#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r3e s LYS 11 N 0.00 4.05 -0.03 2.12 1.02 -1.26 -5.09 119.74 120.55 1r3e s LYS 11 Ca 0.00 0.84 0.02 0.00 0.02 0.00 0.00 55.97 56.85 1r3e s LYS 11 Cb 0.00 -2.31 0.01 0.00 -0.52 0.00 0.00 37.83 35.01 1r3e s LYS 11 CO 0.00 0.03 -0.09 -1.01 -0.92 0.00 0.00 175.35 173.35 1r3e s HIS 12 N -2.16 1.03 -5.00 3.18 3.76 -1.26 -4.46 115.29 110.38 1r3e s HIS 12 Ca 0.57 -0.28 0.00 0.00 -0.15 0.00 0.00 55.06 55.20 1r3e s HIS 12 Cb -0.10 -0.75 0.00 0.00 1.11 0.00 0.00 32.58 32.85 1r3e s HIS 12 CO 0.19 -0.13 0.00 0.41 -0.85 0.00 0.00 174.74 174.36 1r3e n GLY 13 N 3.41 0.12 3.54 -2.22 0.00 -0.85 -3.30 105.19 105.89 1r3e n GLY 13 Ca -0.19 -1.49 -0.34 0.00 0.00 0.00 0.00 46.02 44.00 1r3e n GLY 13 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r3e s ILE 14 N -2.92 3.55 -0.14 -0.61 -1.09 0.43 -0.84 121.20 119.58 1r3e s ILE 14 Ca 0.00 -0.53 0.01 0.00 -2.23 0.00 0.00 60.65 57.91 1r3e s ILE 14 Cb 0.00 -2.45 0.02 0.00 -1.58 0.00 0.00 42.46 38.44 1r3e s ILE 14 CO 0.00 0.58 -0.18 -0.22 -1.23 0.00 0.00 174.94 173.89 1r3e s LEU 15 N -0.58 1.93 -0.88 2.97 2.96 0.84 0.92 118.68 126.83 1r3e s LEU 15 Ca 0.09 -0.55 -0.21 0.00 -0.22 0.00 0.00 54.13 53.23 1r3e s LEU 15 Cb -0.12 -1.31 0.09 0.00 0.50 0.00 0.00 46.19 45.35 1r3e s LEU 15 CO 0.02 0.01 1.19 -0.69 -1.32 0.00 0.00 176.35 175.57 1r3e s VAL 16 N 1.12 4.33 0.42 1.68 1.01 -1.26 -0.82 120.40 126.87 1r3e s VAL 16 Ca -0.01 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 60.98 1r3e s VAL 16 Cb -0.14 -4.85 -0.05 0.00 0.00 0.00 0.00 36.38 31.34 1r3e s VAL 16 CO -0.06 -1.65 0.75 0.00 0.00 0.00 0.00 175.10 174.14 1r3e s ALA 17 N 3.89 3.39 -0.17 5.51 0.00 -0.83 -0.28 121.76 133.28 1r3e s ALA 17 Ca 0.34 -0.35 -0.02 0.00 0.00 0.00 0.00 51.96 51.94 1r3e s ALA 17 Cb -0.06 -2.62 -0.01 0.00 0.00 0.00 0.00 23.12 20.42 1r3e s ALA 17 CO -0.03 -0.11 -0.08 -0.47 0.00 0.00 0.00 175.76 175.07 1r3e s TYR 18 N -2.47 2.90 -0.28 0.00 6.14 0.38 -1.61 117.35 122.42 1r3e s TYR 18 Ca 0.49 -0.69 -0.08 0.00 0.64 0.00 0.00 57.07 57.43 1r3e s TYR 18 Cb -0.10 -1.96 -0.01 0.00 0.42 0.00 0.00 41.96 40.31 1r3e s TYR 18 CO 0.36 -0.30 0.11 0.21 0.64 0.00 0.00 175.55 176.58 1r3e s LYS 19 N 0.74 3.45 1.03 4.97 2.20 -0.03 -4.23 119.74 127.86 1r3e s LYS 19 Ca -0.04 -0.63 -0.14 0.00 -0.36 0.00 0.00 55.97 54.81 1r3e s LYS 19 Cb -0.15 -3.45 0.20 0.00 -1.51 0.00 0.00 37.83 32.92 1r3e s LYS 19 CO 0.02 -0.32 1.11 -1.25 -0.36 0.00 0.00 175.35 174.54 1r3e s PRO 20 N 1.60 0.20 0.06 4.03 0.04 -1.26 -2.00 135.00 137.68 1r3e s PRO 20 Ca 0.05 0.34 -0.31 0.00 0.04 0.00 0.00 61.00 61.12 1r3e s PRO 20 Cb -0.16 -1.73 -0.07 0.00 0.04 0.00 0.00 34.50 32.58 1r3e s PRO 20 CO 0.05 -2.84 1.43 0.21 0.04 0.00 0.00 177.00 175.88 1r3e s LYS 21 N -5.11 4.29 0.00 4.56 2.20 -1.25 -4.03 119.74 120.40 1r3e s LYS 21 Ca 0.66 2.06 0.00 0.00 -0.36 0.00 0.00 55.97 58.34 1r3e s LYS 21 Cb -0.16 -3.42 0.00 0.00 -1.51 0.00 0.00 37.83 32.73 1r3e s LYS 21 CO 0.57 -0.53 0.00 0.41 -0.36 0.00 0.00 175.35 175.43 1r3e n GLY 22 N 3.62 2.74 3.75 5.54 0.00 0.57 -5.04 105.19 116.38 1r3e n GLY 22 Ca 0.13 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 1r3e n GLY 22 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1r3e s PRO 23 N 0.00 2.48 0.76 1.61 0.02 -1.26 -4.81 135.00 133.81 1r3e s PRO 23 Ca 0.00 1.49 -0.09 0.00 0.02 0.00 0.00 61.00 62.42 1r3e s PRO 23 Cb 0.00 -1.90 0.07 0.00 0.02 0.00 0.00 34.50 32.69 1r3e s PRO 23 CO 0.00 -1.52 1.10 0.95 -0.33 0.00 0.00 177.00 177.20 1r3e s THR 24 N -2.28 2.14 0.25 0.99 -4.23 -1.26 -4.29 115.64 106.96 1r3e s THR 24 Ca 0.69 -0.15 0.03 0.00 -1.18 0.00 0.00 61.69 61.08 1r3e s THR 24 Cb -0.23 -3.00 -0.01 0.00 1.34 0.00 0.00 72.50 70.60 1r3e s THR 24 CO 0.44 0.00 1.60 0.28 -0.54 0.00 0.00 174.62 176.40 1r3e h SER 25 N -0.83 0.37 0.79 3.99 0.02 -1.92 -2.53 113.55 113.43 1r3e h SER 25 Ca -0.45 -0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 60.28 1r3e h SER 25 Cb 1.32 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 1r3e h SER 25 CO 0.62 0.81 -0.18 -0.74 -1.14 0.00 0.00 176.83 176.21 1r3e h HIS 26 N 0.27 0.00 -0.97 3.45 -0.00 -1.94 -1.97 115.15 114.00 1r3e h HIS 26 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1r3e h HIS 26 Cb 0.98 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 28.34 1r3e h HIS 26 CO 0.03 0.18 0.61 -0.44 -0.00 0.00 0.00 177.93 178.31 1r3e h ASP 27 N 0.00 1.14 -0.71 3.26 3.32 -1.82 0.28 116.42 121.88 1r3e h ASP 27 Ca -0.00 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 1r3e h ASP 27 Cb 0.62 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1r3e h ASP 27 CO 0.02 0.85 0.31 0.58 -1.72 0.00 0.00 179.24 179.27 1r3e h VAL 28 N 1.32 1.24 -0.40 -1.35 2.07 -1.37 -0.92 116.25 116.85 1r3e h VAL 28 Ca 0.35 -0.74 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 1r3e h VAL 28 Cb -0.11 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1r3e h VAL 28 CO -0.07 0.30 0.04 0.58 0.02 0.00 0.00 177.57 178.44 1r3e h VAL 29 N 1.01 1.20 -0.09 2.57 2.07 -1.07 -2.20 116.25 119.76 1r3e h VAL 29 Ca 0.24 -0.78 -0.16 0.00 0.82 0.00 0.00 66.70 66.82 1r3e h VAL 29 Cb 0.18 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1r3e h VAL 29 CO -0.02 0.27 -0.63 0.44 0.02 0.00 0.00 177.57 177.65 1r3e h ASP 30 N 0.59 0.36 -0.48 0.57 3.32 -0.18 -1.25 116.42 119.35 1r3e h ASP 30 Ca 0.13 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 56.91 1r3e h ASP 30 Cb 0.31 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1r3e h ASP 30 CO 0.01 0.90 0.10 -0.08 -1.72 0.00 0.00 179.24 178.44 1r3e h GLU 31 N 0.23 0.78 -0.43 3.56 4.57 -0.78 -0.12 114.58 122.39 1r3e h GLU 31 Ca -0.01 -0.20 -0.10 0.00 -1.18 0.00 0.00 59.36 57.87 1r3e h GLU 31 Cb 1.16 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.64 1r3e h GLU 31 CO 0.10 0.78 -0.14 0.28 -1.18 0.00 0.00 179.01 178.85 1r3e h VAL 32 N 0.66 1.28 -0.33 0.32 2.07 -1.28 0.20 116.25 119.16 1r3e h VAL 32 Ca 0.15 -1.26 -0.05 0.00 0.82 0.00 0.00 66.70 66.36 1r3e h VAL 32 Cb 0.36 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1r3e h VAL 32 CO 0.01 0.43 0.00 0.03 0.02 0.00 0.00 177.57 178.06 1r3e h ARG 33 N 0.67 0.50 0.41 1.57 3.08 -1.10 -1.29 114.38 118.23 1r3e h ARG 33 Ca 0.10 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1r3e h ARG 33 Cb 0.68 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1r3e h ARG 33 CO 0.05 0.53 -0.20 -0.22 -1.07 0.00 0.00 179.97 179.06 1r3e h LYS 34 N 0.49 -0.53 -0.71 0.04 3.64 -0.59 -1.57 116.57 117.34 1r3e h LYS 34 Ca 0.11 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1r3e h LYS 34 Cb 0.31 0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.22 1r3e h LYS 34 CO 0.01 -0.26 0.42 0.87 -2.27 0.00 0.00 179.45 178.22 1r3e h LYS 35 N -1.06 0.97 -0.01 1.90 1.79 -0.95 -2.61 116.57 116.60 1r3e h LYS 35 Ca -0.06 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1r3e h LYS 35 Cb 0.51 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1r3e h LYS 35 CO 0.09 0.69 -0.28 1.28 -1.08 0.00 0.00 179.45 180.15 1r3e n LEU 36 N -4.39 1.18 -3.96 2.94 4.32 -0.49 -4.70 117.00 111.91 1r3e n LEU 36 Ca 0.07 -0.34 -0.31 0.00 -0.02 0.00 0.00 56.01 55.42 1r3e n LEU 36 Cb 0.08 -0.10 0.02 0.00 -1.62 0.00 0.00 43.42 41.79 1r3e n LEU 36 CO 0.37 0.22 0.06 1.17 -1.22 0.00 0.00 177.39 177.99 1r3e n LYS 37 N -0.53 -4.99 -4.87 3.23 3.00 -0.62 -4.95 118.16 108.42 1r3e n LYS 37 Ca 0.12 0.55 -0.28 0.00 -0.00 0.00 0.00 58.31 58.70 1r3e n LYS 37 Cb 0.37 -5.37 -0.17 0.00 0.00 0.00 0.00 35.03 29.86 1r3e n LYS 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1r3e s THR 38 N -3.34 1.54 0.05 3.15 2.01 -1.01 -5.05 115.64 112.99 1r3e s THR 38 Ca 0.62 -0.73 -0.17 0.00 0.31 0.00 0.00 61.69 61.72 1r3e s THR 38 Cb -0.31 -1.35 -0.19 0.00 0.01 0.00 0.00 72.50 70.66 1r3e s THR 38 CO 0.85 0.44 1.22 0.08 -0.69 0.00 0.00 174.62 176.53 1r3e h ARG 39 N 6.74 0.57 -6.05 4.92 -0.00 -1.93 -3.40 114.38 115.24 1r3e h ARG 39 Ca -0.27 -0.49 -0.55 0.00 -0.00 0.00 0.00 59.98 58.67 1r3e h ARG 39 Cb 1.20 0.11 -0.09 0.00 -0.00 0.00 0.00 29.97 31.19 1r3e h ARG 39 CO 0.47 1.12 1.37 0.15 -0.00 0.00 0.00 179.97 183.08 1r3e s LYS 40 N -3.61 3.42 -0.01 0.08 -0.14 -1.26 -4.95 119.74 113.26 1r3e s LYS 40 Ca -0.12 -0.97 -0.02 0.00 -1.36 0.00 0.00 55.97 53.49 1r3e s LYS 40 Cb 0.06 -5.29 0.00 0.00 -1.68 0.00 0.00 37.83 30.92 1r3e s LYS 40 CO 0.85 -2.39 0.06 0.08 -0.76 0.00 0.00 175.35 173.18 1r3e s VAL 41 N 5.80 0.03 0.29 3.17 1.01 -1.26 -0.60 120.40 128.85 1r3e s VAL 41 Ca 0.50 -0.25 -0.12 0.00 0.00 0.00 0.00 61.98 62.10 1r3e s VAL 41 Cb -0.01 -0.17 0.01 0.00 0.00 0.00 0.00 36.38 36.21 1r3e s VAL 41 CO -0.08 -0.14 0.57 -0.83 0.00 0.00 0.00 175.10 174.62 1r3e s GLY 42 N -0.42 0.60 0.37 4.51 0.00 -0.80 -5.00 107.32 106.58 1r3e s GLY 42 Ca -0.05 -0.90 0.08 0.00 0.00 0.00 0.00 44.72 43.86 1r3e s GLY 42 CO 0.00 -0.57 -0.01 -2.38 0.00 0.00 0.00 173.10 170.14 1r3e s HIS 43 N -3.53 2.49 -0.38 1.90 -3.43 -1.26 -0.48 115.29 110.59 1r3e s HIS 43 Ca 0.21 -0.56 0.05 0.00 -0.80 0.00 0.00 55.06 53.97 1r3e s HIS 43 Cb -0.02 -1.60 0.47 0.00 -1.43 0.00 0.00 32.58 30.00 1r3e s HIS 43 CO 0.11 0.48 1.49 0.41 -2.00 0.00 0.00 174.74 175.23 1r3e n GLY 44 N -0.93 5.78 0.00 -1.38 0.00 0.73 -4.89 105.19 104.50 1r3e n GLY 44 Ca -0.04 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1r3e n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r3e n GLY 45 N -0.90 2.85 3.77 -0.02 0.00 -1.26 -4.47 105.19 105.15 1r3e n GLY 45 Ca 0.45 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.96 1r3e n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1r3e s THR 46 N 0.00 2.51 -0.10 2.61 2.01 -1.26 -4.67 115.64 116.73 1r3e s THR 46 Ca 0.00 0.49 0.02 0.00 0.31 0.00 0.00 61.69 62.52 1r3e s THR 46 Cb 0.00 -3.31 -0.01 0.00 0.01 0.00 0.00 72.50 69.18 1r3e s THR 46 CO 0.00 0.11 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.65 1r3e s LEU 47 N -1.56 2.49 0.74 4.42 2.96 -1.26 -5.11 118.68 121.36 1r3e s LEU 47 Ca 0.52 -0.39 -0.15 0.00 -0.22 0.00 0.00 54.13 53.90 1r3e s LEU 47 Cb -0.42 -1.53 0.04 0.00 0.50 0.00 0.00 46.19 44.79 1r3e s LEU 47 CO 0.54 0.20 1.22 -1.81 -1.32 0.00 0.00 176.35 175.17 1r3e s ASP 48 N 0.14 4.10 0.39 3.68 1.01 -1.26 -4.15 116.67 120.58 1r3e s ASP 48 Ca -0.09 2.40 0.09 0.00 0.71 0.00 0.00 52.55 55.66 1r3e s ASP 48 Cb -0.15 -2.59 0.85 0.00 1.01 0.00 0.00 42.92 42.03 1r3e s ASP 48 CO 0.06 -2.33 1.95 -0.65 0.21 0.00 0.00 175.17 174.41 1r3e h PRO 49 N -0.33 0.61 0.00 8.23 0.11 -1.88 -1.67 132.00 137.07 1r3e h PRO 49 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1r3e h PRO 49 Cb 1.30 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1r3e h PRO 49 CO 0.49 0.40 0.00 1.97 -0.21 0.00 0.00 178.00 180.66 1r3e n PHE 50 N -4.49 0.18 -3.06 0.65 1.16 -1.26 -0.32 117.46 110.33 1r3e n PHE 50 Ca 0.11 0.06 -0.18 0.00 -1.87 0.00 0.00 57.45 55.58 1r3e n PHE 50 Cb 0.31 -0.60 0.02 0.00 -1.61 0.00 0.00 39.48 37.60 1r3e n PHE 50 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1r3e s ALA 51 N -3.04 4.55 0.19 1.98 0.00 -0.63 -4.54 121.76 120.27 1r3e s ALA 51 Ca 0.10 -1.79 -0.04 0.00 0.00 0.00 0.00 51.96 50.23 1r3e s ALA 51 Cb 0.14 -1.54 -0.03 0.00 0.00 0.00 0.00 23.12 21.68 1r3e s ALA 51 CO 0.42 -0.42 0.20 0.00 0.00 0.00 0.00 175.76 175.96 1r3e n GLY 53 N -0.25 0.76 3.70 0.00 0.00 -0.85 -0.13 105.19 108.43 1r3e n GLY 53 Ca -0.01 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.53 1r3e n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r3e s VAL 54 N -1.63 3.44 -0.15 1.61 1.01 -0.52 -0.85 120.40 123.31 1r3e s VAL 54 Ca 0.00 0.92 -0.01 0.00 0.00 0.00 0.00 61.98 62.89 1r3e s VAL 54 Cb 0.00 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.83 1r3e s VAL 54 CO 0.00 0.02 -0.02 -0.22 0.00 0.00 0.00 175.10 174.88 1r3e s LEU 55 N 2.04 1.25 -0.04 3.92 2.96 -0.63 -4.92 118.68 123.26 1r3e s LEU 55 Ca 0.66 -0.55 -0.30 0.00 -0.22 0.00 0.00 54.13 53.72 1r3e s LEU 55 Cb -0.35 -0.72 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 1r3e s LEU 55 CO 0.29 -0.21 1.16 -0.63 -1.32 0.00 0.00 176.35 175.63 1r3e s ILE 56 N 1.77 4.33 -0.09 6.68 -1.09 -1.26 -1.96 121.20 129.58 1r3e s ILE 56 Ca 0.01 1.66 0.02 0.00 -2.23 0.00 0.00 60.65 60.11 1r3e s ILE 56 Cb -0.15 -4.06 -0.02 0.00 -1.58 0.00 0.00 42.46 36.65 1r3e s ILE 56 CO -0.07 0.03 -0.16 -0.63 -1.23 0.00 0.00 174.94 172.88 1r3e s ILE 57 N 1.92 2.87 -0.13 2.92 -1.09 -0.00 -0.19 121.20 127.50 1r3e s ILE 57 Ca 0.55 -0.76 -0.01 0.00 -2.23 0.00 0.00 60.65 58.20 1r3e s ILE 57 Cb -0.24 -2.15 -0.02 0.00 -1.58 0.00 0.00 42.46 38.46 1r3e s ILE 57 CO 0.23 0.56 -0.09 -0.83 -1.23 0.00 0.00 174.94 173.58 1r3e s GLY 58 N -0.09 1.62 -0.11 6.18 0.00 0.36 -0.11 107.32 115.18 1r3e s GLY 58 Ca -0.03 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 43.84 1r3e s GLY 58 CO 0.04 -0.24 -0.14 0.14 0.00 0.00 0.00 173.10 172.89 1r3e s VAL 59 N 0.14 2.97 0.00 1.40 1.01 -0.02 -1.91 120.40 124.00 1r3e s VAL 59 Ca -0.04 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.23 1r3e s VAL 59 Cb -0.14 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 34.02 1r3e s VAL 59 CO 0.04 0.54 0.00 0.59 0.00 0.00 0.00 175.10 176.27 1r3e n ASN 60 N 3.20 0.00 0.32 3.32 5.03 0.24 0.03 115.26 127.39 1r3e n ASN 60 Ca -0.18 0.00 0.16 0.00 0.87 0.00 0.00 54.58 55.43 1r3e n ASN 60 Cb 0.53 0.00 0.83 0.00 -1.02 0.00 0.00 39.78 40.12 1r3e n ASN 60 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 1r3e h GLN 61 N 0.00 0.00 0.00 3.52 1.08 -1.89 -0.19 115.11 117.62 1r3e h GLN 61 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1r3e h GLN 61 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1r3e h GLN 61 CO 0.00 0.00 -0.11 0.78 -0.95 0.00 0.00 178.83 178.55 1r3e h GLY 62 N 0.00 0.00 2.00 3.46 0.00 -0.60 -1.39 103.07 106.53 1r3e h GLY 62 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1r3e h GLY 62 CO 0.00 0.00 -0.09 -0.91 0.00 0.00 0.00 176.54 175.54 1r3e h THR 63 N 0.00 0.59 0.00 4.70 1.35 -1.15 -2.38 112.91 116.02 1r3e h THR 63 Ca -0.00 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1r3e h THR 63 Cb 0.36 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 1r3e h THR 63 CO 0.01 0.09 0.00 0.54 -0.25 0.00 0.00 175.52 175.91 1r3e n ARG 64 N -3.74 0.40 -0.01 4.72 1.74 -0.52 -2.46 116.66 116.79 1r3e n ARG 64 Ca -0.02 0.07 0.01 0.00 -0.77 0.00 0.00 57.85 57.13 1r3e n ARG 64 Cb 0.20 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.15 1r3e n ARG 64 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1r3e n ILE 65 N -1.16 1.00 0.20 0.55 -5.35 -0.90 -4.66 119.36 109.04 1r3e n ILE 65 Ca 0.11 -1.03 0.04 0.00 -0.27 0.00 0.00 62.75 61.60 1r3e n ILE 65 Cb 0.11 0.48 0.40 0.00 -1.74 0.00 0.00 39.64 38.88 1r3e n ILE 65 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 1r3e h LEU 66 N 0.00 0.00 -2.02 7.28 3.38 -1.55 -2.57 115.31 119.82 1r3e h LEU 66 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1r3e h LEU 66 Cb 0.57 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1r3e h LEU 66 CO 0.00 0.34 0.11 1.05 0.09 0.00 0.00 178.44 180.03 1r3e h GLU 67 N 0.00 0.00 0.00 1.13 4.11 -1.83 -0.94 114.58 117.05 1r3e h GLU 67 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1r3e h GLU 67 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1r3e h GLU 67 CO 0.04 0.00 0.00 1.19 0.07 0.00 0.00 179.01 180.31 1r3e n PHE 68 N -4.45 0.35 0.66 2.06 3.72 -0.97 -2.35 117.46 116.49 1r3e n PHE 68 Ca 0.01 0.15 0.12 0.00 -0.05 0.00 0.00 57.45 57.68 1r3e n PHE 68 Cb 0.24 -0.74 0.18 0.00 -0.94 0.00 0.00 39.48 38.21 1r3e n PHE 68 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1r3e n TYR 69 N -1.83 0.40 -0.01 1.38 4.01 -0.36 -3.94 117.16 116.81 1r3e n TYR 69 Ca 0.02 0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.88 1r3e n TYR 69 Cb 0.14 -0.55 0.31 0.00 -0.31 0.00 0.00 39.34 38.93 1r3e n TYR 69 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1r3e h LYS 70 N 0.00 0.56 -0.01 -0.72 3.64 -1.60 -2.93 116.57 115.51 1r3e h LYS 70 Ca 0.00 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1r3e h LYS 70 Cb 0.69 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1r3e h LYS 70 CO 0.00 0.54 -0.02 -0.25 -2.27 0.00 0.00 179.45 177.45 1r3e n ASP 71 N -4.31 1.13 -4.88 4.20 9.92 -1.25 -4.65 116.55 116.71 1r3e n ASP 71 Ca 0.02 -1.32 -0.30 0.00 -0.53 0.00 0.00 54.79 52.66 1r3e n ASP 71 Cb 0.21 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.71 1r3e n ASP 71 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1r3e s LEU 72 N -2.05 3.21 0.34 0.64 1.43 -1.11 -4.73 118.68 116.40 1r3e s LEU 72 Ca 0.39 1.28 -0.15 0.00 -1.03 0.00 0.00 54.13 54.61 1r3e s LEU 72 Cb 0.21 -4.26 -0.09 0.00 0.03 0.00 0.00 46.19 42.08 1r3e s LEU 72 CO 0.36 -0.94 0.76 -0.54 0.23 0.00 0.00 176.35 176.22 1r3e s LYS 73 N -5.16 4.02 0.19 1.70 1.02 -1.26 -4.14 119.74 116.10 1r3e s LYS 73 Ca 0.55 0.71 0.10 0.00 0.02 0.00 0.00 55.97 57.34 1r3e s LYS 73 Cb -0.11 -2.40 -0.04 0.00 -0.52 0.00 0.00 37.83 34.76 1r3e s LYS 73 CO 0.52 0.13 -0.20 0.15 -0.92 0.00 0.00 175.35 175.03 1r3e s LYS 74 N -3.04 1.38 -0.08 1.68 3.01 -1.05 -0.37 119.74 121.27 1r3e s LYS 74 Ca 0.55 -1.48 0.03 0.00 -1.01 0.00 0.00 55.97 54.05 1r3e s LYS 74 Cb -0.10 -1.50 0.01 0.00 -1.01 0.00 0.00 37.83 35.23 1r3e s LYS 74 CO 0.17 0.31 -0.16 0.08 0.51 0.00 0.00 175.35 176.26 1r3e s VAL 75 N -2.04 1.45 -0.00 3.17 1.01 -0.63 -1.40 120.40 121.96 1r3e s VAL 75 Ca 0.19 -0.66 0.07 0.00 0.00 0.00 0.00 61.98 61.58 1r3e s VAL 75 Cb -0.06 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 1r3e s VAL 75 CO 0.08 0.43 -0.21 -0.31 0.00 0.00 0.00 175.10 175.09 1r3e s TYR 76 N 0.62 1.89 -0.35 5.22 1.51 -0.00 -0.00 117.35 126.24 1r3e s TYR 76 Ca -0.15 -0.36 0.04 0.00 -1.01 0.00 0.00 57.07 55.59 1r3e s TYR 76 Cb -0.16 -1.19 0.10 0.00 -0.11 0.00 0.00 41.96 40.60 1r3e s TYR 76 CO 0.04 0.00 0.06 -0.46 -1.11 0.00 0.00 175.55 174.09 1r3e s TRP 77 N -0.58 3.61 0.19 2.71 -0.00 0.29 -1.10 118.94 124.07 1r3e s TRP 77 Ca 0.08 -2.94 0.04 0.00 -0.00 0.00 0.00 56.10 53.28 1r3e s TRP 77 Cb -0.08 -2.85 -0.03 0.00 -0.00 0.00 0.00 33.47 30.51 1r3e s TRP 77 CO -0.00 -0.94 0.30 0.54 -0.00 0.00 0.00 176.95 176.85 1r3e s VAL 78 N 0.88 5.20 -0.07 5.86 0.11 -0.60 -2.30 120.40 129.48 1r3e s VAL 78 Ca 0.11 -0.87 0.01 0.00 -2.93 0.00 0.00 61.98 58.30 1r3e s VAL 78 Cb -0.19 -3.74 0.02 0.00 -1.53 0.00 0.00 36.38 30.94 1r3e s VAL 78 CO -0.09 -0.20 -0.06 -0.75 -3.33 0.00 0.00 175.10 170.67 1r3e s LYS 79 N -3.55 1.11 0.26 1.54 2.20 -0.74 -1.02 119.74 119.54 1r3e s LYS 79 Ca 0.34 -0.16 0.10 0.00 -0.36 0.00 0.00 55.97 55.89 1r3e s LYS 79 Cb -0.10 -1.14 -0.05 0.00 -1.51 0.00 0.00 37.83 35.03 1r3e s LYS 79 CO 0.28 -0.14 -0.17 0.00 -0.36 0.00 0.00 175.35 174.96 1r3e s MET 80 N 1.24 1.56 -0.23 4.03 0.23 0.24 -0.43 119.30 125.94 1r3e s MET 80 Ca -0.05 -1.72 0.01 0.00 -1.03 0.00 0.00 55.69 52.90 1r3e s MET 80 Cb -0.14 -1.51 0.04 0.00 -1.53 0.00 0.00 34.83 31.69 1r3e s MET 80 CO -0.02 0.26 -0.13 0.50 -2.03 0.00 0.00 175.02 173.60 1r3e s ARG 81 N -3.57 2.67 0.49 3.16 3.52 -0.24 -1.19 118.95 123.77 1r3e s ARG 81 Ca 0.27 -1.07 -0.21 0.00 -0.13 0.00 0.00 55.73 54.59 1r3e s ARG 81 Cb -0.03 -2.81 -0.07 0.00 -1.56 0.00 0.00 34.95 30.48 1r3e s ARG 81 CO 0.12 -0.40 1.12 -0.51 -0.81 0.00 0.00 175.30 174.82 1r3e s LEU 82 N 1.23 3.90 0.00 -0.88 1.43 0.27 -2.05 118.68 122.58 1r3e s LEU 82 Ca -0.02 2.17 0.00 0.00 -1.03 0.00 0.00 54.13 55.25 1r3e s LEU 82 Cb -0.17 -4.41 0.00 0.00 0.03 0.00 0.00 46.19 41.64 1r3e s LEU 82 CO -0.08 -0.96 0.00 0.61 0.23 0.00 0.00 176.35 176.15 1r3e n GLY 83 N 0.22 0.89 3.39 -3.19 0.00 0.19 -4.65 105.19 102.04 1r3e n GLY 83 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1r3e n GLY 83 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1r3e s LEU 84 N 0.00 2.48 -0.03 0.99 2.96 -1.21 -0.47 118.68 123.40 1r3e s LEU 84 Ca 0.00 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1r3e s LEU 84 Cb 0.00 -1.49 0.02 0.00 0.50 0.00 0.00 46.19 45.23 1r3e s LEU 84 CO 0.00 0.30 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.68 1r3e s ILE 85 N -0.47 0.30 0.37 6.68 1.01 0.15 -2.94 121.20 126.30 1r3e s ILE 85 Ca 0.06 0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.76 1r3e s ILE 85 Cb -0.12 -0.37 -0.06 0.00 0.01 0.00 0.00 42.46 41.93 1r3e s ILE 85 CO 0.01 0.17 0.05 0.42 0.00 0.00 0.00 174.94 175.59 1r3e s THR 86 N 0.94 1.34 0.21 2.92 -4.23 -1.26 0.34 115.64 115.90 1r3e s THR 86 Ca -0.11 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.39 1r3e s THR 86 Cb -0.14 -2.75 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 1r3e s THR 86 CO -0.01 0.00 1.54 -0.33 -0.54 0.00 0.00 174.62 175.28 1r3e h GLU 87 N 1.92 0.50 -0.00 3.99 5.08 -1.68 -3.16 114.58 121.23 1r3e h GLU 87 Ca -0.41 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 57.65 1r3e h GLU 87 Cb 1.25 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1r3e h GLU 87 CO 0.72 0.90 -0.40 0.25 -1.00 0.00 0.00 179.01 179.47 1r3e n THR 88 N -3.97 0.00 -0.97 1.13 -2.24 -1.26 -4.77 114.28 102.21 1r3e n THR 88 Ca -0.03 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1r3e n THR 88 Cb 0.58 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1r3e n THR 88 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1r3e n PHE 89 N -1.20 0.00 -4.47 4.78 3.01 -1.20 -4.81 117.46 113.57 1r3e n PHE 89 Ca 0.08 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.31 1r3e n PHE 89 Cb 0.34 -0.13 -0.10 0.00 -0.01 0.00 0.00 39.48 39.58 1r3e n PHE 89 CO 0.00 0.00 0.00 0.16 1.01 0.00 0.00 176.76 177.93 1r3e s ASP 90 N -2.71 2.48 0.19 4.37 1.47 -1.26 -2.67 116.67 118.53 1r3e s ASP 90 Ca 0.00 -1.45 0.13 0.00 1.18 0.00 0.00 52.55 52.41 1r3e s ASP 90 Cb 0.00 0.07 0.69 0.00 -0.34 0.00 0.00 42.92 43.34 1r3e s ASP 90 CO 0.00 -0.69 1.39 0.00 0.68 0.00 0.00 175.17 176.55 1r3e n ILE 91 N -0.75 1.43 0.85 2.11 0.13 -0.53 -1.48 119.36 121.12 1r3e n ILE 91 Ca -0.04 0.64 0.12 0.00 -1.10 0.00 0.00 62.75 62.38 1r3e n ILE 91 Cb 0.66 -1.64 0.21 0.00 -0.84 0.00 0.00 39.64 38.03 1r3e n ILE 91 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 1r3e n THR 92 N -1.95 0.11 -2.83 9.51 -2.24 -1.26 -4.92 114.28 110.70 1r3e n THR 92 Ca -0.01 -0.09 -0.35 0.00 -2.27 0.00 0.00 64.05 61.33 1r3e n THR 92 Cb 0.02 0.14 -0.07 0.00 -2.10 0.00 0.00 70.33 68.33 1r3e n THR 92 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1r3e s GLY 93 N -3.23 2.57 0.14 3.38 0.00 -0.55 -4.98 107.32 104.65 1r3e s GLY 93 Ca 0.09 0.43 -0.32 0.00 0.00 0.00 0.00 44.72 44.91 1r3e s GLY 93 CO 0.71 0.78 1.75 -2.21 0.00 0.00 0.00 173.10 174.13 1r3e n GLU 94 N -0.06 2.58 -1.87 2.90 2.13 -1.26 -4.61 120.64 120.44 1r3e n GLU 94 Ca 0.04 0.93 -0.42 0.00 0.66 0.00 0.00 57.16 58.38 1r3e n GLU 94 Cb 0.52 -2.78 -0.02 0.00 0.27 0.00 0.00 31.44 29.43 1r3e n GLU 94 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1r3e s VAL 95 N 1.99 2.38 -0.04 6.31 1.01 -1.26 -2.09 120.40 128.70 1r3e s VAL 95 Ca 0.80 0.30 0.14 0.00 0.00 0.00 0.00 61.98 63.22 1r3e s VAL 95 Cb -0.56 -3.19 -0.21 0.00 0.00 0.00 0.00 36.38 32.42 1r3e s VAL 95 CO 0.37 0.03 0.27 1.33 0.00 0.00 0.00 175.10 177.10 1r3e n VAL 96 N 3.18 0.16 -3.62 2.92 0.24 0.15 -4.92 118.33 116.45 1r3e n VAL 96 Ca 0.11 -0.37 -0.10 0.00 -2.04 0.00 0.00 64.34 61.95 1r3e n VAL 96 Cb 0.38 0.03 -0.07 0.00 -1.47 0.00 0.00 33.84 32.71 1r3e n VAL 96 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1r3e s GLU 97 N -2.87 0.56 -0.40 7.34 2.12 -0.88 -5.00 118.70 119.57 1r3e s GLU 97 Ca -0.05 0.53 0.09 0.00 0.36 0.00 0.00 54.97 55.90 1r3e s GLU 97 Cb 0.08 0.27 0.30 0.00 0.26 0.00 0.00 34.13 35.04 1r3e s GLU 97 CO 0.58 -0.09 0.73 -1.91 -0.54 0.00 0.00 175.26 174.03 1r3e n GLU 98 N 1.93 0.87 -1.65 4.30 2.13 -1.25 -0.68 120.64 126.29 1r3e n GLU 98 Ca -0.12 -2.98 -0.30 0.00 0.66 0.00 0.00 57.16 54.42 1r3e n GLU 98 Cb 0.56 -1.44 0.19 0.00 0.27 0.00 0.00 31.44 31.02 1r3e n GLU 98 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1r3e s ARG 99 N -1.37 0.27 -0.57 5.31 3.00 0.38 -4.91 118.95 121.06 1r3e s ARG 99 Ca 0.35 -0.20 -0.09 0.00 -1.00 0.00 0.00 55.73 54.79 1r3e s ARG 99 Cb 0.27 -1.78 0.15 0.00 0.00 0.00 0.00 34.95 33.59 1r3e s ARG 99 CO -0.10 -2.69 0.45 -1.21 0.00 0.00 0.00 175.30 171.74 1r3e s GLU 100 N -5.67 2.71 0.02 5.12 2.02 -1.26 -4.51 118.70 117.12 1r3e s GLU 100 Ca 0.71 -2.07 -0.30 0.00 0.02 0.00 0.00 54.97 53.33 1r3e s GLU 100 Cb -0.07 -3.98 -0.09 0.00 0.10 0.00 0.00 34.13 30.09 1r3e s GLU 100 CO 0.54 -1.21 1.98 0.00 0.02 0.00 0.00 175.26 176.58 1r3e s ASN 102 N 4.58 6.31 0.06 0.00 0.01 -1.26 -4.98 114.94 119.65 1r3e s ASN 102 Ca 0.90 -2.78 -0.00 0.00 -0.71 0.00 0.00 52.86 50.27 1r3e s ASN 102 Cb -0.46 -2.10 -0.04 0.00 0.41 0.00 0.00 41.25 39.06 1r3e s ASN 102 CO 0.43 -0.50 -0.04 -0.69 -1.51 0.00 0.00 177.10 174.79 1r3e s VAL 103 N 0.04 0.31 -0.07 1.60 1.01 -1.26 -5.16 120.40 116.88 1r3e s VAL 103 Ca 0.18 -1.74 -0.02 0.00 0.00 0.00 0.00 61.98 60.40 1r3e s VAL 103 Cb -0.13 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 1r3e s VAL 103 CO -0.07 -0.92 0.04 0.42 0.00 0.00 0.00 175.10 174.57 1r3e s THR 104 N -3.59 4.58 0.25 3.92 -4.23 -1.26 -4.93 115.64 110.39 1r3e s THR 104 Ca 0.06 -0.22 0.21 0.00 -1.18 0.00 0.00 61.69 60.55 1r3e s THR 104 Cb 0.05 -2.98 0.32 0.00 1.34 0.00 0.00 72.50 71.23 1r3e s THR 104 CO -0.08 0.54 0.75 1.21 -0.54 0.00 0.00 174.62 176.51 1r3e n GLU 105 N 1.88 -0.01 -0.03 3.99 2.13 -1.26 0.06 120.64 127.40 1r3e n GLU 105 Ca -0.18 0.55 -0.14 0.00 0.66 0.00 0.00 57.16 58.06 1r3e n GLU 105 Cb 0.54 -1.20 -0.11 0.00 0.27 0.00 0.00 31.44 30.94 1r3e n GLU 105 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1r3e h GLU 106 N 0.00 0.09 -0.04 5.31 4.39 -1.99 -1.87 114.58 120.47 1r3e h GLU 106 Ca 0.44 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 60.05 1r3e h GLU 106 Cb 1.66 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.32 1r3e h GLU 106 CO -0.09 0.79 0.02 0.93 -1.16 0.00 0.00 179.01 179.51 1r3e h GLU 107 N -0.57 0.06 -0.88 2.33 5.08 -0.76 -2.04 114.58 117.79 1r3e h GLU 107 Ca -0.01 -0.01 0.23 0.00 -1.00 0.00 0.00 59.36 58.57 1r3e h GLU 107 Cb 0.82 -0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.90 1r3e h GLU 107 CO 0.02 0.16 0.06 0.82 -1.00 0.00 0.00 179.01 179.07 1r3e h ILE 108 N -0.05 0.19 -0.74 3.13 2.04 -1.51 0.12 117.51 120.69 1r3e h ILE 108 Ca 0.01 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.86 1r3e h ILE 108 Cb 0.12 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.26 1r3e h ILE 108 CO -0.00 0.02 0.48 0.03 0.00 0.00 0.00 178.15 178.68 1r3e h ARG 109 N 0.09 0.93 -0.14 2.37 2.47 -1.10 -2.15 114.38 116.85 1r3e h ARG 109 Ca 0.52 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 59.17 1r3e h ARG 109 Cb 1.03 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 29.13 1r3e h ARG 109 CO -0.78 0.62 0.02 1.49 0.56 0.00 0.00 179.97 181.89 1r3e h GLU 110 N 0.96 0.24 -0.24 0.04 4.81 -0.15 -2.92 114.58 117.32 1r3e h GLU 110 Ca 0.29 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1r3e h GLU 110 Cb -0.05 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1r3e h GLU 110 CO -0.09 0.42 0.01 0.00 -0.73 0.00 0.00 179.01 178.62 1r3e h ALA 111 N 0.81 1.58 0.00 2.92 0.00 -0.74 -0.68 119.26 123.14 1r3e h ALA 111 Ca 0.04 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 1r3e h ALA 111 Cb 0.29 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1r3e h ALA 111 CO 0.00 0.32 -0.87 0.82 0.00 0.00 0.00 179.25 179.52 1r3e h ILE 112 N 0.35 1.56 -0.00 0.00 2.04 -1.42 -3.25 117.51 116.77 1r3e h ILE 112 Ca 0.08 -3.04 0.00 0.00 1.00 0.00 0.00 64.86 62.90 1r3e h ILE 112 Cb 0.22 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.97 1r3e h ILE 112 CO 0.00 0.85 -0.62 0.49 0.00 0.00 0.00 178.15 178.87 1r3e n PHE 113 N -3.41 0.00 0.59 1.37 3.72 -1.01 -3.48 117.46 115.24 1r3e n PHE 113 Ca 0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 1r3e n PHE 113 Cb 0.85 -0.12 0.46 0.00 -0.94 0.00 0.00 39.48 39.73 1r3e n PHE 113 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1r3e n SER 114 N -1.18 0.54 0.16 4.37 3.41 -0.29 -2.54 113.62 118.09 1r3e n SER 114 Ca 0.07 0.59 0.12 0.00 -0.26 0.00 0.00 58.87 59.39 1r3e n SER 114 Cb 0.35 -0.72 0.24 0.00 -0.26 0.00 0.00 64.21 63.82 1r3e n SER 114 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1r3e h PHE 115 N 0.00 0.00 -2.92 7.33 -1.00 -1.67 -3.46 116.94 115.22 1r3e h PHE 115 Ca 0.00 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 60.21 1r3e h PHE 115 Cb 0.52 0.00 0.09 0.00 3.61 0.00 0.00 35.95 40.16 1r3e h PHE 115 CO 0.00 0.00 0.64 0.28 -1.61 0.00 0.00 178.31 177.62 1r3e n VAL 116 N -2.72 1.18 0.00 -0.55 0.31 -1.05 -4.56 118.33 110.93 1r3e n VAL 116 Ca 0.04 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1r3e n VAL 116 Cb 0.49 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 1r3e n VAL 116 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1r3e n GLY 117 N 1.87 1.17 3.89 2.92 0.00 -0.12 -4.96 105.19 109.96 1r3e n GLY 117 Ca 0.10 -2.05 -0.29 0.00 0.00 0.00 0.00 46.02 43.77 1r3e n GLY 117 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1r3e s GLU 118 N -1.70 3.22 0.18 1.61 -1.05 -1.26 -2.91 118.70 116.79 1r3e s GLU 118 Ca 0.00 0.43 -0.24 0.00 -0.15 0.00 0.00 54.97 55.02 1r3e s GLU 118 Cb 0.00 -2.14 0.07 0.00 -0.44 0.00 0.00 34.13 31.61 1r3e s GLU 118 CO 0.00 -0.69 0.97 1.52 0.95 0.00 0.00 175.26 178.01 1r3e s TYR 119 N -3.14 -0.06 -0.52 4.83 1.13 0.15 -4.95 117.35 114.78 1r3e s TYR 119 Ca 0.55 -0.30 -0.19 0.00 -1.41 0.00 0.00 57.07 55.72 1r3e s TYR 119 Cb -0.11 0.67 0.07 0.00 -1.10 0.00 0.00 41.96 41.49 1r3e s TYR 119 CO 0.50 -0.90 0.64 -0.51 -2.51 0.00 0.00 175.55 172.76 1r3e s ASP 120 N -3.07 6.21 -0.19 -0.18 1.01 -1.26 0.29 116.67 119.48 1r3e s ASP 120 Ca 0.15 -1.02 -0.11 0.00 0.71 0.00 0.00 52.55 52.28 1r3e s ASP 120 Cb -0.02 -2.29 -0.05 0.00 1.01 0.00 0.00 42.92 41.57 1r3e s ASP 120 CO 0.04 -0.93 0.17 -1.58 0.21 0.00 0.00 175.17 173.08 1r3e s GLN 121 N 2.62 4.20 -0.15 8.23 0.74 -0.14 -4.75 119.66 130.41 1r3e s GLN 121 Ca 0.14 -0.15 -0.22 0.00 0.05 0.00 0.00 55.36 55.18 1r3e s GLN 121 Cb -0.20 -3.43 -0.03 0.00 1.10 0.00 0.00 33.01 30.45 1r3e s GLN 121 CO 0.11 0.28 0.67 0.08 -0.55 0.00 0.00 175.29 175.87 1r3e s VAL 122 N 0.41 5.02 0.63 1.34 1.01 -1.26 -0.26 120.40 127.30 1r3e s VAL 122 Ca 0.10 1.30 -0.16 0.00 0.00 0.00 0.00 61.98 63.22 1r3e s VAL 122 Cb -0.12 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1r3e s VAL 122 CO -0.00 0.15 1.11 -2.16 0.00 0.00 0.00 175.10 174.20 1r3e s PRO 123 N 1.56 2.91 0.59 2.72 0.04 -1.26 -4.86 135.00 136.70 1r3e s PRO 123 Ca 0.32 1.44 -0.18 0.00 0.04 0.00 0.00 61.00 62.62 1r3e s PRO 123 Cb -0.16 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1r3e s PRO 123 CO 0.13 -1.17 1.17 -1.25 0.04 0.00 0.00 177.00 175.92 1r3e s PRO 124 N -3.92 3.04 0.47 0.56 0.04 -1.26 -4.62 135.00 129.31 1r3e s PRO 124 Ca 0.68 1.72 0.19 0.00 0.04 0.00 0.00 61.00 63.63 1r3e s PRO 124 Cb -0.21 -1.95 1.17 0.00 0.04 0.00 0.00 34.50 33.54 1r3e s PRO 124 CO 0.38 -1.12 2.02 0.00 0.04 0.00 0.00 177.00 178.32 1r3e h ALA 125 N 0.86 1.54 -2.21 8.56 0.00 -1.88 -3.28 119.26 122.85 1r3e h ALA 125 Ca -0.50 -0.15 -0.74 0.00 0.00 0.00 0.00 54.91 53.52 1r3e h ALA 125 Cb 1.28 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.83 1r3e h ALA 125 CO 0.55 0.21 0.68 0.71 0.00 0.00 0.00 179.25 181.40 1r3e s TYR 126 N -4.47 3.49 0.27 0.00 1.51 -1.26 -3.85 117.35 113.04 1r3e s TYR 126 Ca -0.04 -1.83 -0.10 0.00 -1.01 0.00 0.00 57.07 54.10 1r3e s TYR 126 Cb 0.15 -4.11 -0.00 0.00 -0.11 0.00 0.00 41.96 37.88 1r3e s TYR 126 CO 0.66 -1.28 0.46 -1.54 -1.11 0.00 0.00 175.55 172.74 1r3e s SER 127 N 2.84 0.11 0.00 2.29 1.04 -1.24 -4.89 113.70 113.85 1r3e s SER 127 Ca 0.30 -1.08 0.22 0.00 0.48 0.00 0.00 55.95 55.87 1r3e s SER 127 Cb -0.06 0.60 0.96 0.00 0.10 0.00 0.00 66.02 67.61 1r3e s SER 127 CO -0.08 -1.17 1.66 0.00 0.98 0.00 0.00 173.24 174.64 1r3e n ALA 128 N -0.41 2.56 -1.15 5.32 0.00 -1.26 -1.40 120.51 124.16 1r3e n ALA 128 Ca -0.01 -0.39 -0.34 0.00 0.00 0.00 0.00 53.44 52.70 1r3e n ALA 128 Cb 0.62 -1.18 0.12 0.00 0.00 0.00 0.00 19.45 19.01 1r3e n ALA 128 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1r3e n LYS 129 N -0.06 0.25 -4.32 0.00 4.76 -1.26 -4.56 118.16 112.96 1r3e n LYS 129 Ca 0.17 0.16 -0.34 0.00 -2.87 0.00 0.00 58.31 55.42 1r3e n LYS 129 Cb 0.25 -2.41 -0.09 0.00 -1.84 0.00 0.00 35.03 30.94 1r3e n LYS 129 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1r3e s LYS 130 N -3.99 2.94 -0.22 1.97 -0.14 -1.26 -0.26 119.74 118.78 1r3e s LYS 130 Ca 0.73 -0.46 -0.02 0.00 -1.36 0.00 0.00 55.97 54.86 1r3e s LYS 130 Cb -0.30 -2.77 0.07 0.00 -1.68 0.00 0.00 37.83 33.15 1r3e s LYS 130 CO 0.51 0.68 0.05 -0.47 -0.76 0.00 0.00 175.35 175.36 1r3e s TYR 131 N -0.97 1.14 -1.31 3.18 5.04 -0.01 -4.83 117.35 119.59 1r3e s TYR 131 Ca 0.16 -1.05 -0.01 0.00 -2.44 0.00 0.00 57.07 53.73 1r3e s TYR 131 Cb -0.11 -1.16 0.00 0.00 0.35 0.00 0.00 41.96 41.04 1r3e s TYR 131 CO 0.05 -0.68 0.73 1.63 -1.34 0.00 0.00 175.55 175.94 1r3e n LYS 132 N 5.02 -5.03 -0.54 4.97 5.02 -1.26 -2.06 118.16 124.28 1r3e n LYS 132 Ca -0.08 0.63 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 1r3e n LYS 132 Cb 0.46 -5.22 0.00 0.00 -0.02 0.00 0.00 35.03 30.24 1r3e n LYS 132 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r3e n GLY 133 N -1.56 1.90 3.55 0.72 0.00 -1.26 -5.02 105.19 103.51 1r3e n GLY 133 Ca -0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 1r3e n GLY 133 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r3e s GLU 134 N -0.01 2.39 0.39 1.61 0.41 -0.88 -5.07 118.70 117.54 1r3e s GLU 134 Ca 0.00 -0.81 -0.26 0.00 -0.41 0.00 0.00 54.97 53.49 1r3e s GLU 134 Cb 0.00 -2.40 -0.09 0.00 -1.78 0.00 0.00 34.13 29.86 1r3e s GLU 134 CO 0.00 0.58 1.27 1.03 -0.49 0.00 0.00 175.26 177.65 1r3e s ARG 135 N -1.43 4.08 0.53 1.61 1.81 -1.26 -0.83 118.95 123.46 1r3e s ARG 135 Ca 0.16 2.08 0.32 0.00 -1.72 0.00 0.00 55.73 56.57 1r3e s ARG 135 Cb -0.11 -2.81 1.30 0.00 -0.45 0.00 0.00 34.95 32.87 1r3e s ARG 135 CO 0.07 -0.37 1.96 -0.07 -0.68 0.00 0.00 175.30 176.21 1r3e h LEU 136 N 2.84 0.00 0.00 2.53 4.07 -0.54 -2.70 115.31 121.51 1r3e h LEU 136 Ca -0.49 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.47 1r3e h LEU 136 Cb 1.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.98 1r3e h LEU 136 CO 0.63 0.05 -0.35 0.10 -1.08 0.00 0.00 178.44 177.79 1r3e h TYR 137 N 0.00 0.00 0.15 1.13 -0.00 -1.34 -2.79 116.97 114.12 1r3e h TYR 137 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 58.73 58.51 1r3e h TYR 137 Cb 0.55 0.00 0.02 0.00 0.00 0.00 0.00 36.73 37.30 1r3e h TYR 137 CO 0.00 0.00 -0.94 -0.22 -0.00 0.00 0.00 178.16 177.00 1r3e h LYS 138 N 0.00 0.37 -0.31 0.10 3.11 -1.79 -2.58 116.57 115.47 1r3e h LYS 138 Ca 0.00 -0.60 -0.03 0.00 -2.81 0.00 0.00 60.65 57.21 1r3e h LYS 138 Cb 0.99 0.22 -0.02 0.00 -1.00 0.00 0.00 32.23 32.42 1r3e h LYS 138 CO 0.00 1.28 0.08 -0.07 -2.81 0.00 0.00 179.45 177.93 1r3e h LEU 139 N -0.22 0.40 -0.48 5.20 3.38 -1.57 -2.16 115.31 119.86 1r3e h LEU 139 Ca -0.16 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.60 1r3e h LEU 139 Cb 1.73 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.37 1r3e h LEU 139 CO 0.18 0.41 -0.46 0.00 0.09 0.00 0.00 178.44 178.66 1r3e h ALA 140 N 1.65 0.66 0.00 1.53 0.00 -1.50 0.50 119.26 122.11 1r3e h ALA 140 Ca 0.11 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 1r3e h ALA 140 Cb 0.17 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1r3e h ALA 140 CO -0.00 0.67 -0.29 0.00 0.00 0.00 0.00 179.25 179.63 1r3e h ARG 141 N 0.59 0.00 0.00 0.00 3.08 -1.05 0.20 114.38 117.20 1r3e h ARG 141 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1r3e h ARG 141 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.07 1r3e h ARG 141 CO 0.10 0.29 0.00 0.39 -1.07 0.00 0.00 179.97 179.68 1r3e n GLU 142 N -4.08 0.25 -0.73 0.04 1.02 -0.85 -4.89 120.64 111.41 1r3e n GLU 142 Ca -0.02 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1r3e n GLU 142 Cb 0.35 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 1r3e n GLU 142 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1r3e n GLY 143 N 0.97 0.61 3.17 0.62 0.00 0.69 -5.02 105.19 106.23 1r3e n GLY 143 Ca 0.10 -0.73 -0.40 0.00 0.00 0.00 0.00 46.02 44.99 1r3e n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r3e s LYS 144 N -1.48 2.79 -0.56 1.61 1.02 0.17 -4.96 119.74 118.33 1r3e s LYS 144 Ca 0.00 -2.36 -0.27 0.00 0.02 0.00 0.00 55.97 53.35 1r3e s LYS 144 Cb 0.00 -3.93 0.03 0.00 -0.52 0.00 0.00 37.83 33.41 1r3e s LYS 144 CO 0.00 -1.20 1.12 0.42 -0.92 0.00 0.00 175.35 174.77 1r3e s ILE 145 N 0.27 4.13 -0.15 2.17 -1.09 -1.26 -3.36 121.20 121.92 1r3e s ILE 145 Ca 0.15 0.77 -0.08 0.00 -2.23 0.00 0.00 60.65 59.27 1r3e s ILE 145 Cb -0.19 -4.66 -0.04 0.00 -1.58 0.00 0.00 42.46 35.99 1r3e s ILE 145 CO -0.04 -1.25 0.13 -0.63 -1.23 0.00 0.00 174.94 171.92 1r3e s ILE 146 N 4.64 5.41 -0.40 2.92 1.01 -1.26 -5.06 121.20 128.46 1r3e s ILE 146 Ca 0.40 0.18 -0.04 0.00 0.00 0.00 0.00 60.65 61.19 1r3e s ILE 146 Cb -0.09 -3.39 0.10 0.00 0.01 0.00 0.00 42.46 39.09 1r3e s ILE 146 CO 0.24 0.56 0.20 0.20 0.00 0.00 0.00 174.94 176.14 1r3e s ASN 147 N -0.53 5.28 0.84 3.58 0.02 -1.26 -4.13 114.94 118.74 1r3e s ASN 147 Ca 0.12 -1.90 -0.12 0.00 -1.02 0.00 0.00 52.86 49.95 1r3e s ASN 147 Cb -0.12 -1.84 0.09 0.00 0.02 0.00 0.00 41.25 39.41 1r3e s ASN 147 CO 0.02 -0.52 1.14 -0.76 0.02 0.00 0.00 177.10 176.99 1r3e s LEU 148 N 1.19 2.36 0.66 0.60 1.02 -1.26 -5.00 118.68 118.25 1r3e s LEU 148 Ca 0.06 1.00 -0.17 0.00 0.02 0.00 0.00 54.13 55.04 1r3e s LEU 148 Cb -0.23 -3.48 -0.00 0.00 0.02 0.00 0.00 46.19 42.51 1r3e s LEU 148 CO -0.03 -2.13 1.22 -2.16 0.02 0.00 0.00 176.35 173.28 1r3e s PRO 149 N -5.35 2.56 0.57 1.29 0.04 -1.26 -4.66 135.00 128.19 1r3e s PRO 149 Ca 0.62 1.84 -0.19 0.00 0.04 0.00 0.00 61.00 63.31 1r3e s PRO 149 Cb -0.13 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 1r3e s PRO 149 CO 0.52 -1.53 1.20 -2.14 0.04 0.00 0.00 177.00 175.09 1r3e s PRO 150 N -3.59 3.11 -0.04 0.56 0.02 -1.26 -4.62 135.00 129.18 1r3e s PRO 150 Ca 0.77 1.81 0.05 0.00 0.02 0.00 0.00 61.00 63.65 1r3e s PRO 150 Cb -0.31 -2.00 -0.02 0.00 0.02 0.00 0.00 34.50 32.19 1r3e s PRO 150 CO 0.39 -1.09 -0.17 0.21 -0.33 0.00 0.00 177.00 176.01 1r3e s LYS 151 N -3.25 2.43 -0.30 5.54 2.20 0.64 -4.82 119.74 122.19 1r3e s LYS 151 Ca 0.75 -0.76 -0.28 0.00 -0.36 0.00 0.00 55.97 55.32 1r3e s LYS 151 Cb -0.30 -2.30 -0.02 0.00 -1.51 0.00 0.00 37.83 33.70 1r3e s LYS 151 CO 0.33 0.59 1.81 0.50 -0.36 0.00 0.00 175.35 178.22 1r3e s ARG 152 N -0.66 3.40 0.31 4.03 6.06 -1.26 -0.96 118.95 129.86 1r3e s ARG 152 Ca 0.10 1.52 0.09 0.00 -2.50 0.00 0.00 55.73 54.94 1r3e s ARG 152 Cb -0.11 -4.19 -0.04 0.00 0.06 0.00 0.00 34.95 30.67 1r3e s ARG 152 CO 0.00 -1.78 0.08 0.08 -2.50 0.00 0.00 175.30 171.18 1r3e s VAL 153 N 6.71 3.25 -0.13 7.11 1.01 0.15 -4.95 120.40 133.55 1r3e s VAL 153 Ca 0.80 -1.77 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 1r3e s VAL 153 Cb -0.24 -2.95 0.04 0.00 0.00 0.00 0.00 36.38 33.24 1r3e s VAL 153 CO 0.33 -0.27 0.03 -0.75 0.00 0.00 0.00 175.10 174.45 1r3e s LYS 154 N -3.77 0.49 -0.52 2.72 2.47 -1.26 -0.68 119.74 119.19 1r3e s LYS 154 Ca 0.35 -0.10 -0.16 0.00 -1.56 0.00 0.00 55.97 54.50 1r3e s LYS 154 Cb -0.04 -1.49 0.11 0.00 -1.46 0.00 0.00 37.83 34.95 1r3e s LYS 154 CO 0.22 -0.48 0.48 0.42 0.16 0.00 0.00 175.35 176.14 1r3e s ILE 155 N 1.97 5.21 0.22 5.43 1.01 -1.14 -1.11 121.20 132.78 1r3e s ILE 155 Ca 0.02 -1.38 -0.05 0.00 0.00 0.00 0.00 60.65 59.25 1r3e s ILE 155 Cb -0.15 -4.29 0.07 0.00 0.01 0.00 0.00 42.46 38.10 1r3e s ILE 155 CO -0.07 -0.80 1.67 -0.26 0.00 0.00 0.00 174.94 175.49 1r3e h PHE 156 N 8.86 0.93 -1.48 3.97 -1.00 -1.65 -0.30 116.94 126.27 1r3e h PHE 156 Ca -0.30 -0.17 0.10 0.00 2.81 0.00 0.00 57.97 60.41 1r3e h PHE 156 Cb 1.10 -0.24 -0.25 0.00 3.61 0.00 0.00 35.95 40.18 1r3e h PHE 156 CO 0.71 0.90 0.59 -1.59 -1.61 0.00 0.00 178.31 177.31 1r3e s LYS 157 N -4.82 0.48 -0.10 1.51 -2.85 -1.24 -4.73 119.74 108.00 1r3e s LYS 157 Ca -0.10 0.22 0.01 0.00 -1.00 0.00 0.00 55.97 55.10 1r3e s LYS 157 Cb 0.14 0.23 0.02 0.00 -2.06 0.00 0.00 37.83 36.15 1r3e s LYS 157 CO 0.83 -0.13 -0.12 0.42 0.10 0.00 0.00 175.35 176.45 1r3e s ILE 158 N -0.75 1.28 0.24 3.79 1.01 -1.26 -2.02 121.20 123.49 1r3e s ILE 158 Ca 0.01 -0.50 0.05 0.00 0.00 0.00 0.00 60.65 60.21 1r3e s ILE 158 Cb -0.02 -1.20 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 1r3e s ILE 158 CO -0.02 0.40 0.19 -2.67 0.00 0.00 0.00 174.94 172.84 1r3e n TRP 159 N 4.37 -0.50 -3.89 3.97 2.14 -0.96 -4.92 117.44 117.64 1r3e n TRP 159 Ca -0.18 -1.98 -0.28 0.00 2.07 0.00 0.00 57.50 57.13 1r3e n TRP 159 Cb 0.51 0.19 0.02 0.00 -0.81 0.00 0.00 31.31 31.22 1r3e n TRP 159 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 1r3e n ASP 160 N -2.03 -3.47 -4.70 -0.67 8.00 -1.26 -0.75 116.55 111.66 1r3e n ASP 160 Ca 0.05 -0.83 -0.42 0.00 0.71 0.00 0.00 54.79 54.30 1r3e n ASP 160 Cb 0.43 -3.77 -0.03 0.00 -0.02 0.00 0.00 41.12 37.73 1r3e n ASP 160 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1r3e s VAL 161 N -3.44 4.12 -0.08 2.53 1.01 -1.26 -4.16 120.40 119.11 1r3e s VAL 161 Ca 0.46 1.50 -0.00 0.00 0.00 0.00 0.00 61.98 63.94 1r3e s VAL 161 Cb -0.23 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.21 1r3e s VAL 161 CO 0.84 0.08 -0.05 0.21 0.00 0.00 0.00 175.10 176.18 1r3e s ASN 162 N 1.21 1.76 0.17 3.32 3.84 -0.50 -5.00 114.94 119.73 1r3e s ASN 162 Ca 0.58 -0.21 0.10 0.00 0.21 0.00 0.00 52.86 53.54 1r3e s ASN 162 Cb -0.28 -0.65 -0.04 0.00 -0.55 0.00 0.00 41.25 39.73 1r3e s ASN 162 CO 0.27 -0.12 -0.16 -0.63 -2.79 0.00 0.00 177.10 173.67 1r3e s ILE 163 N 1.56 2.83 0.00 -5.21 1.01 -1.26 -1.97 121.20 118.16 1r3e s ILE 163 Ca 0.01 -1.76 0.00 0.00 0.00 0.00 0.00 60.65 58.90 1r3e s ILE 163 Cb -0.13 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 39.97 1r3e s ILE 163 CO -0.05 -0.07 0.00 -1.84 0.00 0.00 0.00 174.94 172.98 1r3e n GLU 164 N 0.27 0.00 0.00 2.79 0.28 -1.01 -5.04 120.64 117.93 1r3e n GLU 164 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.88 1r3e n GLU 164 Cb 0.55 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.42 1r3e n GLU 164 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1r3e n GLY 165 N 0.00 0.30 0.99 -1.84 0.00 -1.26 -2.66 105.19 100.73 1r3e n GLY 165 Ca 0.00 -0.95 0.07 0.00 0.00 0.00 0.00 46.02 45.14 1r3e n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r3e n ARG 166 N 8.62 2.42 -3.20 1.61 3.00 -1.26 -4.79 116.66 123.07 1r3e n ARG 166 Ca 0.00 -1.76 -0.44 0.00 -0.01 0.00 0.00 57.85 55.65 1r3e n ARG 166 Cb 0.00 -1.52 -0.07 0.00 0.00 0.00 0.00 32.46 30.88 1r3e n ARG 166 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1r3e s ASP 167 N -0.87 6.22 -0.06 0.55 -0.00 -1.09 0.96 116.67 122.38 1r3e s ASP 167 Ca 0.32 -0.88 0.06 0.00 -0.00 0.00 0.00 52.55 52.04 1r3e s ASP 167 Cb 0.19 -2.27 -0.01 0.00 -0.00 0.00 0.00 42.92 40.83 1r3e s ASP 167 CO 0.18 -0.82 -0.24 -0.69 -0.00 0.00 0.00 175.17 173.61 1r3e s VAL 168 N 2.48 1.96 0.09 -1.27 1.01 -0.34 -2.41 120.40 121.92 1r3e s VAL 168 Ca 0.14 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1r3e s VAL 168 Cb -0.19 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1r3e s VAL 168 CO 0.12 0.55 -0.06 -0.94 0.00 0.00 0.00 175.10 174.77 1r3e s SER 169 N -0.06 1.02 -0.09 3.32 1.04 -0.83 0.82 113.70 118.91 1r3e s SER 169 Ca -0.06 -0.97 -0.33 0.00 0.48 0.00 0.00 55.95 55.08 1r3e s SER 169 Cb -0.14 0.11 0.14 0.00 0.10 0.00 0.00 66.02 66.23 1r3e s SER 169 CO 0.04 -0.47 1.41 0.72 0.98 0.00 0.00 173.24 175.92 1r3e s PHE 170 N -3.50 -0.01 0.25 5.02 -0.12 -0.19 -1.41 117.98 118.02 1r3e s PHE 170 Ca 0.09 -0.01 0.07 0.00 -0.05 0.00 0.00 56.93 57.03 1r3e s PHE 170 Cb 0.05 0.51 -0.03 0.00 -0.63 0.00 0.00 43.02 42.91 1r3e s PHE 170 CO -0.05 -0.06 0.23 1.03 -0.05 0.00 0.00 175.22 176.32 1r3e s ARG 171 N -2.10 3.04 -0.27 1.99 0.52 0.07 -1.55 118.95 120.65 1r3e s ARG 171 Ca 0.15 -0.99 -0.21 0.00 -0.52 0.00 0.00 55.73 54.15 1r3e s ARG 171 Cb 0.07 -2.64 0.07 0.00 0.52 0.00 0.00 34.95 32.98 1r3e s ARG 171 CO -0.06 0.41 0.71 0.54 0.02 0.00 0.00 175.30 176.91 1r3e s VAL 172 N -2.10 -0.00 -0.22 3.52 0.11 -0.26 -2.28 120.40 119.17 1r3e s VAL 172 Ca 0.33 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 59.31 1r3e s VAL 172 Cb -0.08 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.74 1r3e s VAL 172 CO 0.26 0.00 0.08 -0.70 -3.33 0.00 0.00 175.10 171.40 1r3e s GLU 173 N 0.88 3.80 0.28 1.54 2.12 -0.86 -0.82 118.70 125.64 1r3e s GLU 173 Ca -0.04 -0.41 0.06 0.00 0.36 0.00 0.00 54.97 54.93 1r3e s GLU 173 Cb -0.05 -3.30 -0.06 0.00 0.26 0.00 0.00 34.13 30.98 1r3e s GLU 173 CO -0.07 -0.00 -0.04 0.14 -0.54 0.00 0.00 175.26 174.75 1r3e s VAL 174 N 1.12 1.49 0.58 3.70 -7.23 -0.49 -1.78 120.40 117.80 1r3e s VAL 174 Ca 0.05 -2.09 -0.06 0.00 -1.81 0.00 0.00 61.98 58.07 1r3e s VAL 174 Cb -0.14 -2.47 0.01 0.00 0.56 0.00 0.00 36.38 34.33 1r3e s VAL 174 CO 0.03 -0.27 0.89 -0.94 -0.31 0.00 0.00 175.10 174.50 1r3e s SER 175 N -3.43 5.60 0.27 4.85 1.04 -0.27 -2.53 113.70 119.23 1r3e s SER 175 Ca 0.30 0.69 -0.30 0.00 0.48 0.00 0.00 55.95 57.12 1r3e s SER 175 Cb 0.05 -1.69 -0.13 0.00 0.10 0.00 0.00 66.02 64.34 1r3e s SER 175 CO 0.12 -1.05 1.38 -2.65 0.98 0.00 0.00 173.24 172.02 1r3e n PRO 176 N -2.56 2.08 -0.26 4.02 -0.02 -1.26 -2.61 135.00 134.40 1r3e n PRO 176 Ca 0.04 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1r3e n PRO 176 Cb 0.58 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1r3e n PRO 176 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r3e n GLY 177 N 1.77 0.86 3.72 -1.23 0.00 -1.26 -4.93 105.19 104.12 1r3e n GLY 177 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1r3e n GLY 177 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1r3e s THR 178 N -2.65 4.73 -0.26 2.61 2.01 -1.07 -5.04 115.64 115.97 1r3e s THR 178 Ca 0.00 1.97 -0.10 0.00 0.31 0.00 0.00 61.69 63.87 1r3e s THR 178 Cb 0.00 -4.28 -0.05 0.00 0.01 0.00 0.00 72.50 68.18 1r3e s THR 178 CO 0.00 0.25 0.15 -0.31 -0.69 0.00 0.00 174.62 174.02 1r3e s TYR 179 N 0.51 3.23 0.26 4.92 1.51 -1.26 -4.97 117.35 121.54 1r3e s TYR 179 Ca 0.48 0.07 0.01 0.00 -1.01 0.00 0.00 57.07 56.61 1r3e s TYR 179 Cb -0.22 -2.30 0.33 0.00 -0.11 0.00 0.00 41.96 39.66 1r3e s TYR 179 CO 0.27 -0.10 1.67 0.82 -1.11 0.00 0.00 175.55 177.10 1r3e h ILE 180 N 5.26 1.28 -0.88 2.71 1.08 -1.99 -1.84 117.51 123.13 1r3e h ILE 180 Ca -0.37 -1.38 0.03 0.00 -0.39 0.00 0.00 64.86 62.75 1r3e h ILE 180 Cb 1.18 1.42 -0.05 0.00 -3.07 0.00 0.00 36.82 36.30 1r3e h ILE 180 CO 0.60 0.44 0.57 0.03 -0.69 0.00 0.00 178.15 179.10 1r3e h ARG 181 N 0.45 1.10 -0.38 2.37 3.08 -1.93 0.74 114.38 119.81 1r3e h ARG 181 Ca 0.06 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 1r3e h ARG 181 Cb 0.76 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1r3e h ARG 181 CO 0.06 0.73 -0.15 0.77 -1.07 0.00 0.00 179.97 180.31 1r3e h SER 182 N 1.13 0.79 -0.05 7.04 0.02 -1.83 -2.27 113.55 118.38 1r3e h SER 182 Ca 0.34 -0.39 0.03 0.00 -0.84 0.00 0.00 61.79 60.93 1r3e h SER 182 Cb -0.04 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.24 1r3e h SER 182 CO -0.10 1.00 -0.14 0.25 -1.14 0.00 0.00 176.83 176.70 1r3e h LEU 183 N 0.58 -0.43 -0.19 5.07 5.85 -0.66 0.14 115.31 125.67 1r3e h LEU 183 Ca 0.09 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.93 1r3e h LEU 183 Cb 0.68 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.86 1r3e h LEU 183 CO 0.05 -0.20 -0.10 0.00 -0.34 0.00 0.00 178.44 177.85 1r3e h MET 185 N -0.08 0.86 -0.23 0.00 2.86 -0.99 -1.23 114.93 116.12 1r3e h MET 185 Ca 0.10 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.65 1r3e h MET 185 Cb 0.24 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1r3e h MET 185 CO -0.24 0.57 -0.04 -0.44 1.06 0.00 0.00 176.91 177.83 1r3e h ASP 186 N 0.89 0.43 -0.66 1.22 3.32 -0.00 -0.01 116.42 121.60 1r3e h ASP 186 Ca 0.36 -0.35 0.04 0.00 0.02 0.00 0.00 57.03 57.10 1r3e h ASP 186 Cb 0.25 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.64 1r3e h ASP 186 CO -0.13 0.67 0.40 0.40 -1.72 0.00 0.00 179.24 178.86 1r3e h ILE 187 N 0.17 1.05 -0.50 0.35 2.04 -0.90 0.15 117.51 119.88 1r3e h ILE 187 Ca 0.06 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 1r3e h ILE 187 Cb 0.48 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 1r3e h ILE 187 CO 0.02 0.14 0.26 1.23 0.00 0.00 0.00 178.15 179.80 1r3e h GLY 188 N 0.77 0.73 1.02 5.37 0.00 -0.97 -0.99 103.07 109.00 1r3e h GLY 188 Ca 0.27 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 47.20 1r3e h GLY 188 CO -0.13 0.31 -0.05 -1.82 0.00 0.00 0.00 176.54 174.86 1r3e h TYR 189 N 0.69 0.96 0.32 5.60 3.20 1.00 0.19 116.97 128.94 1r3e h TYR 189 Ca 0.18 -0.18 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1r3e h TYR 189 Cb 0.05 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.05 1r3e h TYR 189 CO 0.00 0.93 -0.31 0.87 -1.64 0.00 0.00 178.16 178.02 1r3e h LYS 190 N 0.72 -0.62 0.00 1.82 1.79 0.14 0.56 116.57 120.98 1r3e h LYS 190 Ca 0.13 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 1r3e h LYS 190 Cb 0.57 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.37 1r3e h LYS 190 CO 0.03 -0.42 0.00 1.28 -1.08 0.00 0.00 179.45 179.27 1r3e n LEU 191 N -5.42 0.00 -3.08 2.94 4.77 -0.47 -4.85 117.00 110.89 1r3e n LEU 191 Ca -0.09 0.40 -0.14 0.00 -0.03 0.00 0.00 56.01 56.15 1r3e n LEU 191 Cb 0.33 -0.40 0.07 0.00 -2.33 0.00 0.00 43.42 41.08 1r3e n LEU 191 CO 0.29 -0.34 0.06 0.61 -1.33 0.00 0.00 177.39 176.68 1r3e n GLY 192 N -0.94 -0.61 0.00 -0.72 0.00 0.20 -4.90 105.19 98.22 1r3e n GLY 192 Ca 0.02 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1r3e n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3e n GLY 194 N 0.00 -3.29 3.13 0.00 0.00 -0.71 -3.66 105.19 100.65 1r3e n GLY 194 Ca 0.00 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 1r3e n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3e s ALA 195 N -3.47 -0.42 -0.02 4.61 0.00 -1.23 0.54 121.76 121.77 1r3e s ALA 195 Ca 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 51.97 1r3e s ALA 195 Cb 0.00 0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.20 1r3e s ALA 195 CO 0.00 -0.21 -0.05 -0.08 0.00 0.00 0.00 175.76 175.42 1r3e s THR 196 N -1.26 0.50 0.02 0.00 -1.32 -0.87 -3.37 115.64 109.34 1r3e s THR 196 Ca -0.13 -0.20 -0.30 0.00 -1.21 0.00 0.00 61.69 59.84 1r3e s THR 196 Cb -0.07 -0.47 -0.07 0.00 -1.51 0.00 0.00 72.50 70.39 1r3e s THR 196 CO 0.02 0.17 1.57 0.00 -2.21 0.00 0.00 174.62 174.17 1r3e s ALA 197 N 0.28 3.64 -0.05 11.08 0.00 -1.09 -1.08 121.76 134.54 1r3e s ALA 197 Ca -0.03 1.03 0.12 0.00 0.00 0.00 0.00 51.96 53.09 1r3e s ALA 197 Cb -0.07 -3.68 -0.19 0.00 0.00 0.00 0.00 23.12 19.18 1r3e s ALA 197 CO -0.00 -1.12 0.21 1.33 0.00 0.00 0.00 175.76 176.19 1r3e n VAL 198 N 4.89 0.26 -3.79 0.00 0.24 0.43 -1.46 118.33 118.90 1r3e n VAL 198 Ca 0.15 -0.37 -0.13 0.00 -2.04 0.00 0.00 64.34 61.96 1r3e n VAL 198 Cb 0.42 -0.07 -0.11 0.00 -1.47 0.00 0.00 33.84 32.61 1r3e n VAL 198 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1r3e s GLU 199 N -2.72 0.35 -0.08 7.34 2.02 -1.08 -4.79 118.70 119.74 1r3e s GLU 199 Ca -0.05 0.23 -0.04 0.00 0.02 0.00 0.00 54.97 55.13 1r3e s GLU 199 Cb 0.07 0.17 0.04 0.00 0.10 0.00 0.00 34.13 34.51 1r3e s GLU 199 CO 0.53 -0.06 0.18 -1.17 0.02 0.00 0.00 175.26 174.77 1r3e s LEU 200 N -0.16 0.64 -0.16 1.80 2.96 -1.26 -1.79 118.68 120.72 1r3e s LEU 200 Ca -0.03 0.38 -0.01 0.00 -0.22 0.00 0.00 54.13 54.26 1r3e s LEU 200 Cb -0.03 0.51 0.04 0.00 0.50 0.00 0.00 46.19 47.22 1r3e s LEU 200 CO 0.01 -0.15 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.17 1r3e s VAL 201 N 1.15 0.91 -0.59 1.68 1.01 -0.97 -1.28 120.40 122.29 1r3e s VAL 201 Ca -0.09 -0.50 -0.27 0.00 0.00 0.00 0.00 61.98 61.12 1r3e s VAL 201 Cb -0.11 -1.13 0.03 0.00 0.00 0.00 0.00 36.38 35.18 1r3e s VAL 201 CO -0.07 0.10 1.15 -0.60 0.00 0.00 0.00 175.10 175.68 1r3e s ARG 202 N 1.72 3.44 0.24 2.72 3.52 0.82 -0.55 118.95 130.86 1r3e s ARG 202 Ca 0.01 0.08 0.25 0.00 -0.13 0.00 0.00 55.73 55.94 1r3e s ARG 202 Cb -0.15 -4.04 0.62 0.00 -1.56 0.00 0.00 34.95 29.81 1r3e s ARG 202 CO -0.07 -1.70 1.65 0.93 -0.81 0.00 0.00 175.30 175.30 1r3e h GLU 203 N 9.55 0.00 -1.78 5.12 5.08 -0.74 -1.38 114.58 130.44 1r3e h GLU 203 Ca -0.26 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.19 1r3e h GLU 203 Cb 1.06 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.10 1r3e h GLU 203 CO 1.18 0.00 0.52 -1.54 -1.00 0.00 0.00 179.01 178.17 1r3e s SER 204 N -4.85 -0.38 -0.21 1.42 1.04 -1.13 -1.31 113.70 108.28 1r3e s SER 204 Ca 0.09 0.30 -0.02 0.00 0.48 0.00 0.00 55.95 56.80 1r3e s SER 204 Cb 0.11 0.33 0.06 0.00 0.10 0.00 0.00 66.02 66.63 1r3e s SER 204 CO 0.64 -0.43 0.02 -0.69 0.98 0.00 0.00 173.24 173.76 1r3e s VAL 205 N -1.68 0.75 0.00 5.02 1.01 -0.30 -1.60 120.40 123.60 1r3e s VAL 205 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1r3e s VAL 205 Cb -0.01 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1r3e s VAL 205 CO -0.01 -0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.47 1r3e n GLY 206 N 4.96 3.36 0.15 4.51 0.00 0.50 -1.80 105.19 116.87 1r3e n GLY 206 Ca -0.09 -0.13 0.06 0.00 0.00 0.00 0.00 46.02 45.85 1r3e n GLY 206 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1r3e h PRO 207 N 0.00 0.00 -6.27 1.61 0.11 -1.96 -3.46 132.00 122.02 1r3e h PRO 207 Ca 0.00 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.56 1r3e h PRO 207 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1r3e h PRO 207 CO 0.00 0.29 0.83 -1.01 -0.21 0.00 0.00 178.00 177.89 1r3e s HIS 208 N -3.06 2.90 0.35 0.65 3.76 -0.74 -5.02 115.29 114.11 1r3e s HIS 208 Ca 0.03 0.97 0.08 0.00 -0.15 0.00 0.00 55.06 55.99 1r3e s HIS 208 Cb 0.07 -3.55 -0.03 0.00 1.11 0.00 0.00 32.58 30.18 1r3e s HIS 208 CO 0.74 -1.92 0.24 0.95 -0.85 0.00 0.00 174.74 173.90 1r3e s THR 209 N 2.81 3.22 0.21 1.30 -4.23 -1.26 -1.15 115.64 116.55 1r3e s THR 209 Ca 0.59 -1.50 0.26 0.00 -1.18 0.00 0.00 61.69 59.86 1r3e s THR 209 Cb -0.26 -3.08 0.26 0.00 1.34 0.00 0.00 72.50 70.76 1r3e s THR 209 CO 0.21 -0.16 1.91 -0.29 -0.54 0.00 0.00 174.62 175.76 1r3e h ILE 210 N 1.35 0.51 0.00 2.99 2.10 -1.49 -2.34 117.51 120.63 1r3e h ILE 210 Ca -0.44 -0.91 -0.05 0.00 1.08 0.00 0.00 64.86 64.54 1r3e h ILE 210 Cb 1.25 1.63 -0.01 0.00 -1.09 0.00 0.00 36.82 38.60 1r3e h ILE 210 CO 0.60 0.18 -0.24 -0.33 -1.08 0.00 0.00 178.15 177.28 1r3e h GLU 211 N 0.00 0.00 -0.17 2.19 3.07 -1.95 -2.34 114.58 115.38 1r3e h GLU 211 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1r3e h GLU 211 Cb 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 1r3e h GLU 211 CO 0.02 0.24 0.00 -0.85 -1.40 0.00 0.00 179.01 177.02 1r3e n GLU 212 N -3.93 2.19 -2.33 2.33 0.28 -0.90 -4.98 120.64 113.30 1r3e n GLU 212 Ca -0.02 -1.97 -0.34 0.00 -0.16 0.00 0.00 57.16 54.67 1r3e n GLU 212 Cb 0.32 -1.44 -0.01 0.00 1.43 0.00 0.00 31.44 31.74 1r3e n GLU 212 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1r3e s SER 213 N -1.64 5.94 -0.19 -1.84 1.04 -0.88 -4.82 113.70 111.31 1r3e s SER 213 Ca 0.30 2.05 -0.01 0.00 0.48 0.00 0.00 55.95 58.77 1r3e s SER 213 Cb 0.19 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.75 1r3e s SER 213 CO 0.28 -1.06 -0.13 -0.22 0.98 0.00 0.00 173.24 173.09 1r3e s LEU 214 N -3.77 2.51 -0.62 2.42 0.20 0.61 -4.73 118.68 115.30 1r3e s LEU 214 Ca 0.70 -0.51 -0.27 0.00 0.69 0.00 0.00 54.13 54.74 1r3e s LEU 214 Cb -0.20 -1.60 0.00 0.00 -0.43 0.00 0.00 46.19 43.96 1r3e s LEU 214 CO 0.25 0.01 1.58 0.21 -0.29 0.00 0.00 176.35 178.12 1r3e s ASN 215 N 1.25 5.77 0.43 3.68 3.04 -1.26 -0.47 114.94 127.38 1r3e s ASN 215 Ca 0.03 0.16 0.30 0.00 0.04 0.00 0.00 52.86 53.38 1r3e s ASN 215 Cb -0.14 -2.54 1.36 0.00 -1.54 0.00 0.00 41.25 38.38 1r3e s ASN 215 CO -0.06 -2.02 1.89 -0.37 -3.04 0.00 0.00 177.10 173.50 1r3e h VAL 216 N 6.51 0.00 0.00 -5.21 -1.51 -1.93 -2.78 116.25 111.34 1r3e h VAL 216 Ca -0.27 -0.26 -0.12 0.00 -1.23 0.00 0.00 66.70 64.83 1r3e h VAL 216 Cb 1.11 1.08 -0.02 0.00 -2.13 0.00 0.00 31.29 31.33 1r3e h VAL 216 CO 1.21 0.00 -0.55 -0.26 -1.23 0.00 0.00 177.57 176.74 1r3e h PHE 217 N 0.00 0.00 -0.06 5.19 -1.00 -1.88 -3.22 116.94 115.97 1r3e h PHE 217 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1r3e h PHE 217 Cb 0.30 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.86 1r3e h PHE 217 CO 0.00 0.55 0.00 -0.85 -1.61 0.00 0.00 178.31 176.40 1r3e n GLU 218 N -3.57 1.12 -3.55 1.51 0.28 -1.10 -4.98 120.64 110.34 1r3e n GLU 218 Ca -0.00 -1.41 -0.36 0.00 -0.16 0.00 0.00 57.16 55.22 1r3e n GLU 218 Cb 0.62 -1.27 -0.06 0.00 1.43 0.00 0.00 31.44 32.16 1r3e n GLU 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1r3e s ALA 219 N -1.14 3.71 0.50 -1.84 0.00 -1.07 -5.07 121.76 116.86 1r3e s ALA 219 Ca 0.17 -0.31 -0.18 0.00 0.00 0.00 0.00 51.96 51.64 1r3e s ALA 219 Cb 0.12 -2.32 -0.08 0.00 0.00 0.00 0.00 23.12 20.84 1r3e s ALA 219 CO 0.18 0.53 1.00 0.00 0.00 0.00 0.00 175.76 177.46 1r3e s ALA 220 N -1.27 2.98 0.49 0.00 0.00 -1.26 -4.89 121.76 117.81 1r3e s ALA 220 Ca 0.29 0.33 0.29 0.00 0.00 0.00 0.00 51.96 52.87 1r3e s ALA 220 Cb -0.15 -3.16 1.38 0.00 0.00 0.00 0.00 23.12 21.18 1r3e s ALA 220 CO 0.16 -0.24 1.81 -1.00 0.00 0.00 0.00 175.76 176.49 1r3e h PRO 221 N 1.19 0.14 -0.36 0.00 0.13 -1.95 -2.12 132.00 129.03 1r3e h PRO 221 Ca -0.48 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 64.51 1r3e h PRO 221 Cb 1.19 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1r3e h PRO 221 CO 0.60 0.09 -0.30 1.49 -0.23 0.00 0.00 178.00 179.66 1r3e h GLU 222 N 0.14 0.77 0.04 0.86 4.81 -1.92 -1.64 114.58 117.66 1r3e h GLU 222 Ca 0.54 -0.35 -0.23 0.00 -0.13 0.00 0.00 59.36 59.20 1r3e h GLU 222 Cb 1.87 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.22 1r3e h GLU 222 CO -0.11 0.97 -1.03 1.05 -0.73 0.00 0.00 179.01 179.16 1r3e h GLU 223 N 0.66 0.15 -0.53 1.92 4.11 -1.77 -1.63 114.58 117.49 1r3e h GLU 223 Ca 0.08 -0.21 0.01 0.00 0.07 0.00 0.00 59.36 59.30 1r3e h GLU 223 Cb 0.83 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.13 1r3e h GLU 223 CO 0.07 1.05 0.35 0.82 0.07 0.00 0.00 179.01 181.37 1r3e h ILE 224 N 0.06 1.13 -0.60 -1.06 2.04 -1.42 0.55 117.51 118.21 1r3e h ILE 224 Ca -0.06 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 1r3e h ILE 224 Cb 1.74 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 1r3e h ILE 224 CO 0.15 0.13 0.36 -0.08 0.00 0.00 0.00 178.15 178.71 1r3e h GLU 225 N 0.72 0.82 0.00 2.37 4.81 -1.17 -1.69 114.58 120.43 1r3e h GLU 225 Ca 0.20 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1r3e h GLU 225 Cb -0.08 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.13 1r3e h GLU 225 CO -0.04 0.59 -0.11 -0.91 -0.73 0.00 0.00 179.01 177.80 1r3e h ASN 226 N 0.81 0.00 1.30 1.04 -0.26 -0.84 -2.80 115.58 114.83 1r3e h ASN 226 Ca 0.22 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.96 1r3e h ASN 226 Cb -0.01 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.25 1r3e h ASN 226 CO -0.04 0.11 0.00 -1.14 -1.06 0.00 0.00 177.43 175.30 1r3e n ARG 227 N -3.27 0.18 -2.19 0.81 3.00 0.15 -4.84 116.66 110.50 1r3e n ARG 227 Ca 0.00 0.17 -0.42 0.00 -0.00 0.00 0.00 57.85 57.60 1r3e n ARG 227 Cb 0.36 -1.72 -0.03 0.00 0.00 0.00 0.00 32.46 31.07 1r3e n ARG 227 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1r3e s ILE 228 N -3.08 3.49 -0.27 5.15 1.01 -1.06 -4.68 121.20 121.76 1r3e s ILE 228 Ca 0.11 1.01 -0.25 0.00 0.00 0.00 0.00 60.65 61.52 1r3e s ILE 228 Cb 0.14 -3.65 -0.00 0.00 0.01 0.00 0.00 42.46 38.96 1r3e s ILE 228 CO 0.56 0.05 0.85 -0.63 0.00 0.00 0.00 174.94 175.77 1r3e s ILE 229 N 1.62 4.79 0.73 2.92 1.01 0.26 -4.87 121.20 127.66 1r3e s ILE 229 Ca 0.64 1.50 -0.13 0.00 0.00 0.00 0.00 60.65 62.66 1r3e s ILE 229 Cb -0.35 -4.16 0.04 0.00 0.01 0.00 0.00 42.46 38.01 1r3e s ILE 229 CO 0.29 -0.16 1.13 -2.16 0.00 0.00 0.00 174.94 174.04 1r3e s PRO 230 N 2.96 2.33 0.26 2.79 0.04 -1.26 -0.43 135.00 141.69 1r3e s PRO 230 Ca 0.35 1.41 -0.03 0.00 0.04 0.00 0.00 61.00 62.77 1r3e s PRO 230 Cb -0.15 -1.89 0.54 0.00 0.04 0.00 0.00 34.50 33.04 1r3e s PRO 230 CO 0.09 -1.62 1.66 -0.07 0.04 0.00 0.00 177.00 177.11 1r3e h LEU 231 N -0.57 -0.06 -2.48 -3.56 4.07 -1.94 -0.44 115.31 110.32 1r3e h LEU 231 Ca -0.46 0.17 0.01 0.00 0.08 0.00 0.00 57.88 57.69 1r3e h LEU 231 Cb 1.25 0.25 -0.00 0.00 1.08 0.00 0.00 40.66 43.24 1r3e h LEU 231 CO 0.51 -0.10 0.15 -0.33 -1.08 0.00 0.00 178.44 177.59 1r3e h GLU 232 N 0.22 0.00 -0.29 1.13 3.07 -1.91 -0.94 114.58 115.86 1r3e h GLU 232 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 1r3e h GLU 232 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1r3e h GLU 232 CO -0.59 0.00 0.00 1.63 -1.40 0.00 0.00 179.01 178.65 1r3e n LYS 233 N -3.22 2.11 -2.98 2.33 5.02 -0.19 -4.97 118.16 116.26 1r3e n LYS 233 Ca -0.02 -1.93 -0.28 0.00 -2.02 0.00 0.00 58.31 54.07 1r3e n LYS 233 Cb 0.23 -1.36 -0.02 0.00 -0.02 0.00 0.00 35.03 33.86 1r3e n LYS 233 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1r3e n LEU 235 N -1.68 -2.11 0.04 0.00 4.32 -1.26 -4.79 117.00 111.52 1r3e n LEU 235 Ca -0.01 -0.98 0.06 0.00 -0.02 0.00 0.00 56.01 55.06 1r3e n LEU 235 Cb 0.55 -2.23 0.25 0.00 -1.62 0.00 0.00 43.42 40.38 1r3e n LEU 235 CO 0.50 0.39 0.67 1.21 -1.22 0.00 0.00 177.39 178.94 1r3e n GLU 236 N -4.43 0.04 0.00 3.23 2.13 -1.26 -1.39 120.64 118.97 1r3e n GLU 236 Ca -0.14 0.41 0.14 0.00 0.66 0.00 0.00 57.16 58.23 1r3e n GLU 236 Cb 0.60 -1.60 0.59 0.00 0.27 0.00 0.00 31.44 31.30 1r3e n GLU 236 CO 0.00 0.00 0.00 -2.67 -0.41 0.00 0.00 177.13 174.05 1r3e n TRP 237 N -1.68 0.00 -3.61 4.31 2.14 -1.26 -4.78 117.44 112.55 1r3e n TRP 237 Ca 0.01 0.00 -0.37 0.00 2.07 0.00 0.00 57.50 59.21 1r3e n TRP 237 Cb 0.10 -0.29 -0.06 0.00 -0.81 0.00 0.00 31.31 30.25 1r3e n TRP 237 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1r3e s LEU 238 N -2.70 4.44 0.35 5.67 1.43 -0.48 -5.05 118.68 122.33 1r3e s LEU 238 Ca 0.23 0.81 -0.28 0.00 -1.03 0.00 0.00 54.13 53.86 1r3e s LEU 238 Cb 0.19 -2.50 -0.12 0.00 0.03 0.00 0.00 46.19 43.79 1r3e s LEU 238 CO 0.52 0.33 1.25 -2.65 0.23 0.00 0.00 176.35 176.03 1r3e n PRO 239 N 1.74 2.02 -2.32 1.29 -0.02 -1.26 -4.78 135.00 131.67 1r3e n PRO 239 Ca -0.15 0.71 -0.25 0.00 -2.02 0.00 0.00 63.50 61.79 1r3e n PRO 239 Cb 0.53 -2.28 0.08 0.00 -0.02 0.00 0.00 33.50 31.81 1r3e n PRO 239 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1r3e s ARG 240 N -1.88 2.07 -0.29 -0.52 0.52 -1.26 -2.35 118.95 115.25 1r3e s ARG 240 Ca 0.56 -0.49 -0.21 0.00 -0.52 0.00 0.00 55.73 55.07 1r3e s ARG 240 Cb -0.58 -2.23 0.13 0.00 0.52 0.00 0.00 34.95 32.80 1r3e s ARG 240 CO 0.62 -1.25 1.01 0.08 0.02 0.00 0.00 175.30 175.77 1r3e s VAL 241 N -3.19 0.00 0.11 3.52 1.01 -1.10 -3.43 120.40 117.32 1r3e s VAL 241 Ca 0.61 0.00 0.10 0.00 0.00 0.00 0.00 61.98 62.70 1r3e s VAL 241 Cb -0.09 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1r3e s VAL 241 CO 0.44 0.00 -0.26 -0.69 0.00 0.00 0.00 175.10 174.59 1r3e s VAL 242 N 0.70 2.20 0.32 2.92 1.01 -0.02 0.10 120.40 127.63 1r3e s VAL 242 Ca -0.02 -1.65 0.09 0.00 0.00 0.00 0.00 61.98 60.40 1r3e s VAL 242 Cb -0.04 -1.93 -0.06 0.00 0.00 0.00 0.00 36.38 34.34 1r3e s VAL 242 CO -0.10 0.15 -0.09 0.68 0.00 0.00 0.00 175.10 175.74 1r3e s VAL 243 N -1.00 2.05 0.14 2.92 -7.23 -0.69 -2.90 120.40 113.69 1r3e s VAL 243 Ca 0.13 -2.18 -0.31 0.00 -1.81 0.00 0.00 61.98 57.80 1r3e s VAL 243 Cb -0.10 -2.57 -0.09 0.00 0.56 0.00 0.00 36.38 34.18 1r3e s VAL 243 CO 0.05 -0.24 1.52 -1.00 -0.31 0.00 0.00 175.10 175.12 1r3e s HIS 244 N -2.74 3.07 -0.53 2.82 3.76 0.04 -4.22 115.29 117.49 1r3e s HIS 244 Ca 0.31 0.70 0.00 0.00 -0.15 0.00 0.00 55.06 55.93 1r3e s HIS 244 Cb 0.03 -3.85 0.00 0.00 1.11 0.00 0.00 32.58 29.86 1r3e s HIS 244 CO 0.15 -3.13 0.32 0.94 -0.85 0.00 0.00 174.74 172.17 1r3e n GLN 245 N 4.09 0.00 -0.09 1.40 -0.06 -1.26 0.10 117.38 121.56 1r3e n GLN 245 Ca 0.13 0.05 -0.10 0.00 -2.00 0.00 0.00 57.00 55.08 1r3e n GLN 245 Cb 0.40 -1.61 -0.16 0.00 -4.06 0.00 0.00 30.24 24.81 1r3e n GLN 245 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 1r3e n GLU 246 N -0.82 0.68 0.17 3.69 4.07 -1.26 -4.31 120.64 122.86 1r3e n GLU 246 Ca 0.00 0.03 0.13 0.00 -0.06 0.00 0.00 57.16 57.26 1r3e n GLU 246 Cb 0.11 -1.55 0.50 0.00 -0.06 0.00 0.00 31.44 30.44 1r3e n GLU 246 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1r3e h SER 247 N 0.00 0.00 -0.06 4.31 0.02 0.35 -3.36 113.55 114.81 1r3e h SER 247 Ca -0.52 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.45 1r3e h SER 247 Cb 2.22 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 64.70 1r3e h SER 247 CO 0.03 0.00 -0.46 0.00 -1.14 0.00 0.00 176.83 175.27 1r3e h THR 248 N 0.00 0.00 -1.00 -2.27 1.03 -1.75 -1.39 112.91 107.54 1r3e h THR 248 Ca 0.00 0.00 0.22 0.00 -0.01 0.00 0.00 66.41 66.62 1r3e h THR 248 Cb 0.52 0.00 -0.10 0.00 -1.07 0.00 0.00 68.15 67.50 1r3e h THR 248 CO 0.00 0.00 0.62 0.50 -0.01 0.00 0.00 175.52 176.63 1r3e h LYS 249 N -0.53 0.56 0.83 0.00 3.64 -1.88 0.27 116.57 119.46 1r3e h LYS 249 Ca 0.02 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 1r3e h LYS 249 Cb 0.59 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1r3e h LYS 249 CO -0.34 0.37 -0.43 0.52 -2.27 0.00 0.00 179.45 177.30 1r3e h MET 250 N 0.58 -1.12 -0.46 1.90 2.86 -1.52 -2.57 114.93 114.61 1r3e h MET 250 Ca 0.57 0.08 0.09 0.00 -2.06 0.00 0.00 59.70 58.38 1r3e h MET 250 Cb 1.15 0.25 -0.09 0.00 0.06 0.00 0.00 31.60 32.98 1r3e h MET 250 CO -0.33 -0.74 -0.11 0.82 1.06 0.00 0.00 176.91 177.61 1r3e h ILE 251 N -1.16 0.55 0.00 -1.22 2.04 -0.35 0.48 117.51 117.85 1r3e h ILE 251 Ca -0.11 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1r3e h ILE 251 Cb 0.90 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1r3e h ILE 251 CO 0.17 0.00 0.02 0.18 0.00 0.00 0.00 178.15 178.52 1r3e n LEU 252 N -5.33 0.00 -0.54 1.44 4.32 -0.01 0.49 117.00 117.37 1r3e n LEU 252 Ca 0.04 0.43 0.10 0.00 -0.02 0.00 0.00 56.01 56.56 1r3e n LEU 252 Cb 0.25 -0.43 0.01 0.00 -1.62 0.00 0.00 43.42 41.63 1r3e n LEU 252 CO 0.13 -0.43 0.35 0.59 -1.22 0.00 0.00 177.39 176.81 1r3e n ASN 253 N -1.43 2.10 0.00 -1.43 3.02 0.17 -4.84 115.26 112.85 1r3e n ASN 253 Ca 0.00 -1.55 0.00 0.00 -0.03 0.00 0.00 54.58 53.00 1r3e n ASN 253 Cb 0.02 0.40 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 1r3e n ASN 253 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r3e n GLY 254 N 1.34 1.11 3.70 7.41 0.00 0.18 -5.07 105.19 113.87 1r3e n GLY 254 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1r3e n GLY 254 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r3e s SER 255 N -2.00 7.00 1.11 1.61 0.01 -1.06 -4.99 113.70 115.38 1r3e s SER 255 Ca 0.00 2.03 -0.13 0.00 1.31 0.00 0.00 55.95 59.16 1r3e s SER 255 Cb 0.00 -2.57 0.25 0.00 0.21 0.00 0.00 66.02 63.91 1r3e s SER 255 CO 0.00 -0.56 1.05 -1.10 0.41 0.00 0.00 173.24 173.04 1r3e s GLN 256 N 1.55 -0.49 -0.22 12.44 -1.52 -1.26 -4.40 119.66 125.76 1r3e s GLN 256 Ca 0.60 0.78 -0.09 0.00 -1.95 0.00 0.00 55.36 54.69 1r3e s GLN 256 Cb -0.30 -1.61 -0.05 0.00 -0.22 0.00 0.00 33.01 30.84 1r3e s GLN 256 CO 0.27 -3.42 0.12 0.42 -0.25 0.00 0.00 175.29 172.43 1r3e s ILE 257 N -2.61 5.15 0.20 1.08 1.01 -1.06 -4.93 121.20 120.04 1r3e s ILE 257 Ca 0.67 0.10 0.10 0.00 0.00 0.00 0.00 60.65 61.53 1r3e s ILE 257 Cb -0.23 -3.37 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 1r3e s ILE 257 CO 0.62 0.40 -0.15 -1.00 0.00 0.00 0.00 174.94 174.81 1r3e s HIS 258 N 0.74 2.49 0.33 3.97 3.76 -1.26 -0.99 115.29 124.33 1r3e s HIS 258 Ca 0.06 -0.28 0.13 0.00 -0.15 0.00 0.00 55.06 54.82 1r3e s HIS 258 Cb -0.13 -1.20 1.03 0.00 1.11 0.00 0.00 32.58 33.39 1r3e s HIS 258 CO 0.02 0.53 1.68 1.25 -0.85 0.00 0.00 174.74 177.37 1r3e h LEU 259 N 2.89 0.55 -0.09 0.89 6.46 -1.24 -1.74 115.31 123.03 1r3e h LEU 259 Ca -0.46 0.18 0.01 0.00 -0.12 0.00 0.00 57.88 57.49 1r3e h LEU 259 Cb 1.21 0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 41.24 1r3e h LEU 259 CO 0.53 -0.07 -0.07 -0.08 -0.62 0.00 0.00 178.44 178.12 1r3e h GLU 260 N 0.39 -0.03 -6.26 1.25 4.57 -1.95 -3.30 114.58 109.26 1r3e h GLU 260 Ca 0.71 0.00 -0.53 0.00 -1.18 0.00 0.00 59.36 58.36 1r3e h GLU 260 Cb 1.55 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 30.09 1r3e h GLU 260 CO -0.57 -0.02 1.19 0.00 -1.18 0.00 0.00 179.01 178.43 1r3e s MET 261 N -3.33 3.09 0.00 1.92 0.23 -0.66 -4.82 119.30 115.73 1r3e s MET 261 Ca -0.02 0.56 0.00 0.00 -1.03 0.00 0.00 55.69 55.20 1r3e s MET 261 Cb 0.01 -4.22 0.00 0.00 -1.53 0.00 0.00 34.83 29.09 1r3e s MET 261 CO 0.08 -2.19 0.00 -0.11 -2.03 0.00 0.00 175.02 170.77 1r3e n LEU 262 N 10.60 0.00 0.00 0.18 7.94 -1.24 -4.47 117.00 130.01 1r3e n LEU 262 Ca 0.15 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.05 1r3e n LEU 262 Cb 0.50 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.45 1r3e n LEU 262 CO 0.71 0.00 0.00 1.17 -1.11 0.00 0.00 177.39 178.16 1r3e n LYS 263 N 0.00 0.00 -4.30 1.96 0.00 -1.14 -0.78 118.16 113.90 1r3e n LYS 263 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 58.31 58.07 1r3e n LYS 263 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 34.91 1r3e n LYS 263 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1r3e s GLU 264 N 0.00 1.17 0.26 1.64 -1.05 -1.23 -5.01 118.70 114.48 1r3e s GLU 264 Ca 0.00 -1.22 0.01 0.00 -0.15 0.00 0.00 54.97 53.61 1r3e s GLU 264 Cb 0.00 -1.39 -0.03 0.00 -0.44 0.00 0.00 34.13 32.27 1r3e s GLU 264 CO 0.00 0.31 0.23 1.67 0.95 0.00 0.00 175.26 178.43 1r3e s TRP 265 N -1.37 1.34 -0.32 4.83 1.48 -1.26 -0.84 118.94 122.81 1r3e s TRP 265 Ca 0.09 -1.45 0.15 0.00 -1.06 0.00 0.00 56.10 53.83 1r3e s TRP 265 Cb -0.09 -0.54 0.47 0.00 -1.16 0.00 0.00 33.47 32.15 1r3e s TRP 265 CO 0.05 -0.79 1.07 -0.25 -4.06 0.00 0.00 176.95 172.97 1r3e n ASP 266 N -0.86 2.75 -1.88 -2.66 9.92 -1.22 -4.98 116.55 117.62 1r3e n ASP 266 Ca 0.04 -2.88 0.00 0.00 -0.53 0.00 0.00 54.79 51.41 1r3e n ASP 266 Cb 0.64 -0.47 0.00 0.00 -0.64 0.00 0.00 41.12 40.65 1r3e n ASP 266 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1r3e n GLY 267 N -0.42 -4.97 3.33 0.44 0.00 -1.26 -4.86 105.19 97.45 1r3e n GLY 267 Ca 0.21 -0.47 0.02 0.00 0.00 0.00 0.00 46.02 45.78 1r3e n GLY 267 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1r3e s PHE 268 N -2.47 -1.19 0.14 1.61 -0.12 -1.26 -4.91 117.98 109.78 1r3e s PHE 268 Ca 0.00 1.60 -0.32 0.00 -0.05 0.00 0.00 56.93 58.16 1r3e s PHE 268 Cb 0.00 0.54 -0.12 0.00 -0.63 0.00 0.00 43.02 42.82 1r3e s PHE 268 CO 0.00 -0.63 1.76 1.17 -0.05 0.00 0.00 175.22 177.47 1r3e n LYS 269 N 5.36 2.61 -1.36 1.99 3.00 -1.26 -3.39 118.16 125.11 1r3e n LYS 269 Ca -0.06 0.95 -0.50 0.00 -0.00 0.00 0.00 58.31 58.70 1r3e n LYS 269 Cb 0.51 -2.80 -0.05 0.00 0.00 0.00 0.00 35.03 32.70 1r3e n LYS 269 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1r3e n LYS 270 N 4.77 0.00 0.00 1.64 4.81 -1.25 -0.74 118.16 127.39 1r3e n LYS 270 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.62 1r3e n LYS 270 Cb 0.34 -1.13 0.00 0.00 0.02 0.00 0.00 35.03 34.26 1r3e n LYS 270 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r3e n GLY 271 N 1.71 2.44 3.76 3.14 0.00 0.74 -4.96 105.19 112.02 1r3e n GLY 271 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1r3e n GLY 271 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r3e s GLU 272 N -0.74 3.64 -0.23 1.61 2.56 0.08 -4.51 118.70 121.11 1r3e s GLU 272 Ca 0.00 2.29 -0.14 0.00 0.00 0.00 0.00 54.97 57.12 1r3e s GLU 272 Cb 0.00 -2.58 -0.04 0.00 2.00 0.00 0.00 34.13 33.51 1r3e s GLU 272 CO 0.00 -0.81 0.34 0.08 -0.56 0.00 0.00 175.26 174.31 1r3e s VAL 273 N -1.25 5.23 0.12 3.70 1.01 -1.26 -0.43 120.40 127.51 1r3e s VAL 273 Ca 0.62 0.55 0.05 0.00 0.00 0.00 0.00 61.98 63.21 1r3e s VAL 273 Cb -0.41 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1r3e s VAL 273 CO 0.52 0.25 -0.13 0.68 0.00 0.00 0.00 175.10 176.41 1r3e s VAL 274 N 1.46 1.25 -0.27 2.92 -7.23 0.18 -4.39 120.40 114.32 1r3e s VAL 274 Ca 0.15 -1.71 -0.11 0.00 -1.81 0.00 0.00 61.98 58.51 1r3e s VAL 274 Cb -0.15 -1.50 -0.05 0.00 0.56 0.00 0.00 36.38 35.24 1r3e s VAL 274 CO 0.08 -0.46 0.17 0.00 -0.31 0.00 0.00 175.10 174.59 1r3e s ARG 275 N -2.73 3.96 -0.26 4.82 1.70 -0.99 -0.26 118.95 125.20 1r3e s ARG 275 Ca 0.08 -0.32 -0.29 0.00 -0.47 0.00 0.00 55.73 54.74 1r3e s ARG 275 Cb -0.04 -3.61 0.01 0.00 -0.57 0.00 0.00 34.95 30.74 1r3e s ARG 275 CO 0.02 -0.12 1.04 0.14 -1.08 0.00 0.00 175.30 175.31 1r3e s VAL 276 N 1.56 4.64 0.05 4.99 -7.23 0.16 -2.71 120.40 121.86 1r3e s VAL 276 Ca 0.07 1.92 -0.01 0.00 -1.81 0.00 0.00 61.98 62.15 1r3e s VAL 276 Cb -0.15 -4.33 -0.04 0.00 0.56 0.00 0.00 36.38 32.41 1r3e s VAL 276 CO 0.09 -0.27 0.21 -0.36 -0.31 0.00 0.00 175.10 174.46 1r3e s PHE 277 N 3.32 3.53 -2.00 2.82 0.08 0.28 -0.98 117.98 125.02 1r3e s PHE 277 Ca 0.44 0.29 0.11 0.00 0.12 0.00 0.00 56.93 57.89 1r3e s PHE 277 Cb -0.14 -1.79 0.67 0.00 -0.57 0.00 0.00 43.02 41.19 1r3e s PHE 277 CO 0.09 0.60 1.39 -1.71 -0.10 0.00 0.00 175.22 175.48 1r3e n ASN 278 N 0.43 0.00 0.00 1.36 5.15 0.13 -1.71 115.26 120.62 1r3e n ASN 278 Ca -0.06 -1.54 0.00 0.00 -0.60 0.00 0.00 54.58 52.38 1r3e n ASN 278 Cb 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.76 1r3e n ASN 278 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1r3e n GLU 279 N -0.69 0.00 -0.12 1.20 2.13 -1.26 -4.29 120.64 117.61 1r3e n GLU 279 Ca 0.08 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.97 1r3e n GLU 279 Cb 0.04 -3.58 0.13 0.00 0.27 0.00 0.00 31.44 28.30 1r3e n GLU 279 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1r3e n GLU 280 N -1.69 2.01 0.00 5.31 2.13 -1.26 -4.98 120.64 122.16 1r3e n GLU 280 Ca 0.00 -1.81 0.00 0.00 0.66 0.00 0.00 57.16 56.01 1r3e n GLU 280 Cb 0.00 -1.30 0.00 0.00 0.27 0.00 0.00 31.44 30.41 1r3e n GLU 280 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1r3e n GLY 281 N 0.76 3.11 3.56 8.31 0.00 -1.26 -5.06 105.19 114.60 1r3e n GLY 281 Ca 0.12 -0.91 -0.48 0.00 0.00 0.00 0.00 46.02 44.75 1r3e n GLY 281 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1r3e n ARG 282 N 0.00 1.03 -3.04 1.61 0.63 -1.26 -4.57 116.66 111.07 1r3e n ARG 282 Ca 0.00 0.37 -0.41 0.00 -0.92 0.00 0.00 57.85 56.88 1r3e n ARG 282 Cb 0.00 -1.77 -0.06 0.00 0.45 0.00 0.00 32.46 31.09 1r3e n ARG 282 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1r3e s LEU 283 N 0.85 4.09 -0.12 6.15 0.20 -1.26 0.19 118.68 128.79 1r3e s LEU 283 Ca 0.69 0.66 -0.06 0.00 0.69 0.00 0.00 54.13 56.11 1r3e s LEU 283 Cb -0.83 -2.95 -0.26 0.00 -0.43 0.00 0.00 46.19 41.72 1r3e s LEU 283 CO 0.55 -0.48 0.38 0.18 -0.29 0.00 0.00 176.35 176.68 1r3e n LEU 284 N 5.93 2.61 -3.85 -0.68 4.77 -0.16 -4.77 117.00 120.85 1r3e n LEU 284 Ca 0.01 0.22 0.02 0.00 -0.03 0.00 0.00 56.01 56.22 1r3e n LEU 284 Cb 0.48 -1.10 0.01 0.00 -2.33 0.00 0.00 43.42 40.48 1r3e n LEU 284 CO 0.46 0.85 1.05 0.00 -1.33 0.00 0.00 177.39 178.42 1r3e s ALA 285 N -2.56 -2.28 -0.05 -1.18 0.00 -1.17 -1.19 121.76 113.32 1r3e s ALA 285 Ca -0.22 0.22 0.05 0.00 0.00 0.00 0.00 51.96 52.01 1r3e s ALA 285 Cb 0.07 0.69 -0.02 0.00 0.00 0.00 0.00 23.12 23.86 1r3e s ALA 285 CO 0.77 -1.11 -0.19 -0.51 0.00 0.00 0.00 175.76 174.73 1r3e s LEU 286 N -3.47 2.47 0.06 0.00 1.43 -0.17 0.40 118.68 119.41 1r3e s LEU 286 Ca 0.23 -0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 52.97 1r3e s LEU 286 Cb 0.01 -1.48 -0.02 0.00 0.03 0.00 0.00 46.19 44.72 1r3e s LEU 286 CO -0.01 0.31 0.06 0.00 0.23 0.00 0.00 176.35 176.93 1r3e s ALA 287 N -0.50 0.20 -0.08 4.21 0.00 0.64 -1.05 121.76 125.18 1r3e s ALA 287 Ca 0.06 -0.94 -0.07 0.00 0.00 0.00 0.00 51.96 51.01 1r3e s ALA 287 Cb -0.12 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.31 1r3e s ALA 287 CO 0.01 -0.42 0.19 -2.00 0.00 0.00 0.00 175.76 173.54 1r3e s GLU 288 N -3.79 3.51 -0.10 0.00 2.12 0.26 -0.65 118.70 120.05 1r3e s GLU 288 Ca 0.05 -0.08 -0.30 0.00 0.36 0.00 0.00 54.97 55.00 1r3e s GLU 288 Cb 0.06 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 31.25 1r3e s GLU 288 CO -0.10 0.75 1.37 0.00 -0.54 0.00 0.00 175.26 176.74 1r3e s ALA 289 N -1.09 3.62 -0.55 6.30 0.00 0.43 0.11 121.76 130.58 1r3e s ALA 289 Ca 0.19 0.66 0.24 0.00 0.00 0.00 0.00 51.96 53.04 1r3e s ALA 289 Cb -0.13 -3.64 0.48 0.00 0.00 0.00 0.00 23.12 19.84 1r3e s ALA 289 CO 0.08 -1.14 1.59 0.93 0.00 0.00 0.00 175.76 177.21 1r3e h GLU 290 N 8.39 0.00 0.00 0.00 4.39 -0.25 0.21 114.58 127.32 1r3e h GLU 290 Ca -0.32 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.40 1r3e h GLU 290 Cb 1.14 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.79 1r3e h GLU 290 CO 0.95 0.00 0.34 -2.13 -1.16 0.00 0.00 179.01 177.01 1r3e n ARG 291 N -2.66 0.92 -2.55 2.33 3.00 -1.26 -4.84 116.66 111.60 1r3e n ARG 291 Ca 0.04 -1.87 -0.42 0.00 -0.00 0.00 0.00 57.85 55.61 1r3e n ARG 291 Cb 0.49 2.37 -0.04 0.00 0.00 0.00 0.00 32.46 35.28 1r3e n ARG 291 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1r3e s ASN 292 N -3.02 7.26 -1.02 6.15 0.01 -1.26 -3.81 114.94 119.24 1r3e s ASN 292 Ca 0.17 1.94 -0.20 0.00 -0.71 0.00 0.00 52.86 54.05 1r3e s ASN 292 Cb -0.04 -2.59 0.09 0.00 0.41 0.00 0.00 41.25 39.12 1r3e s ASN 292 CO 0.09 -0.28 1.35 -0.94 -1.51 0.00 0.00 177.10 175.81 1r3e s SER 293 N 0.50 6.62 0.00 -1.22 1.04 -1.22 -3.18 113.70 116.24 1r3e s SER 293 Ca 0.52 -1.88 0.00 0.00 0.48 0.00 0.00 55.95 55.08 1r3e s SER 293 Cb -0.27 -2.49 0.00 0.00 0.10 0.00 0.00 66.02 63.36 1r3e s SER 293 CO 0.31 -1.25 0.00 -0.24 0.98 0.00 0.00 173.24 173.04 1r3e n SER 294 N 7.71 0.00 -3.39 7.02 2.88 -1.26 -4.46 113.62 122.13 1r3e n SER 294 Ca 0.31 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.53 1r3e n SER 294 Cb 0.49 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.92 1r3e n SER 294 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1r3e n PHE 295 N 0.00 1.83 1.39 0.66 3.01 -1.19 -4.54 117.46 118.62 1r3e n PHE 295 Ca 0.00 -2.11 0.01 0.00 1.01 0.00 0.00 57.45 56.36 1r3e n PHE 295 Cb 0.00 -1.84 0.08 0.00 -0.01 0.00 0.00 39.48 37.71 1r3e n PHE 295 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1r3e n LEU 296 N 5.40 0.00 -4.56 4.37 -0.00 -1.26 -4.69 117.00 116.25 1r3e n LEU 296 Ca 0.50 0.00 -0.40 0.00 -0.00 0.00 0.00 56.01 56.11 1r3e n LEU 296 Cb 0.25 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.64 1r3e n LEU 296 CO 0.85 0.00 1.54 -0.70 -0.00 0.00 0.00 177.39 179.08 1r3e s GLU 297 N -2.00 2.84 -0.07 1.96 -6.30 -1.26 -4.77 118.70 109.10 1r3e s GLU 297 Ca 0.04 0.70 0.17 0.00 -2.50 0.00 0.00 54.97 53.38 1r3e s GLU 297 Cb 0.02 -4.32 0.35 0.00 0.00 0.00 0.00 34.13 30.18 1r3e s GLU 297 CO 0.03 -2.48 1.16 -2.37 0.02 0.00 0.00 175.26 171.62 1r3e n THR 298 N 7.18 0.80 0.00 -1.70 5.66 -1.26 -4.84 114.28 120.12 1r3e n THR 298 Ca 0.19 -1.60 0.00 0.00 -3.05 0.00 0.00 64.05 59.60 1r3e n THR 298 Cb 0.51 0.46 0.00 0.00 -1.55 0.00 0.00 70.33 69.75 1r3e n THR 298 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1r3e n LEU 299 N -0.21 0.00 0.00 1.09 -0.00 -1.26 -4.47 117.00 112.15 1r3e n LEU 299 Ca 0.10 0.03 0.00 0.00 -0.00 0.00 0.00 56.01 56.13 1r3e n LEU 299 Cb 0.90 -0.03 0.00 0.00 -0.00 0.00 0.00 43.42 44.30 1r3e n LEU 299 CO -0.03 -0.03 0.00 0.54 -0.00 0.00 0.00 177.39 177.87 1r3e n ARG 300 N -0.78 0.00 0.00 1.47 3.00 -1.26 -5.30 116.66 113.80 1r3e n ARG 300 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1r3e n ARG 300 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.50 1r3e n ARG 300 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1r3e n LYS 301 N 0.00 3.08 0.00 5.56 5.02 -1.26 -5.19 118.16 125.38 1r3e n LYS 301 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1r3e n LYS 301 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1r3e n LYS 301 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1r3e n GLU 306 N 0.00 0.00 0.00 1.97 0.28 -1.26 -5.00 120.64 116.63 1r3e n GLU 306 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1r3e n GLU 306 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1r3e n GLU 306 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1r3e n ARG 307 N 0.00 0.00 0.12 3.44 -4.01 -1.26 -0.77 116.66 114.18 1r3e n ARG 307 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 1r3e n ARG 307 Cb 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.42 1r3e n ARG 307 CO 0.00 0.00 0.00 1.33 -3.04 0.00 0.00 177.63 175.92 1r3e n VAL 308 N 0.00 0.12 -4.94 8.89 0.24 -0.16 -4.74 118.33 117.73 1r3e n VAL 308 Ca 0.00 0.04 -0.33 0.00 -2.04 0.00 0.00 64.34 62.01 1r3e n VAL 308 Cb 0.00 -0.62 -0.15 0.00 -1.47 0.00 0.00 33.84 31.60 1r3e n VAL 308 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1r3e s LEU 309 N -6.73 2.52 -0.15 1.34 1.43 -1.14 0.55 118.68 116.49 1r3e s LEU 309 Ca 0.00 -0.37 -0.14 0.00 -1.03 0.00 0.00 54.13 52.59 1r3e s LEU 309 Cb 0.00 -1.53 -0.05 0.00 0.03 0.00 0.00 46.19 44.64 1r3e s LEU 309 CO 0.00 0.21 0.31 -0.89 0.23 0.00 0.00 176.35 176.21 1r3e s THR 310 N 0.10 5.29 0.16 5.49 2.01 0.30 -2.57 115.64 126.41 1r3e s THR 310 Ca -0.08 0.60 -0.32 0.00 0.31 0.00 0.00 61.69 62.20 1r3e s THR 310 Cb -0.15 -3.65 -0.12 0.00 0.01 0.00 0.00 72.50 68.58 1r3e s THR 310 CO 0.05 0.39 1.72 0.18 -0.69 0.00 0.00 174.62 176.27 1r3e n LEU 311 N 3.54 3.75 -0.06 4.42 4.32 -1.26 0.90 117.00 132.59 1r3e n LEU 311 Ca -0.11 1.04 -0.13 0.00 -0.02 0.00 0.00 56.01 56.79 1r3e n LEU 311 Cb 0.52 -1.52 -0.05 0.00 -1.62 0.00 0.00 43.42 40.75 1r3e n LEU 311 CO 0.40 0.05 -0.94 -1.14 -1.22 0.00 0.00 177.39 174.54 1r3e n ARG 312 N 4.35 0.28 -3.71 3.23 0.63 -0.21 -4.82 116.66 116.41 1r3e n ARG 312 Ca 0.17 0.11 -0.11 0.00 -0.92 0.00 0.00 57.85 57.10 1r3e n ARG 312 Cb 0.34 -1.02 -0.11 0.00 0.45 0.00 0.00 32.46 32.12 1r3e n ARG 312 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1r3e s LYS 313 N -2.24 0.40 -0.08 -0.14 1.02 -0.92 -4.99 119.74 112.79 1r3e s LYS 313 Ca -0.18 0.73 0.01 0.00 0.02 0.00 0.00 55.97 56.55 1r3e s LYS 313 Cb 0.06 0.02 -0.03 0.00 -0.52 0.00 0.00 37.83 37.37 1r3e s LYS 313 CO 0.24 -0.14 -0.10 0.08 -0.92 0.00 0.00 175.35 174.51 1r3e s VAL 314 N 1.16 3.37 -1.10 3.17 1.01 -1.26 -1.00 120.40 125.75 1r3e s VAL 314 Ca -0.08 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.28 1r3e s VAL 314 Cb -0.07 -2.37 0.28 0.00 0.00 0.00 0.00 36.38 34.22 1r3e s VAL 314 CO -0.10 0.58 1.78 0.49 0.00 0.00 0.00 175.10 177.85 1r3e n PHE 315 N 2.55 2.57 -0.78 5.22 3.72 -0.34 -4.99 117.46 125.41 1r3e n PHE 315 Ca -0.18 -2.61 -0.31 0.00 -0.05 0.00 0.00 57.45 54.31 1r3e n PHE 315 Cb 0.53 -1.35 0.17 0.00 -0.94 0.00 0.00 39.48 37.88 1r3e n PHE 315 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1r3e s ASN 316 N -1.12 2.85 0.00 4.37 -0.87 -1.26 -4.47 114.94 114.44 1r3e s ASN 316 Ca 0.38 2.00 0.00 0.00 -1.57 0.00 0.00 52.86 53.67 1r3e s ASN 316 Cb 0.13 -2.50 0.00 0.00 -0.02 0.00 0.00 41.25 38.86 1r3e s ASN 316 CO -0.03 -3.11 0.00 1.07 -2.57 0.00 0.00 177.10 172.46 1r3e n THR 317 N -4.23 -0.73 -1.12 1.60 5.66 -1.26 -5.11 114.28 109.08 1r3e n THR 317 Ca 0.10 0.07 0.00 0.00 -3.05 0.00 0.00 64.05 61.17 1r3e n THR 317 Cb 0.53 -1.54 0.00 0.00 -1.55 0.00 0.00 70.33 67.77 1r3e n THR 317 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91