212 N -2.18 1.25 -0.10 3.43 -7.23 -0.70 -1.54 120.40 113.33 3f8r s VAL 212 Ca 0.04 -2.07 -0.18 0.00 -1.81 0.00 0.00 61.98 57.97 3f8r s VAL 212 Cb -0.05 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 3f8r s VAL 212 CO 0.01 -0.72 0.47 -0.69 -0.31 0.00 0.00 175.10 173.86 3f8r s VAL 213 N -3.24 5.15 -0.03 1.32 1.01 -1.26 -1.59 120.40 121.77 3f8r s VAL 213 Ca 0.17 0.94 0.16 0.00 0.00 0.00 0.00 61.98 63.26 3f8r s VAL 213 Cb 0.02 -3.81 -0.25 0.00 0.00 0.00 0.00 36.38 32.34 3f8r s VAL 213 CO 0.01 0.37 0.34 0.29 0.00 0.00 0.00 175.10 176.11 3f8r n LYS 214 N 3.37 0.54 -3.55 2.72 5.02 0.18 -4.94 118.16 121.51 3f8r n LYS 214 Ca -0.08 -0.14 -0.12 0.00 -2.02 0.00 0.00 58.31 55.94 3f8r n LYS 214 Cb 0.52 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 34.09 3f8r n LYS 214 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3f8r s GLU 215 N -3.09 0.77 -0.23 1.97 2.12 -1.19 -4.28 118.70 114.77 3f8r s GLU 215 Ca -0.06 0.11 0.02 0.00 0.36 0.00 0.00 54.97 55.39 3f8r s GLU 215 Cb 0.10 0.36 0.05 0.00 0.26 0.00 0.00 34.13 34.90 3f8r s GLU 215 CO 0.67 -0.26 -0.12 0.42 -0.54 0.00 0.00 175.26 175.44 3f8r s ILE 216 N -1.45 1.92 0.00 -3.70 1.01 -0.53 0.25 121.20 118.70 3f8r s ILE 216 Ca -0.03 -1.29 0.00 0.00 0.00 0.00 0.00 60.65 59.33 3f8r s ILE 216 Cb -0.00 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.48 3f8r s ILE 216 CO 0.02 0.12 0.00 0.29 0.00 0.00 0.00 174.94 175.37 3f8r n LYS 217 N 4.57 2.00 0.00 2.79 5.02 0.12 -4.18 118.16 128.48 3f8r n LYS 217 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 3f8r n LYS 217 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.46 3f8r n LYS 217 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3f8r n GLY 218 N 5.00 2.71 0.00 0.72 0.00 -1.26 -2.12 105.19 110.24 3f8r n GLY 218 Ca 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.07 3f8r n GLY 218 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3f8r n ASP 219 N 0.00 0.00 0.03 1.61 5.75 -1.26 -4.84 116.55 117.84 3f8r n ASP 219 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.62 3f8r n ASP 219 Cb 0.00 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 39.95 3f8r n ASP 219 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 3f8r h LYS 220 N 0.00 0.20 -4.96 0.11 1.57 -1.97 -3.47 116.57 108.05 3f8r h LYS 220 Ca 0.00 -0.35 -0.35 0.00 -1.87 0.00 0.00 60.65 58.08 3f8r h LYS 220 Cb 0.00 0.13 -0.22 0.00 0.08 0.00 0.00 32.23 32.22 3f8r h LYS 220 CO 0.00 1.02 -0.76 0.14 -0.57 0.00 0.00 179.45 179.28 3f8r s VAL 221 N -2.60 0.83 -0.21 0.50 -7.23 -1.26 -4.94 120.40 105.49 3f8r s VAL 221 Ca -0.12 -1.17 -0.42 0.00 -1.81 0.00 0.00 61.98 58.47 3f8r s VAL 221 Cb 0.07 -0.84 -0.19 0.00 0.56 0.00 0.00 36.38 35.98 3f8r s VAL 221 CO 0.83 -0.28 1.37 0.52 -0.31 0.00 0.00 175.10 177.23 3f8r n VAL 222 N 1.43 0.03 0.00 1.32 0.31 -0.81 -4.57 118.33 116.04 3f8r n VAL 222 Ca -0.22 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 3f8r n VAL 222 Cb 0.54 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 33.07 3f8r n VAL 222 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3f8r n LYS 223 N 2.96 1.92 -4.05 5.55 5.02 -0.90 -4.34 118.16 124.31 3f8r n LYS 223 Ca 0.25 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.46 3f8r n LYS 223 Cb 0.04 -0.97 -0.10 0.00 -0.02 0.00 0.00 35.03 33.98 3f8r n LYS 223 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3f8r s GLN 224 N -1.95 0.61 -0.10 1.97 -0.21 -1.23 -2.17 119.66 116.58 3f8r s GLN 224 Ca 0.00 -1.12 0.01 0.00 0.02 0.00 0.00 55.36 54.27 3f8r s GLN 224 Cb 0.00 0.22 0.02 0.00 1.00 0.00 0.00 33.01 34.25 3f8r s GLN 224 CO 0.00 -0.12 -0.11 0.14 -2.12 0.00 0.00 175.29 173.08 3f8r s VAL 225 N -3.66 1.18 -0.20 1.09 -7.23 -1.26 -0.70 120.40 109.63 3f8r s VAL 225 Ca 0.04 -0.43 -0.22 0.00 -1.81 0.00 0.00 61.98 59.57 3f8r s VAL 225 Cb 0.06 -1.13 -0.02 0.00 0.56 0.00 0.00 36.38 35.84 3f8r s VAL 225 CO -0.09 0.38 0.68 -0.69 -0.31 0.00 0.00 175.10 175.08 3f8r s VAL 226 N 1.30 4.98 0.05 1.32 1.01 0.14 -4.98 120.40 124.22 3f8r s VAL 226 Ca -0.02 1.30 0.07 0.00 0.00 0.00 0.00 61.98 63.34 3f8r s VAL 226 Cb -0.14 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 3f8r s VAL 226 CO -0.04 0.08 -0.20 -0.69 0.00 0.00 0.00 175.10 174.24 3f8r s VAL 227 N 2.03 1.65 -0.02 2.92 1.01 -1.26 0.49 120.40 127.22 3f8r s VAL 227 Ca 0.31 -1.25 0.03 0.00 0.00 0.00 0.00 61.98 61.07 3f8r s VAL 227 Cb -0.16 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.77 3f8r s VAL 227 CO 0.11 0.15 -0.09 -0.70 0.00 0.00 0.00 175.10 174.57 3f8r s GLU 228 N -1.30 0.89 -0.20 2.72 2.12 -0.62 -4.93 118.70 117.38 3f8r s GLU 228 Ca 0.07 -0.31 -0.26 0.00 0.36 0.00 0.00 54.97 54.82 3f8r s GLU 228 Cb -0.09 -0.84 -0.01 0.00 0.26 0.00 0.00 34.13 33.45 3f8r s GLU 228 CO 0.02 0.14 0.89 1.21 -0.54 0.00 0.00 175.26 176.98 3f8r s ASN 229 N 0.05 6.97 0.00 -1.70 3.84 -1.26 -1.72 114.94 121.11 3f8r s ASN 229 Ca -0.01 1.20 0.00 0.00 0.21 0.00 0.00 52.86 54.26 3f8r s ASN 229 Cb -0.07 -2.47 0.00 0.00 -0.55 0.00 0.00 41.25 38.16 3f8r s ASN 229 CO 0.00 -0.49 0.24 0.18 -2.79 0.00 0.00 177.10 174.23 3f8r n LEU 230 N 5.67 0.36 0.00 3.21 4.77 0.21 -4.98 117.00 126.24 3f8r n LEU 230 Ca 0.07 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 3f8r n LEU 230 Cb 0.48 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 3f8r n LEU 230 CO 0.49 0.09 0.00 0.29 -1.33 0.00 0.00 177.39 176.93 3f8r n LYS 231 N 0.19 1.03 0.00 3.23 5.02 -1.26 -5.07 118.16 121.29 3f8r n LYS 231 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3f8r n LYS 231 Cb 0.09 -0.09 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 3f8r n LYS 231 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3f8r n VAL 240 N 0.00 0.00 -0.01 -0.18 0.24 -0.92 -5.21 118.33 112.25 3f8r n VAL 240 Ca 0.00 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.31 3f8r n VAL 240 Cb 0.00 0.00 -0.12 0.00 -1.47 0.00 0.00 33.84 32.25 3f8r n VAL 240 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3f8r n ASN 241 N 0.00 0.41 -3.88 -1.34 3.02 0.39 -3.60 115.26 110.26 3f8r n ASN 241 Ca 0.00 0.18 -0.11 0.00 -0.03 0.00 0.00 54.58 54.62 3f8r n ASN 241 Cb 0.00 0.86 -0.11 0.00 -0.61 0.00 0.00 39.78 39.92 3f8r n ASN 241 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3f8r s GLY 242 N -4.90 0.04 -0.17 7.41 0.00 -1.10 -4.43 107.32 104.18 3f8r s GLY 242 Ca -0.06 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 44.59 3f8r s GLY 242 CO 0.84 -0.18 -0.20 0.14 0.00 0.00 0.00 173.10 173.69 3f8r s VAL 243 N -1.00 2.03 -0.33 1.40 1.01 0.90 -0.95 120.40 123.46 3f8r s VAL 243 Ca -0.11 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.83 3f8r s VAL 243 Cb -0.06 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.49 3f8r s VAL 243 CO 0.01 0.54 0.19 -0.36 0.00 0.00 0.00 175.10 175.47 3f8r s PHE 244 N 1.16 3.20 -0.42 5.22 0.40 0.75 -0.47 117.98 127.82 3f8r s PHE 244 Ca 0.01 -0.56 -0.19 0.00 -0.60 0.00 0.00 56.93 55.60 3f8r s PHE 244 Cb -0.14 -2.41 0.02 0.00 0.51 0.00 0.00 43.02 41.01 3f8r s PHE 244 CO -0.10 -0.47 0.56 0.42 0.70 0.00 0.00 175.22 176.33 3f8r s ILE 245 N 1.63 4.94 -0.57 0.64 1.01 0.12 -0.84 121.20 128.13 3f8r s ILE 245 Ca 0.04 -0.05 0.06 0.00 0.00 0.00 0.00 60.65 60.71 3f8r s ILE 245 Cb -0.18 -4.12 0.30 0.00 0.01 0.00 0.00 42.46 38.47 3f8r s ILE 245 CO 0.07 -0.50 0.83 -0.62 0.00 0.00 0.00 174.94 174.72 3f8r n GLU 246 N 5.97 2.62 -0.49 2.79 -0.58 -0.08 -4.48 120.64 126.39 3f8r n GLU 246 Ca -0.04 -4.56 0.08 0.00 -0.42 0.00 0.00 57.16 52.22 3f8r n GLU 246 Cb 0.48 -2.13 0.28 0.00 -0.57 0.00 0.00 31.44 29.49 3f8r n GLU 246 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 3f8r n ILE 247 N 0.32 2.06 0.00 -3.67 -5.35 -1.25 -4.15 119.36 107.32 3f8r n ILE 247 Ca 0.29 -1.55 0.00 0.00 -0.27 0.00 0.00 62.75 61.22 3f8r n ILE 247 Cb 0.43 -0.06 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 3f8r n ILE 247 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3f8r n GLY 248 N 0.08 -0.22 3.20 3.28 0.00 -1.26 -4.89 105.19 105.38 3f8r n GLY 248 Ca 0.21 -1.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.22 3f8r n GLY 248 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3f8r s PHE 249 N -1.01 1.02 -0.30 1.61 0.40 -1.26 -2.55 117.98 115.89 3f8r s PHE 249 Ca 0.00 -0.98 -0.04 0.00 -0.60 0.00 0.00 56.93 55.31 3f8r s PHE 249 Cb 0.00 -0.59 0.04 0.00 0.51 0.00 0.00 43.02 42.98 3f8r s PHE 249 CO 0.00 -0.20 0.02 -0.51 0.70 0.00 0.00 175.22 175.23 3f8r s ASP 250 N -3.10 4.88 0.78 1.36 1.01 -0.36 -4.90 116.67 116.34 3f8r s ASP 250 Ca 0.18 -1.06 -0.12 0.00 0.71 0.00 0.00 52.55 52.26 3f8r s ASP 250 Cb 0.06 -1.76 0.07 0.00 1.01 0.00 0.00 42.92 42.29 3f8r s ASP 250 CO -0.01 -0.23 1.14 -2.16 0.21 0.00 0.00 175.17 174.12 3f8r s PRO 251 N 1.34 1.99 -1.26 8.23 0.04 -1.26 -2.13 135.00 141.95 3f8r s PRO 251 Ca -0.02 1.46 -0.08 0.00 0.04 0.00 0.00 61.00 62.40 3f8r s PRO 251 Cb -0.19 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 3f8r s PRO 251 CO -0.00 -1.89 2.88 -0.35 0.04 0.00 0.00 177.00 177.68 3f8r n PRO 252 N -3.31 3.66 -0.12 0.56 -0.04 -1.26 -4.64 135.00 129.85 3f8r n PRO 252 Ca 0.11 -2.41 -0.09 0.00 -0.04 0.00 0.00 63.50 61.07 3f8r n PRO 252 Cb 0.52 -2.61 -0.01 0.00 -0.04 0.00 0.00 33.50 31.36 3f8r n PRO 252 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3f8r h THR 253 N 2.70 1.18 -0.12 0.52 2.02 -1.91 -1.83 112.91 115.46 3f8r h THR 253 Ca 0.71 -0.53 0.04 0.00 0.77 0.00 0.00 66.41 67.40 3f8r h THR 253 Cb 0.47 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 3f8r h THR 253 CO 1.45 0.19 -0.11 0.44 0.37 0.00 0.00 175.52 177.86 3f8r h ASP 254 N 0.45 -0.33 -0.33 4.18 3.32 -1.91 0.80 116.42 122.59 3f8r h ASP 254 Ca 0.12 0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.25 3f8r h ASP 254 Cb 0.15 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 3f8r h ASP 254 CO -0.01 -0.14 0.21 0.15 -1.72 0.00 0.00 179.24 177.72 3f8r h PHE 255 N -0.12 0.39 0.17 4.55 3.04 -1.91 -0.38 116.94 122.67 3f8r h PHE 255 Ca 0.08 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.04 3f8r h PHE 255 Cb 0.24 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 38.62 3f8r h PHE 255 CO -0.23 0.24 -0.08 0.00 -2.02 0.00 0.00 178.31 176.22 3f8r h ALA 256 N 1.13 -0.23 -0.64 2.41 0.00 -0.99 -2.39 119.26 118.54 3f8r h ALA 256 Ca 0.12 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.04 3f8r h ALA 256 Cb -0.03 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 3f8r h ALA 256 CO -0.04 -0.63 0.36 0.87 0.00 0.00 0.00 179.25 179.81 3f8r h LYS 257 N -0.23 0.66 0.00 0.00 1.57 -0.63 -0.84 116.57 117.10 3f8r h LYS 257 Ca -0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3f8r h LYS 257 Cb 0.18 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3f8r h LYS 257 CO 0.03 0.44 0.00 0.66 -0.57 0.00 0.00 179.45 180.01 3f8r h SER 258 N 0.68 0.00 -0.33 0.86 4.64 -0.87 -2.77 113.55 115.76 3f8r h SER 258 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 3f8r h SER 258 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3f8r h SER 258 CO -0.16 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.39 3f8r n ASN 259 N -2.96 3.85 -0.98 4.97 3.02 -0.75 -4.96 115.26 117.46 3f8r n ASN 259 Ca -0.00 -2.74 -0.10 0.00 -0.03 0.00 0.00 54.58 51.71 3f8r n ASN 259 Cb 0.24 -0.48 -0.02 0.00 -0.61 0.00 0.00 39.78 38.90 3f8r n ASN 259 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f8r n GLY 260 N -0.08 0.52 3.56 7.41 0.00 -0.96 -4.95 105.19 110.69 3f8r n GLY 260 Ca 0.20 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 3f8r n GLY 260 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f8r s ILE 261 N -2.44 4.56 0.49 -0.61 1.01 -0.40 -4.78 121.20 119.03 3f8r s ILE 261 Ca 0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 60.65 60.32 3f8r s ILE 261 Cb 0.00 -3.08 -0.06 0.00 0.01 0.00 0.00 42.46 39.33 3f8r s ILE 261 CO 0.00 0.42 1.26 -1.61 0.00 0.00 0.00 174.94 175.01 3f8r s GLU 262 N 0.81 3.53 0.30 2.79 2.02 -1.26 -4.13 118.70 122.76 3f8r s GLU 262 Ca 0.03 2.01 0.11 0.00 0.02 0.00 0.00 54.97 57.14 3f8r s GLU 262 Cb -0.14 -2.39 -0.06 0.00 0.10 0.00 0.00 34.13 31.65 3f8r s GLU 262 CO 0.02 -0.81 -0.16 0.95 0.02 0.00 0.00 175.26 175.28 3f8r s THR 263 N -1.41 2.38 0.31 3.63 -4.23 -1.26 -2.14 115.64 112.91 3f8r s THR 263 Ca 0.66 -2.33 -0.00 0.00 -1.18 0.00 0.00 61.69 58.83 3f8r s THR 263 Cb -0.35 -2.42 0.06 0.00 1.34 0.00 0.00 72.50 71.14 3f8r s THR 263 CO 0.42 -0.33 0.43 -0.90 -0.54 0.00 0.00 174.62 173.69 3f8r n ASP 264 N -0.68 0.55 0.16 3.99 5.68 0.05 -4.75 116.55 121.55 3f8r n ASP 264 Ca -0.05 -1.47 0.12 0.00 -0.50 0.00 0.00 54.79 52.89 3f8r n ASP 264 Cb 0.61 -0.28 0.56 0.00 -1.14 0.00 0.00 41.12 40.87 3f8r n ASP 264 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3f8r h THR 265 N -0.50 0.00 -0.02 2.12 1.35 -2.02 -0.32 112.91 113.52 3f8r h THR 265 Ca -0.14 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 3f8r h THR 265 Cb 0.51 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 3f8r h THR 265 CO 0.15 0.00 -0.12 0.59 -0.25 0.00 0.00 175.52 175.89 3f8r n ASN 266 N -2.34 2.12 0.00 5.36 3.02 -1.26 -4.95 115.26 117.21 3f8r n ASN 266 Ca 0.01 -1.62 0.00 0.00 -0.03 0.00 0.00 54.58 52.94 3f8r n ASN 266 Cb 0.18 0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.45 3f8r n ASN 266 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f8r n GLY 267 N 1.31 0.73 3.89 7.41 0.00 -0.13 -4.80 105.19 113.60 3f8r n GLY 267 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 3f8r n GLY 267 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f8r s TYR 268 N -2.62 3.49 -0.04 1.61 1.51 -1.26 -3.69 117.35 116.36 3f8r s TYR 268 Ca 0.00 0.94 -0.30 0.00 -1.01 0.00 0.00 57.07 56.70 3f8r s TYR 268 Cb 0.00 -2.36 -0.07 0.00 -0.11 0.00 0.00 41.96 39.42 3f8r s TYR 268 CO 0.00 -0.11 1.78 0.42 -1.11 0.00 0.00 175.55 176.54 3f8r s ILE 269 N -2.42 3.37 0.03 2.71 1.01 0.11 -0.77 121.20 125.24 3f8r s ILE 269 Ca 0.49 0.44 -0.30 0.00 0.00 0.00 0.00 60.65 61.28 3f8r s ILE 269 Cb -0.10 -3.30 -0.06 0.00 0.01 0.00 0.00 42.46 39.01 3f8r s ILE 269 CO 0.34 -0.05 1.36 -0.75 0.00 0.00 0.00 174.94 175.84 3f8r s LYS 270 N 4.31 4.32 0.11 2.79 2.47 -0.91 -1.07 119.74 131.76 3f8r s LYS 270 Ca 0.80 1.95 0.03 0.00 -1.56 0.00 0.00 55.97 57.19 3f8r s LYS 270 Cb -0.36 -3.46 -0.04 0.00 -1.46 0.00 0.00 37.83 32.51 3f8r s LYS 270 CO 0.34 -0.49 -0.09 0.14 0.16 0.00 0.00 175.35 175.41 3f8r s VAL 271 N 1.89 0.96 0.54 4.02 -7.23 -1.26 -4.25 120.40 115.06 3f8r s VAL 271 Ca 0.63 -1.86 0.04 0.00 -1.81 0.00 0.00 61.98 58.98 3f8r s VAL 271 Cb -0.32 -1.61 0.10 0.00 0.56 0.00 0.00 36.38 35.11 3f8r s VAL 271 CO 0.27 -0.70 0.74 -0.90 -0.31 0.00 0.00 175.10 174.20 3f8r n ASP 272 N 0.15 1.47 -0.34 4.85 5.68 -1.02 -4.81 116.55 122.54 3f8r n ASP 272 Ca -0.13 -2.13 0.18 0.00 -0.50 0.00 0.00 54.79 52.21 3f8r n ASP 272 Cb 0.59 -0.44 0.41 0.00 -1.14 0.00 0.00 41.12 40.55 3f8r n ASP 272 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3f8r h GLU 273 N 0.00 0.56 -0.81 0.11 4.81 -2.02 -0.80 114.58 116.43 3f8r h GLU 273 Ca -0.25 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3f8r h GLU 273 Cb 1.02 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.28 3f8r h GLU 273 CO 0.31 0.37 0.01 0.91 -0.73 0.00 0.00 179.01 179.87 3f8r n TRP 274 N -4.76 0.98 -1.91 0.92 7.02 -1.26 -4.89 117.44 113.54 3f8r n TRP 274 Ca 0.25 -0.35 -0.18 0.00 -1.02 0.00 0.00 57.50 56.20 3f8r n TRP 274 Cb 0.73 -0.30 -0.05 0.00 -2.42 0.00 0.00 31.31 29.28 3f8r n TRP 274 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 3f8r n MET 275 N 0.28 -1.37 -3.20 -0.99 2.81 -0.31 -4.54 117.12 109.81 3f8r n MET 275 Ca 0.13 1.03 -0.39 0.00 -1.81 0.00 0.00 57.70 56.67 3f8r n MET 275 Cb 0.70 -5.43 -0.06 0.00 -0.71 0.00 0.00 33.22 27.73 3f8r n MET 275 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 3f8r s ARG 276 N -4.18 4.31 0.25 0.03 0.52 -1.26 -1.64 118.95 116.98 3f8r s ARG 276 Ca 0.00 0.77 -0.00 0.00 -0.52 0.00 0.00 55.73 55.98 3f8r s ARG 276 Cb 0.00 -3.32 0.05 0.00 0.52 0.00 0.00 34.95 32.20 3f8r s ARG 276 CO 0.00 0.43 0.34 0.25 0.02 0.00 0.00 175.30 176.34 3f8r n THR 277 N 2.46 0.00 0.30 0.02 -2.24 -0.69 -2.43 114.28 111.71 3f8r n THR 277 Ca -0.07 -0.54 0.15 0.00 -2.27 0.00 0.00 64.05 61.32 3f8r n THR 277 Cb 0.51 -1.21 0.71 0.00 -2.10 0.00 0.00 70.33 68.24 3f8r n THR 277 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3f8r h SER 278 N -0.20 0.00 -3.70 3.42 4.64 -1.86 -3.41 113.55 112.44 3f8r h SER 278 Ca -0.11 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.54 3f8r h SER 278 Cb 0.42 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.30 3f8r h SER 278 CO 0.12 0.00 -0.54 -0.69 -0.87 0.00 0.00 176.83 174.85 3f8r s VAL 279 N -3.62 4.84 0.18 0.95 1.01 -1.26 -4.96 120.40 117.53 3f8r s VAL 279 Ca 0.00 -0.26 -0.33 0.00 0.00 0.00 0.00 61.98 61.39 3f8r s VAL 279 Cb 0.09 -3.43 -0.15 0.00 0.00 0.00 0.00 36.38 32.89 3f8r s VAL 279 CO 0.40 0.10 1.33 -2.65 0.00 0.00 0.00 175.10 174.27 3f8r n PRO 280 N 5.02 1.56 -0.28 2.72 -0.02 -1.26 -1.23 135.00 141.51 3f8r n PRO 280 Ca -0.14 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3f8r n PRO 280 Cb 0.50 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3f8r n PRO 280 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f8r n GLY 281 N 2.34 1.26 3.23 -1.23 0.00 -1.26 -5.02 105.19 104.50 3f8r n GLY 281 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 3f8r n GLY 281 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f8r s VAL 282 N -2.85 2.68 0.34 1.61 1.01 -0.36 -1.02 120.40 121.82 3f8r s VAL 282 Ca 0.00 -0.74 0.10 0.00 0.00 0.00 0.00 61.98 61.34 3f8r s VAL 282 Cb 0.00 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.15 3f8r s VAL 282 CO 0.00 0.49 -0.10 -0.36 0.00 0.00 0.00 175.10 175.14 3f8r s PHE 283 N 1.19 2.40 -0.01 5.22 0.40 0.25 -1.70 117.98 125.73 3f8r s PHE 283 Ca 0.02 -0.49 -0.09 0.00 -0.60 0.00 0.00 56.93 55.77 3f8r s PHE 283 Cb -0.14 -1.37 0.01 0.00 0.51 0.00 0.00 43.02 42.02 3f8r s PHE 283 CO -0.06 0.59 0.18 0.00 0.70 0.00 0.00 175.22 176.63 3f8r s ALA 284 N -2.60 -0.44 0.03 5.36 0.00 -0.65 0.37 121.76 123.82 3f8r s ALA 284 Ca 0.32 0.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.33 3f8r s ALA 284 Cb 0.02 0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 3f8r s ALA 284 CO 0.17 -0.20 0.01 0.00 0.00 0.00 0.00 175.76 175.73 3f8r s ALA 285 N -1.15 0.12 0.00 0.00 0.00 0.49 -4.73 121.76 116.49 3f8r s ALA 285 Ca -0.12 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.18 3f8r s ALA 285 Cb -0.06 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.24 3f8r s ALA 285 CO 0.02 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 175.96 3f8r n GLY 286 N 1.16 -1.81 0.45 0.00 0.00 -1.26 -4.29 105.19 99.43 3f8r n GLY 286 Ca -0.21 -1.65 0.26 0.00 0.00 0.00 0.00 46.02 44.42 3f8r n GLY 286 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3f8r h ASP 287 N 0.00 0.00 0.78 1.61 3.32 -1.93 -0.60 116.42 119.60 3f8r h ASP 287 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3f8r h ASP 287 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3f8r h ASP 287 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3f8r s THR 289 N -3.10 2.92 -1.28 0.00 -4.23 -0.24 -0.71 115.64 109.00 3f8r s THR 289 Ca 0.08 -0.70 0.29 0.00 -1.18 0.00 0.00 61.69 60.18 3f8r s THR 289 Cb 0.12 -3.07 0.38 0.00 1.34 0.00 0.00 72.50 71.26 3f8r s THR 289 CO 0.39 -0.05 1.94 -1.54 -0.54 0.00 0.00 174.62 174.83 3f8r n SER 290 N -2.22 0.11 -4.73 3.99 3.41 -0.23 -4.69 113.62 109.25 3f8r n SER 290 Ca 0.07 0.01 -0.41 0.00 -0.26 0.00 0.00 58.87 58.28 3f8r n SER 290 Cb 0.59 -0.29 -0.04 0.00 -0.26 0.00 0.00 64.21 64.21 3f8r n SER 290 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f8r s ALA 291 N -2.74 3.30 -1.46 7.33 0.00 -1.26 -3.57 121.76 123.36 3f8r s ALA 291 Ca 0.22 0.68 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 3f8r s ALA 291 Cb 0.20 -3.31 0.05 0.00 0.00 0.00 0.00 23.12 20.06 3f8r s ALA 291 CO 0.50 -0.10 0.71 0.91 0.00 0.00 0.00 175.76 177.79 3f8r n TRP 292 N 2.61 -1.92 -1.66 0.00 8.01 -1.26 -4.83 117.44 118.40 3f8r n TRP 292 Ca 0.02 0.83 -0.49 0.00 -1.31 0.00 0.00 57.50 56.55 3f8r n TRP 292 Cb 0.48 -3.86 -0.05 0.00 -2.01 0.00 0.00 31.31 25.87 3f8r n TRP 292 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.69 176.57 3f8r n LEU 293 N -4.45 2.79 0.00 -0.99 -0.00 -1.23 -1.83 117.00 111.29 3f8r n LEU 293 Ca -0.15 1.07 0.00 0.00 -0.00 0.00 0.00 56.01 56.93 3f8r n LEU 293 Cb 0.61 -1.34 0.00 0.00 -0.00 0.00 0.00 43.42 42.69 3f8r n LEU 293 CO 0.75 -0.42 0.00 0.61 -0.00 0.00 0.00 177.39 178.33 3f8r n GLY 294 N 3.45 2.98 3.54 -3.96 0.00 -1.26 -4.96 105.19 104.98 3f8r n GLY 294 Ca 0.19 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 3f8r n GLY 294 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3f8r s PHE 295 N -0.18 2.68 -0.64 1.61 5.36 -0.76 -4.93 117.98 121.13 3f8r s PHE 295 Ca 0.00 -1.02 -0.14 0.00 -0.96 0.00 0.00 56.93 54.81 3f8r s PHE 295 Cb 0.00 -4.61 0.16 0.00 -0.34 0.00 0.00 43.02 38.23 3f8r s PHE 295 CO 0.00 -1.83 0.57 1.03 -1.46 0.00 0.00 175.22 173.53 3f8r s ARG 296 N 4.40 3.12 0.13 10.12 0.52 -1.26 -4.93 118.95 131.06 3f8r s ARG 296 Ca 0.44 -2.02 0.06 0.00 -0.52 0.00 0.00 55.73 53.69 3f8r s ARG 296 Cb -0.01 -4.27 -0.04 0.00 0.52 0.00 0.00 34.95 31.15 3f8r s ARG 296 CO -0.09 -1.29 -0.14 -0.65 0.02 0.00 0.00 175.30 173.15 3f8r s GLN 297 N 0.99 1.06 0.17 3.54 -1.52 -1.26 -5.05 119.66 117.59 3f8r s GLN 297 Ca 0.09 -1.30 -0.13 0.00 -1.95 0.00 0.00 55.36 52.07 3f8r s GLN 297 Cb -0.22 -0.90 0.06 0.00 -0.22 0.00 0.00 33.01 31.73 3f8r s GLN 297 CO -0.02 0.16 1.73 0.28 -0.25 0.00 0.00 175.29 177.20 3f8r h VAL 298 N 3.33 1.22 -0.83 1.09 2.07 -1.97 -2.26 116.25 118.90 3f8r h VAL 298 Ca -0.39 -0.65 0.04 0.00 0.82 0.00 0.00 66.70 66.52 3f8r h VAL 298 Cb 1.20 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 31.50 3f8r h VAL 298 CO 0.53 0.25 0.53 -0.29 0.02 0.00 0.00 177.57 178.62 3f8r h ILE 299 N 0.77 1.11 -0.11 4.57 6.09 -1.97 -0.46 117.51 127.52 3f8r h ILE 299 Ca 0.19 -0.35 -0.21 0.00 -1.37 0.00 0.00 64.86 63.12 3f8r h ILE 299 Cb 0.17 0.00 0.01 0.00 0.47 0.00 0.00 36.82 37.46 3f8r h ILE 299 CO -0.02 0.19 -0.80 0.71 -3.07 0.00 0.00 178.15 175.16 3f8r h THR 300 N 1.01 1.32 -0.31 2.19 1.35 -1.93 -1.84 112.91 114.70 3f8r h THR 300 Ca 0.34 -2.08 0.00 0.00 -0.55 0.00 0.00 66.41 64.12 3f8r h THR 300 Cb 0.05 2.09 -0.02 0.00 -1.73 0.00 0.00 68.15 68.54 3f8r h THR 300 CO -0.13 0.65 0.20 0.00 -0.25 0.00 0.00 175.52 175.99 3f8r h ALA 301 N 0.68 0.40 -0.74 6.62 0.00 -1.12 0.51 119.26 125.61 3f8r h ALA 301 Ca -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3f8r h ALA 301 Cb 1.41 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 3f8r h ALA 301 CO 0.15 -0.13 0.42 0.28 0.00 0.00 0.00 179.25 179.98 3f8r h VAL 302 N 0.42 1.22 -0.45 0.00 2.07 -1.06 -1.17 116.25 117.28 3f8r h VAL 302 Ca 0.11 -0.52 -0.09 0.00 0.82 0.00 0.00 66.70 67.03 3f8r h VAL 302 Cb -0.03 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 3f8r h VAL 302 CO -0.02 0.23 -0.08 0.00 0.02 0.00 0.00 177.57 177.72 3f8r h ALA 303 N 1.22 0.61 -0.16 1.67 0.00 -1.03 -2.38 119.26 119.19 3f8r h ALA 303 Ca 0.26 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3f8r h ALA 303 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3f8r h ALA 303 CO -0.05 0.48 -0.04 1.96 0.00 0.00 0.00 179.25 181.61 3f8r h GLN 304 N 0.68 0.23 -0.63 0.00 4.20 -0.64 -1.48 115.11 117.47 3f8r h GLN 304 Ca 0.12 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 3f8r h GLN 304 Cb 0.61 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 3f8r h GLN 304 CO 0.04 0.29 0.15 0.78 -0.67 0.00 0.00 178.83 179.41 3f8r h GLY 305 N 0.55 1.08 1.00 3.46 0.00 -0.80 -0.77 103.07 107.60 3f8r h GLY 305 Ca 0.05 -0.69 -0.02 0.00 0.00 0.00 0.00 47.33 46.67 3f8r h GLY 305 CO 0.01 0.64 0.33 0.00 0.00 0.00 0.00 176.54 177.52 3f8r h ALA 306 N 1.05 0.87 -0.38 3.60 0.00 -0.81 -0.97 119.26 122.61 3f8r h ALA 306 Ca 0.20 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3f8r h ALA 306 Cb 0.37 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3f8r h ALA 306 CO 0.00 0.43 0.08 0.28 0.00 0.00 0.00 179.25 180.04 3f8r h VAL 307 N 0.93 1.23 -0.63 0.00 2.07 -1.05 -1.05 116.25 117.77 3f8r h VAL 307 Ca 0.23 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 3f8r h VAL 307 Cb 0.11 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 3f8r h VAL 307 CO -0.03 0.28 0.23 0.00 0.02 0.00 0.00 177.57 178.07 3f8r h ALA 308 N 0.93 1.23 -0.31 1.67 0.00 -1.00 -0.26 119.26 121.52 3f8r h ALA 308 Ca 0.12 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 3f8r h ALA 308 Cb 0.34 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3f8r h ALA 308 CO 0.00 0.56 -0.27 0.00 0.00 0.00 0.00 179.25 179.54 3f8r h ALA 309 N 1.35 0.94 -0.47 0.00 0.00 -0.89 -0.38 119.26 119.81 3f8r h ALA 309 Ca 0.21 -0.38 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 3f8r h ALA 309 Cb 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3f8r h ALA 309 CO -0.02 0.61 -0.20 1.15 0.00 0.00 0.00 179.25 180.79 3f8r h THR 310 N 0.55 1.27 -0.23 0.00 2.02 -0.55 -0.49 112.91 115.48 3f8r h THR 310 Ca 0.07 -1.36 -0.12 0.00 0.77 0.00 0.00 66.41 65.77 3f8r h THR 310 Cb 0.75 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 3f8r h THR 310 CO 0.06 0.47 -0.37 0.28 0.37 0.00 0.00 175.52 176.33 3f8r h SER 311 N 0.83 0.52 -0.39 4.18 0.02 -0.80 -1.07 113.55 116.85 3f8r h SER 311 Ca 0.11 -0.22 -0.13 0.00 -0.84 0.00 0.00 61.79 60.71 3f8r h SER 311 Cb 0.77 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 3f8r h SER 311 CO 0.06 0.85 -0.26 0.00 -1.14 0.00 0.00 176.83 176.34 3f8r h ALA 312 N 1.18 0.73 0.04 3.77 0.00 -0.73 -0.64 119.26 123.61 3f8r h ALA 312 Ca 0.04 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 3f8r h ALA 312 Cb 0.84 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3f8r h ALA 312 CO 0.07 0.66 -0.02 -0.92 0.00 0.00 0.00 179.25 179.04 3f8r h TYR 313 N 0.77 -0.05 -0.96 0.00 3.20 -0.86 0.29 116.97 119.37 3f8r h TYR 313 Ca 0.09 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.98 3f8r h TYR 313 Cb 0.82 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 39.06 3f8r h TYR 313 CO 0.05 0.00 0.64 0.00 -1.64 0.00 0.00 178.16 177.21 3f8r h ARG 314 N -0.09 1.25 -0.11 1.82 3.08 -1.02 0.27 114.38 119.58 3f8r h ARG 314 Ca -0.01 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 3f8r h ARG 314 Cb 0.07 -0.28 -0.00 0.00 0.08 0.00 0.00 29.97 29.84 3f8r h ARG 314 CO 0.01 0.83 0.02 -0.92 -1.07 0.00 0.00 179.97 178.84 3f8r h TYR 315 N 1.29 0.18 -0.18 3.04 3.20 -0.53 0.12 116.97 124.10 3f8r h TYR 315 Ca 0.36 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.17 3f8r h TYR 315 Cb -0.12 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 3f8r h TYR 315 CO -0.00 0.35 -0.01 0.28 -1.64 0.00 0.00 178.16 177.14 3f8r h VAL 316 N -0.04 1.27 -0.66 1.81 2.07 -0.22 -3.17 116.25 117.31 3f8r h VAL 316 Ca 0.03 -0.91 -0.06 0.00 0.82 0.00 0.00 66.70 66.59 3f8r h VAL 316 Cb 0.26 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 3f8r h VAL 316 CO 0.00 0.27 0.18 0.71 0.02 0.00 0.00 177.57 178.76 3f8r h THR 317 N 0.07 1.25 -0.01 2.57 1.35 -0.95 -3.51 112.91 113.67 3f8r h THR 317 Ca 0.05 -0.90 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 3f8r h THR 317 Cb 0.42 0.55 0.00 0.00 -1.73 0.00 0.00 68.15 67.38 3f8r h THR 317 CO 0.01 0.34 0.00 -0.62 -0.25 0.00 0.00 175.52 175.01