#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xso s LYS 3 N 0.00 0.99 0.15 1.45 1.02 -1.26 -1.29 119.74 120.80 1xso s LYS 3 Ca 0.00 -0.95 -0.03 0.00 0.02 0.00 0.00 55.97 55.00 1xso s LYS 3 Cb 0.00 -1.08 -0.03 0.00 -0.52 0.00 0.00 37.83 36.20 1xso s LYS 3 CO 0.00 0.26 0.13 0.00 -0.92 0.00 0.00 175.35 174.81 1xso s ALA 4 N -1.08 0.65 0.09 5.17 0.00 -0.27 -1.49 121.76 124.83 1xso s ALA 4 Ca 0.02 -1.34 -0.15 0.00 0.00 0.00 0.00 51.96 50.50 1xso s ALA 4 Cb -0.09 0.92 0.03 0.00 0.00 0.00 0.00 23.12 23.97 1xso s ALA 4 CO 0.02 -0.55 0.34 0.54 0.00 0.00 0.00 175.76 176.12 1xso s VAL 5 N -4.04 0.08 -0.07 0.00 0.11 0.01 -0.75 120.40 115.73 1xso s VAL 5 Ca 0.24 -0.69 -0.12 0.00 -2.93 0.00 0.00 61.98 58.48 1xso s VAL 5 Cb 0.06 -1.11 0.03 0.00 -1.53 0.00 0.00 36.38 33.83 1xso s VAL 5 CO 0.02 -0.38 0.30 0.00 -3.33 0.00 0.00 175.10 171.72 1xso s VAL 7 N -0.45 4.74 -0.12 0.00 1.01 -1.26 -1.65 120.40 122.67 1xso s VAL 7 Ca -0.06 -0.03 -0.15 0.00 0.00 0.00 0.00 61.98 61.74 1xso s VAL 7 Cb -0.04 -3.21 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 1xso s VAL 7 CO 0.02 0.35 0.37 -0.76 0.00 0.00 0.00 175.10 175.08 1xso s LEU 8 N 1.29 4.30 0.07 3.92 1.02 0.65 -4.01 118.68 125.91 1xso s LEU 8 Ca 0.06 0.68 -0.10 0.00 0.02 0.00 0.00 54.13 54.79 1xso s LEU 8 Cb -0.15 -2.51 0.01 0.00 0.02 0.00 0.00 46.19 43.57 1xso s LEU 8 CO 0.05 0.11 0.23 0.00 0.02 0.00 0.00 176.35 176.76 1xso s ALA 9 N 0.22 -0.40 0.00 4.21 0.00 -0.62 -2.26 121.76 122.91 1xso s ALA 9 Ca 0.21 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1xso s ALA 9 Cb -0.14 0.43 0.00 0.00 0.00 0.00 0.00 23.12 23.41 1xso s ALA 9 CO 0.08 -0.47 0.00 0.41 0.00 0.00 0.00 175.76 175.77 1xso n GLY 10 N 0.20 3.84 0.58 0.00 0.00 -1.25 -1.17 105.19 107.38 1xso n GLY 10 Ca -0.17 -1.11 0.13 0.00 0.00 0.00 0.00 46.02 44.87 1xso n GLY 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xso n SER 11 N -0.34 1.77 0.00 1.61 3.41 -1.26 -4.90 113.62 113.92 1xso n SER 11 Ca 0.00 -1.63 0.00 0.00 -0.26 0.00 0.00 58.87 56.98 1xso n SER 11 Cb 0.00 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1xso n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xso n GLY 12 N 1.19 5.10 1.35 5.00 0.00 -1.26 -5.04 105.19 111.54 1xso n GLY 12 Ca 0.18 -1.72 0.10 0.00 0.00 0.00 0.00 46.02 44.57 1xso n GLY 12 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xso n ASP 13 N 0.00 3.97 -4.72 1.61 8.00 -1.26 -4.91 116.55 119.23 1xso n ASP 13 Ca 0.00 -2.19 -0.40 0.00 0.71 0.00 0.00 54.79 52.90 1xso n ASP 13 Cb 0.00 -0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 40.56 1xso n ASP 13 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xso s VAL 14 N -1.44 4.89 0.14 2.53 1.01 -1.26 -4.43 120.40 121.84 1xso s VAL 14 Ca 0.46 1.69 -0.17 0.00 0.00 0.00 0.00 61.98 63.96 1xso s VAL 14 Cb 0.27 -4.15 0.04 0.00 0.00 0.00 0.00 36.38 32.53 1xso s VAL 14 CO 0.27 0.26 0.45 -1.59 0.00 0.00 0.00 175.10 174.48 1xso s LYS 15 N 0.58 1.15 0.00 2.72 -2.85 -0.84 -3.81 119.74 116.69 1xso s LYS 15 Ca 0.42 -0.72 0.00 0.00 -1.00 0.00 0.00 55.97 54.67 1xso s LYS 15 Cb -0.20 0.49 0.00 0.00 -2.06 0.00 0.00 37.83 36.07 1xso s LYS 15 CO 0.23 -0.47 0.00 0.41 0.10 0.00 0.00 175.35 175.62 1xso n GLY 16 N -0.27 -1.32 2.88 0.59 0.00 -0.96 -0.57 105.19 105.55 1xso n GLY 16 Ca -0.15 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 44.78 1xso n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xso s VAL 17 N -2.56 0.13 -0.05 1.61 1.01 -0.86 -0.25 120.40 119.43 1xso s VAL 17 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 61.97 1xso s VAL 17 Cb 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 36.38 36.25 1xso s VAL 17 CO 0.00 0.06 -0.12 -0.69 0.00 0.00 0.00 175.10 174.35 1xso s VAL 18 N 0.18 1.10 -0.07 2.92 1.01 -0.66 -1.89 120.40 122.99 1xso s VAL 18 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.49 1xso s VAL 18 Cb -0.03 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 1xso s VAL 18 CO -0.01 0.34 -0.05 -1.00 0.00 0.00 0.00 175.10 174.39 1xso s HIS 19 N 0.51 3.00 -0.01 5.22 3.76 0.44 -1.37 115.29 126.84 1xso s HIS 19 Ca -0.11 0.07 0.05 0.00 -0.15 0.00 0.00 55.06 54.92 1xso s HIS 19 Cb -0.14 -1.73 -0.01 0.00 1.11 0.00 0.00 32.58 31.80 1xso s HIS 19 CO 0.03 0.37 -0.18 -0.06 -0.85 0.00 0.00 174.74 174.05 1xso s PHE 20 N -0.83 1.58 -0.00 1.40 0.40 0.07 -0.99 117.98 119.60 1xso s PHE 20 Ca 0.13 -0.30 -0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1xso s PHE 20 Cb -0.11 -1.01 -0.00 0.00 0.51 0.00 0.00 43.02 42.41 1xso s PHE 20 CO 0.02 -0.02 0.04 -2.00 0.70 0.00 0.00 175.22 173.96 1xso s GLU 21 N -0.48 0.22 -0.07 0.44 2.12 -0.40 -1.12 118.70 119.42 1xso s GLU 21 Ca 0.07 -0.24 -0.03 0.00 0.36 0.00 0.00 54.97 55.12 1xso s GLU 21 Cb -0.07 0.09 0.04 0.00 0.26 0.00 0.00 34.13 34.45 1xso s GLU 21 CO -0.00 -0.04 0.16 -1.14 -0.54 0.00 0.00 175.26 173.69 1xso s GLN 22 N -0.72 0.11 -0.11 4.30 0.74 -0.41 -1.21 119.66 122.35 1xso s GLN 22 Ca -0.08 0.38 -0.02 0.00 0.05 0.00 0.00 55.36 55.70 1xso s GLN 22 Cb -0.05 -0.16 -0.03 0.00 1.10 0.00 0.00 33.01 33.87 1xso s GLN 22 CO -0.00 -0.16 -0.05 -0.65 -0.55 0.00 0.00 175.29 173.89 1xso s GLN 23 N 1.12 3.20 3.57 1.67 -0.21 -1.26 -1.12 119.66 126.63 1xso s GLN 23 Ca -0.09 -0.52 0.00 0.00 0.02 0.00 0.00 55.36 54.78 1xso s GLN 23 Cb -0.11 -2.76 0.00 0.00 1.00 0.00 0.00 33.01 31.14 1xso s GLN 23 CO -0.06 0.48 0.00 -0.25 -2.12 0.00 0.00 175.29 173.34 1xso n ASP 24 N 2.80 0.00 -2.21 5.90 8.00 -1.26 -1.42 116.55 128.36 1xso n ASP 24 Ca -0.18 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.05 1xso n ASP 24 Cb 0.53 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.66 1xso n ASP 24 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1xso n GLU 25 N 14.00 3.35 -0.70 -1.24 -0.58 -1.26 -4.99 120.64 129.22 1xso n GLU 25 Ca 0.00 -4.00 -0.05 0.00 -0.42 0.00 0.00 57.16 52.69 1xso n GLU 25 Cb 0.00 -2.28 0.03 0.00 -0.57 0.00 0.00 31.44 28.62 1xso n GLU 25 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xso n GLY 25 N -0.71 -0.08 3.75 0.62 0.00 -0.51 -5.02 105.19 103.24 1xso n GLY 25 Ca 0.48 -1.84 -0.38 0.00 0.00 0.00 0.00 46.02 44.27 1xso n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xso s ALA 26 N -3.33 2.83 -0.09 4.61 0.00 -1.26 -4.78 121.76 119.74 1xso s ALA 26 Ca 0.12 1.31 -0.19 0.00 0.00 0.00 0.00 51.96 53.20 1xso s ALA 26 Cb -0.01 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 1xso s ALA 26 CO 0.08 -1.33 0.52 0.08 0.00 0.00 0.00 175.76 175.11 1xso s VAL 27 N -1.32 5.12 -0.09 0.00 1.01 -0.06 -4.60 120.40 120.47 1xso s VAL 27 Ca 0.71 1.05 -0.18 0.00 0.00 0.00 0.00 61.98 63.56 1xso s VAL 27 Cb -0.40 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 1xso s VAL 27 CO 0.47 0.34 0.48 -0.55 0.00 0.00 0.00 175.10 175.84 1xso s SER 28 N 0.44 6.74 -0.15 3.32 0.15 -0.35 -1.34 113.70 122.50 1xso s SER 28 Ca 0.28 0.88 0.01 0.00 0.70 0.00 0.00 55.95 57.82 1xso s SER 28 Cb -0.16 -2.29 0.02 0.00 -1.71 0.00 0.00 66.02 61.88 1xso s SER 28 CO 0.12 0.06 -0.16 -0.69 1.20 0.00 0.00 173.24 173.77 1xso s VAL 29 N 0.26 1.74 -0.07 4.45 1.01 0.57 -1.27 120.40 127.09 1xso s VAL 29 Ca 0.26 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.50 1xso s VAL 29 Cb -0.16 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.64 1xso s VAL 29 CO 0.12 0.49 -0.07 -0.70 0.00 0.00 0.00 175.10 174.94 1xso s GLU 30 N 1.35 1.21 0.24 2.72 2.12 -0.16 -0.65 118.70 125.53 1xso s GLU 30 Ca 0.03 -0.19 -0.10 0.00 0.36 0.00 0.00 54.97 55.07 1xso s GLU 30 Cb -0.13 -1.22 -0.01 0.00 0.26 0.00 0.00 34.13 33.03 1xso s GLU 30 CO -0.10 -0.14 0.41 0.20 -0.54 0.00 0.00 175.26 175.09 1xso s GLY 31 N 1.24 0.74 -0.06 -1.50 0.00 -0.66 -0.42 107.32 106.66 1xso s GLY 31 Ca -0.05 -1.06 -0.02 0.00 0.00 0.00 0.00 44.72 43.59 1xso s GLY 31 CO -0.02 -0.79 0.11 1.25 0.00 0.00 0.00 173.10 173.65 1xso s LYS 32 N -4.03 0.01 -0.08 2.90 2.20 -0.79 -1.47 119.74 118.48 1xso s LYS 32 Ca 0.26 0.39 0.02 0.00 -0.36 0.00 0.00 55.97 56.29 1xso s LYS 32 Cb 0.01 -0.30 0.01 0.00 -1.51 0.00 0.00 37.83 36.04 1xso s LYS 32 CO 0.10 -0.25 -0.15 0.42 -0.36 0.00 0.00 175.35 175.12 1xso s ILE 33 N 1.72 1.36 0.17 5.43 1.01 -0.10 -2.03 121.20 128.75 1xso s ILE 33 Ca -0.02 -0.59 0.07 0.00 0.00 0.00 0.00 60.65 60.11 1xso s ILE 33 Cb -0.12 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 1xso s ILE 33 CO -0.05 0.41 -0.01 -1.61 0.00 0.00 0.00 174.94 173.68 1xso s GLU 34 N 0.75 2.38 0.00 2.79 2.02 0.27 -0.77 118.70 126.13 1xso s GLU 34 Ca -0.12 -1.10 0.00 0.00 0.02 0.00 0.00 54.97 53.77 1xso s GLU 34 Cb -0.16 -2.35 0.00 0.00 0.10 0.00 0.00 34.13 31.72 1xso s GLU 34 CO 0.03 0.46 0.00 0.41 0.02 0.00 0.00 175.26 176.18 1xso n GLY 35 N -0.03 0.71 3.88 -1.39 0.00 -0.45 -1.99 105.19 105.92 1xso n GLY 35 Ca -0.10 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 1xso n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xso s LEU 36 N 0.00 4.18 0.53 0.99 1.43 -0.80 -4.62 118.68 120.39 1xso s LEU 36 Ca 0.00 0.17 -0.20 0.00 -1.03 0.00 0.00 54.13 53.06 1xso s LEU 36 Cb 0.00 -2.80 -0.06 0.00 0.03 0.00 0.00 46.19 43.36 1xso s LEU 36 CO 0.00 0.15 1.15 0.42 0.23 0.00 0.00 176.35 178.31 1xso s THR 37 N -1.51 3.06 0.47 5.49 -4.23 -1.26 -4.02 115.64 113.63 1xso s THR 37 Ca 0.33 0.69 -0.24 0.00 -1.18 0.00 0.00 61.69 61.29 1xso s THR 37 Cb -0.12 -3.29 -0.07 0.00 1.34 0.00 0.00 72.50 70.35 1xso s THR 37 CO 0.26 -0.11 1.34 -1.81 -0.54 0.00 0.00 174.62 173.76 1xso s ASP 38 N -1.64 5.84 0.00 3.99 1.01 -1.26 -4.65 116.67 119.96 1xso s ASP 38 Ca 0.71 2.72 0.00 0.00 0.71 0.00 0.00 52.55 56.70 1xso s ASP 38 Cb -0.26 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.03 1xso s ASP 38 CO 0.30 -1.18 0.00 0.61 0.21 0.00 0.00 175.17 175.11 1xso n GLY 39 N 0.63 -0.38 3.78 0.21 0.00 -0.72 -4.93 105.19 103.78 1xso n GLY 39 Ca 0.07 -2.20 -0.38 0.00 0.00 0.00 0.00 46.02 43.51 1xso n GLY 39 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xso s LEU 40 N 0.00 4.52 -0.03 0.99 1.43 -1.26 -0.75 118.68 123.58 1xso s LEU 40 Ca 0.00 1.70 0.01 0.00 -1.03 0.00 0.00 54.13 54.80 1xso s LEU 40 Cb 0.00 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.71 1xso s LEU 40 CO 0.00 0.12 -0.01 -1.00 0.23 0.00 0.00 176.35 175.69 1xso s HIS 41 N -1.30 0.43 0.48 0.29 3.76 -0.23 -2.92 115.29 115.79 1xso s HIS 41 Ca 0.41 -0.06 -0.24 0.00 -0.15 0.00 0.00 55.06 55.02 1xso s HIS 41 Cb -0.22 -0.46 -0.07 0.00 1.11 0.00 0.00 32.58 32.95 1xso s HIS 41 CO 0.26 -0.13 1.37 0.20 -0.85 0.00 0.00 174.74 175.59 1xso s GLY 42 N 0.89 2.90 -0.17 -2.22 0.00 -0.55 -1.20 107.32 106.97 1xso s GLY 42 Ca -0.10 1.36 -0.03 0.00 0.00 0.00 0.00 44.72 45.95 1xso s GLY 42 CO -0.01 1.93 0.05 -0.12 0.00 0.00 0.00 173.10 174.95 1xso s PHE 43 N -1.26 0.70 0.14 1.90 5.36 -0.01 -0.96 117.98 123.84 1xso s PHE 43 Ca 0.64 -0.57 0.01 0.00 -0.96 0.00 0.00 56.93 56.05 1xso s PHE 43 Cb -0.41 -0.88 -0.04 0.00 -0.34 0.00 0.00 43.02 41.35 1xso s PHE 43 CO 0.51 -0.53 0.01 -1.01 -1.46 0.00 0.00 175.22 172.74 1xso s HIS 44 N 1.97 1.00 -0.34 10.12 3.76 -0.71 -3.07 115.29 128.01 1xso s HIS 44 Ca 0.01 -1.09 -0.10 0.00 -0.15 0.00 0.00 55.06 53.73 1xso s HIS 44 Cb -0.16 -0.58 0.01 0.00 1.11 0.00 0.00 32.58 32.96 1xso s HIS 44 CO -0.08 -0.33 0.17 0.42 -0.85 0.00 0.00 174.74 174.08 1xso s ILE 45 N -3.82 4.56 0.25 0.60 -1.09 -0.38 -0.78 121.20 120.54 1xso s ILE 45 Ca 0.21 -0.63 -0.05 0.00 -2.23 0.00 0.00 60.65 57.95 1xso s ILE 45 Cb 0.07 -3.43 -0.05 0.00 -1.58 0.00 0.00 42.46 37.47 1xso s ILE 45 CO 0.01 -0.07 0.52 -1.00 -1.23 0.00 0.00 174.94 173.17 1xso s HIS 46 N 1.58 3.47 0.11 3.97 3.76 0.50 -1.13 115.29 127.55 1xso s HIS 46 Ca 0.03 0.64 -0.17 0.00 -0.15 0.00 0.00 55.06 55.41 1xso s HIS 46 Cb -0.18 -2.09 -0.04 0.00 1.11 0.00 0.00 32.58 31.38 1xso s HIS 46 CO 0.06 0.24 1.61 -0.24 -0.85 0.00 0.00 174.74 175.56 1xso h VAL 47 N 1.56 1.22 -2.97 -0.90 3.04 -0.85 -2.42 116.25 114.94 1xso h VAL 47 Ca -0.47 -0.73 -0.61 0.00 -1.01 0.00 0.00 66.70 63.88 1xso h VAL 47 Cb 1.18 1.07 -0.04 0.00 -2.01 0.00 0.00 31.29 31.50 1xso h VAL 47 CO 0.68 0.25 -0.44 -0.36 -1.01 0.00 0.00 177.57 176.68 1xso s PHE 48 N -5.31 3.51 -0.65 3.17 0.08 -0.34 -4.64 117.98 113.79 1xso s PHE 48 Ca -0.13 0.33 -0.02 0.00 0.12 0.00 0.00 56.93 57.23 1xso s PHE 48 Cb 0.09 -1.83 0.31 0.00 -0.57 0.00 0.00 43.02 41.03 1xso s PHE 48 CO 0.75 0.54 2.16 0.41 -0.10 0.00 0.00 175.22 178.98 1xso n GLY 49 N 0.19 5.24 3.14 4.36 0.00 -1.08 -3.32 105.19 113.72 1xso n GLY 49 Ca -0.04 -2.13 -0.35 0.00 0.00 0.00 0.00 46.02 43.50 1xso n GLY 49 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xso s ASP 50 N -0.90 4.94 -0.25 1.61 -1.08 -1.26 -4.95 116.67 114.78 1xso s ASP 50 Ca 0.55 -1.52 0.12 0.00 -0.52 0.00 0.00 52.55 51.17 1xso s ASP 50 Cb 0.43 -1.72 0.51 0.00 -1.46 0.00 0.00 42.92 40.67 1xso s ASP 50 CO -0.19 -0.33 1.45 -3.20 0.52 0.00 0.00 175.17 173.41 1xso n ASN 51 N 4.58 2.91 0.16 -0.34 5.15 -1.26 -3.38 115.26 123.07 1xso n ASN 51 Ca -0.09 -3.52 0.02 0.00 -0.60 0.00 0.00 54.58 50.40 1xso n ASN 51 Cb 0.43 -0.60 0.38 0.00 -0.53 0.00 0.00 39.78 39.46 1xso n ASN 51 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 1xso h THR 52 N 1.19 1.22 -1.33 -0.44 1.35 -1.93 -2.45 112.91 110.52 1xso h THR 52 Ca 0.15 -1.02 -0.62 0.00 -0.55 0.00 0.00 66.41 64.37 1xso h THR 52 Cb 1.59 1.47 -0.39 0.00 -1.73 0.00 0.00 68.15 69.09 1xso h THR 52 CO 0.33 0.30 -0.32 -3.20 -0.25 0.00 0.00 175.52 172.38 1xso n ASN 53 N -4.19 5.49 0.00 5.36 5.15 -1.26 -5.05 115.26 120.76 1xso n ASN 53 Ca -0.02 -3.75 0.00 0.00 -0.60 0.00 0.00 54.58 50.21 1xso n ASN 53 Cb 0.34 -0.57 0.00 0.00 -0.53 0.00 0.00 39.78 39.02 1xso n ASN 53 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1xso n GLY 54 N -0.59 1.85 0.12 8.20 0.00 -0.92 -2.26 105.19 111.58 1xso n GLY 54 Ca 0.45 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 46.08 1xso n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xso n MET 56 N -2.22 0.12 -0.06 0.00 2.00 -0.96 -2.56 117.12 113.44 1xso n MET 56 Ca 0.03 0.30 0.12 0.00 0.00 0.00 0.00 57.70 58.15 1xso n MET 56 Cb 0.29 -1.70 0.34 0.00 0.00 0.00 0.00 33.22 32.14 1xso n MET 56 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1xso n SER 57 N -1.93 2.20 0.00 7.83 3.41 -1.21 -4.42 113.62 119.50 1xso n SER 57 Ca 0.04 -1.75 0.10 0.00 -0.26 0.00 0.00 58.87 56.99 1xso n SER 57 Cb 0.25 -0.08 0.45 0.00 -0.26 0.00 0.00 64.21 64.58 1xso n SER 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xso n ALA 58 N 0.69 1.97 -0.14 7.33 0.00 -1.06 -4.48 120.51 124.82 1xso n ALA 58 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1xso n ALA 58 Cb 0.44 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1xso n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xso n GLY 59 N 0.62 -1.80 1.20 0.00 0.00 -1.26 -1.20 105.19 102.75 1xso n GLY 59 Ca 0.06 -1.35 -0.08 0.00 0.00 0.00 0.00 46.02 44.65 1xso n GLY 59 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xso n SER 60 N 0.29 0.19 -4.76 1.61 3.41 -1.26 -4.62 113.62 108.47 1xso n SER 60 Ca 0.00 -1.23 -0.39 0.00 -0.26 0.00 0.00 58.87 56.99 1xso n SER 60 Cb 0.00 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 1xso n SER 60 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1xso s HIS 61 N -1.46 2.72 -0.01 7.33 3.76 -1.26 -0.79 115.29 125.57 1xso s HIS 61 Ca 0.22 1.42 -0.30 0.00 -0.15 0.00 0.00 55.06 56.25 1xso s HIS 61 Cb -0.01 -3.66 -0.08 0.00 1.11 0.00 0.00 32.58 29.95 1xso s HIS 61 CO 0.15 -2.18 1.96 0.12 -0.85 0.00 0.00 174.74 173.95 1xso s PHE 62 N -1.31 1.35 -0.39 1.40 5.36 -0.28 -4.58 117.98 119.53 1xso s PHE 62 Ca 0.61 -0.25 0.11 0.00 -0.96 0.00 0.00 56.93 56.44 1xso s PHE 62 Cb -0.37 -4.17 0.36 0.00 -0.34 0.00 0.00 43.02 38.50 1xso s PHE 62 CO 0.47 -5.16 0.88 -1.71 -1.46 0.00 0.00 175.22 168.24 1xso n ASN 63 N 8.08 -0.01 0.32 6.13 5.15 -1.26 -1.72 115.26 131.94 1xso n ASN 63 Ca 0.21 -3.12 0.21 0.00 -0.60 0.00 0.00 54.58 51.28 1xso n ASN 63 Cb 0.42 0.10 1.05 0.00 -0.53 0.00 0.00 39.78 40.81 1xso n ASN 63 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1xso h PRO 64 N 2.95 0.00 -0.02 1.20 0.13 -1.97 -2.20 132.00 132.09 1xso h PRO 64 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1xso h PRO 64 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1xso h PRO 64 CO 0.38 0.01 -0.10 0.39 -0.23 0.00 0.00 178.00 178.45 1xso n GLU 65 N -3.15 1.56 -3.44 0.86 -0.58 -1.26 -4.96 120.64 109.67 1xso n GLU 65 Ca -0.02 -1.04 -0.20 0.00 -0.42 0.00 0.00 57.16 55.48 1xso n GLU 65 Cb 0.14 -1.48 0.07 0.00 -0.57 0.00 0.00 31.44 29.61 1xso n GLU 65 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xso n ASN 66 N 0.19 -5.11 -5.02 1.62 3.02 -0.83 -5.01 115.26 104.11 1xso n ASN 66 Ca 0.16 -0.50 -0.19 0.00 -0.03 0.00 0.00 54.58 54.02 1xso n ASN 66 Cb 0.41 -4.58 0.05 0.00 -0.61 0.00 0.00 39.78 35.05 1xso n ASN 66 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xso s LYS 67 N -5.98 2.39 0.54 3.52 1.02 -1.26 -5.11 119.74 114.87 1xso s LYS 67 Ca 0.42 -1.55 -0.07 0.00 0.02 0.00 0.00 55.97 54.78 1xso s LYS 67 Cb -0.18 -2.66 -0.03 0.00 -0.52 0.00 0.00 37.83 34.44 1xso s LYS 67 CO 0.65 -0.76 0.88 -0.80 -0.92 0.00 0.00 175.35 174.40 1xso s ASN 68 N -4.61 6.14 0.29 2.83 0.02 -1.26 -4.75 114.94 113.60 1xso s ASN 68 Ca 0.61 1.05 -0.29 0.00 -1.02 0.00 0.00 52.86 53.21 1xso s ASN 68 Cb -0.07 -2.23 -0.10 0.00 0.02 0.00 0.00 41.25 38.87 1xso s ASN 68 CO 0.38 -0.76 1.23 -2.28 0.02 0.00 0.00 177.10 175.69 1xso s HIS 69 N -2.93 3.27 0.00 2.20 5.65 -0.34 -2.74 115.29 120.41 1xso s HIS 69 Ca 0.51 1.49 0.00 0.00 0.25 0.00 0.00 55.06 57.31 1xso s HIS 69 Cb -0.11 -3.52 0.00 0.00 -1.18 0.00 0.00 32.58 27.77 1xso s HIS 69 CO 0.48 -1.38 0.00 0.41 -0.65 0.00 0.00 174.74 173.60 1xso n GLY 70 N 1.18 2.63 3.87 1.59 0.00 -1.25 -4.40 105.19 108.81 1xso n GLY 70 Ca 0.00 -1.10 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 1xso n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xso s ALA 71 N -1.21 3.10 0.55 4.61 0.00 -1.21 -4.72 121.76 122.87 1xso s ALA 71 Ca 0.00 -0.10 0.23 0.00 0.00 0.00 0.00 51.96 52.09 1xso s ALA 71 Cb 0.00 -3.08 1.49 0.00 0.00 0.00 0.00 23.12 21.53 1xso s ALA 71 CO 0.00 -0.70 2.14 -1.35 0.00 0.00 0.00 175.76 175.85 1xso h PRO 72 N -0.33 0.00 -0.01 0.00 0.11 -1.90 -1.62 132.00 128.25 1xso h PRO 72 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1xso h PRO 72 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1xso h PRO 72 CO 0.62 0.00 -0.10 0.41 -0.21 0.00 0.00 178.00 178.72 1xso n GLY 73 N -1.48 -0.74 3.85 -0.55 0.00 -1.26 -4.90 105.19 100.11 1xso n GLY 73 Ca -0.00 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 1xso n GLY 73 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xso s ASP 74 N -2.34 6.75 0.23 1.61 1.01 -0.61 -4.99 116.67 118.33 1xso s ASP 74 Ca 0.32 1.26 0.12 0.00 0.71 0.00 0.00 52.55 54.96 1xso s ASP 74 Cb 0.20 -2.36 0.09 0.00 1.01 0.00 0.00 42.92 41.86 1xso s ASP 74 CO 0.45 -0.21 1.45 0.71 0.21 0.00 0.00 175.17 177.77 1xso h THR 75 N 1.92 1.27 -3.05 -1.27 1.35 -1.90 -3.38 112.91 107.85 1xso h THR 75 Ca -0.48 -2.56 -0.74 0.00 -0.55 0.00 0.00 66.41 62.08 1xso h THR 75 Cb 1.17 2.47 -0.22 0.00 -1.73 0.00 0.00 68.15 69.85 1xso h THR 75 CO 0.65 0.68 0.52 -0.62 -0.25 0.00 0.00 175.52 176.50 1xso s ASP 76 N -6.60 6.72 0.10 5.36 2.15 -1.26 -4.96 116.67 118.17 1xso s ASP 76 Ca 0.02 -2.39 -0.09 0.00 0.43 0.00 0.00 52.55 50.52 1xso s ASP 76 Cb 0.10 -2.31 -0.00 0.00 -0.30 0.00 0.00 42.92 40.40 1xso s ASP 76 CO 0.77 -0.82 0.20 0.00 -0.17 0.00 0.00 175.17 175.15 1xso s ARG 77 N 1.46 0.88 0.49 4.34 1.70 -1.17 -3.85 118.95 122.80 1xso s ARG 77 Ca 0.26 -0.98 -0.19 0.00 -0.47 0.00 0.00 55.73 54.36 1xso s ARG 77 Cb -0.07 0.35 -0.09 0.00 -0.57 0.00 0.00 34.95 34.57 1xso s ARG 77 CO -0.09 -0.29 0.99 -1.01 -1.08 0.00 0.00 175.30 173.82 1xso s HIS 78 N -3.87 3.25 0.38 5.89 3.76 -1.11 -4.71 115.29 118.89 1xso s HIS 78 Ca 0.06 1.55 0.11 0.00 -0.15 0.00 0.00 55.06 56.63 1xso s HIS 78 Cb 0.05 -2.90 0.89 0.00 1.11 0.00 0.00 32.58 31.73 1xso s HIS 78 CO -0.10 -0.45 1.91 0.28 -0.85 0.00 0.00 174.74 175.52 1xso h VAL 79 N 1.37 0.86 -0.06 -0.90 2.07 -1.88 -2.04 116.25 115.67 1xso h VAL 79 Ca -0.48 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1xso h VAL 79 Cb 1.19 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1xso h VAL 79 CO 0.60 0.11 0.00 0.61 0.02 0.00 0.00 177.57 178.91 1xso n GLY 80 N -1.47 -0.63 3.47 2.17 0.00 -0.70 -4.41 105.19 103.61 1xso n GLY 80 Ca 0.15 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1xso n GLY 80 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xso s ASP 81 N -0.96 6.55 0.00 1.61 1.01 -0.77 -1.25 116.67 122.86 1xso s ASP 81 Ca 0.04 -1.82 0.19 0.00 0.71 0.00 0.00 52.55 51.68 1xso s ASP 81 Cb 0.02 -2.43 0.53 0.00 1.01 0.00 0.00 42.92 42.05 1xso s ASP 81 CO 0.03 -1.18 1.44 0.18 0.21 0.00 0.00 175.17 175.84 1xso n LEU 82 N 7.07 3.06 0.00 1.23 4.77 -1.18 -3.90 117.00 128.05 1xso n LEU 82 Ca 0.22 -1.47 0.00 0.00 -0.03 0.00 0.00 56.01 54.74 1xso n LEU 82 Cb 0.49 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1xso n LEU 82 CO 0.55 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.95 1xso n GLY 83 N 1.42 1.16 3.46 -0.72 0.00 -1.23 -4.80 105.19 104.47 1xso n GLY 83 Ca 0.19 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 1xso n GLY 83 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xso s ASN 84 N -4.00 3.73 0.14 1.61 0.01 -1.26 -0.83 114.94 114.33 1xso s ASN 84 Ca 0.00 -0.57 0.06 0.00 -0.71 0.00 0.00 52.86 51.64 1xso s ASN 84 Cb 0.00 -0.48 -0.04 0.00 0.41 0.00 0.00 41.25 41.14 1xso s ASN 84 CO 0.00 0.20 0.01 0.68 -1.51 0.00 0.00 177.10 176.48 1xso s VAL 85 N -1.07 3.89 -0.18 1.60 -7.23 -0.34 -4.91 120.40 112.15 1xso s VAL 85 Ca 0.16 -1.23 -0.04 0.00 -1.81 0.00 0.00 61.98 59.07 1xso s VAL 85 Cb -0.10 -2.92 -0.02 0.00 0.56 0.00 0.00 36.38 33.90 1xso s VAL 85 CO 0.08 -0.02 -0.04 -0.89 -0.31 0.00 0.00 175.10 173.92 1xso s THR 86 N -1.55 3.62 -0.12 5.32 2.01 -1.26 -1.07 115.64 122.59 1xso s THR 86 Ca 0.27 -0.43 -0.09 0.00 0.31 0.00 0.00 61.69 61.74 1xso s THR 86 Cb -0.10 -2.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 1xso s THR 86 CO 0.19 0.46 0.19 0.00 -0.69 0.00 0.00 174.62 174.77 1xso s ALA 87 N 0.86 3.79 -0.02 7.40 0.00 0.08 -4.35 121.76 129.51 1xso s ALA 87 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1xso s ALA 87 Cb -0.15 -2.11 0.02 0.00 0.00 0.00 0.00 23.12 20.89 1xso s ALA 87 CO 0.01 0.47 0.00 -1.21 0.00 0.00 0.00 175.76 175.04 1xso s GLU 88 N -0.66 0.22 -1.51 0.00 2.02 -0.18 -1.75 118.70 116.84 1xso s GLU 88 Ca 0.15 0.07 -0.01 0.00 0.02 0.00 0.00 54.97 55.21 1xso s GLU 88 Cb -0.13 -0.39 0.00 0.00 0.10 0.00 0.00 34.13 33.72 1xso s GLU 88 CO 0.04 -0.11 0.09 0.41 0.02 0.00 0.00 175.26 175.71 1xso n GLY 90 N 3.98 -0.50 1.36 -1.39 0.00 -1.26 -1.89 105.19 105.49 1xso n GLY 90 Ca -0.25 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1xso n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xso n GLY 91 N -1.01 1.25 3.19 -0.02 0.00 -1.26 -5.00 105.19 102.34 1xso n GLY 91 Ca -0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 1xso n GLY 91 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xso s VAL 92 N -2.54 1.57 -0.26 1.61 -7.23 -0.79 -1.34 120.40 111.43 1xso s VAL 92 Ca 0.00 -0.83 -0.04 0.00 -1.81 0.00 0.00 61.98 59.29 1xso s VAL 92 Cb 0.00 -1.32 0.01 0.00 0.56 0.00 0.00 36.38 35.63 1xso s VAL 92 CO 0.00 0.45 0.00 0.00 -0.31 0.00 0.00 175.10 175.24 1xso s ALA 93 N -0.30 2.88 -0.14 1.32 0.00 0.05 -1.01 121.76 124.57 1xso s ALA 93 Ca 0.04 -1.38 0.01 0.00 0.00 0.00 0.00 51.96 50.62 1xso s ALA 93 Cb -0.09 -1.88 0.02 0.00 0.00 0.00 0.00 23.12 21.16 1xso s ALA 93 CO 0.00 -0.76 -0.14 -1.14 0.00 0.00 0.00 175.76 173.72 1xso s GLN 94 N 1.44 2.25 0.06 0.00 0.74 -1.26 -0.93 119.66 121.96 1xso s GLN 94 Ca 0.03 -0.55 -0.05 0.00 0.05 0.00 0.00 55.36 54.84 1xso s GLN 94 Cb -0.16 -2.03 -0.02 0.00 1.10 0.00 0.00 33.01 31.90 1xso s GLN 94 CO -0.01 -0.19 0.08 -0.59 -0.55 0.00 0.00 175.29 174.03 1xso s PHE 95 N 1.36 0.29 -0.17 1.67 -0.71 -0.54 -4.97 117.98 114.91 1xso s PHE 95 Ca 0.02 -0.72 -0.04 0.00 -1.04 0.00 0.00 56.93 55.15 1xso s PHE 95 Cb -0.13 -0.20 0.07 0.00 -1.21 0.00 0.00 43.02 41.55 1xso s PHE 95 CO -0.08 -0.42 0.15 0.21 -1.34 0.00 0.00 175.22 173.74 1xso s LYS 96 N -3.40 0.11 0.25 1.99 2.20 -1.26 -1.66 119.74 117.97 1xso s LYS 96 Ca 0.02 0.12 0.05 0.00 -0.36 0.00 0.00 55.97 55.79 1xso s LYS 96 Cb 0.04 -1.37 -0.05 0.00 -1.51 0.00 0.00 37.83 34.94 1xso s LYS 96 CO -0.08 -0.61 -0.02 0.96 -0.36 0.00 0.00 175.35 175.23 1xso s ILE 97 N 2.23 1.26 0.13 5.43 -4.36 0.17 -4.99 121.20 121.08 1xso s ILE 97 Ca 0.04 -2.06 0.09 0.00 -0.26 0.00 0.00 60.65 58.46 1xso s ILE 97 Cb -0.15 -2.38 -0.04 0.00 1.25 0.00 0.00 42.46 41.14 1xso s ILE 97 CO -0.10 -0.32 -0.23 0.42 0.24 0.00 0.00 174.94 174.96 1xso s THR 98 N -3.27 1.97 -0.04 8.37 -4.23 -1.26 -0.31 115.64 116.87 1xso s THR 98 Ca 0.29 -1.72 -0.04 0.00 -1.18 0.00 0.00 61.69 59.03 1xso s THR 98 Cb 0.05 -1.80 0.01 0.00 1.34 0.00 0.00 72.50 72.10 1xso s THR 98 CO 0.10 -0.06 0.10 -0.62 -0.54 0.00 0.00 174.62 173.60 1xso s ASP 99 N -2.16 -0.09 0.00 3.99 2.15 -0.45 -4.97 116.67 115.14 1xso s ASP 99 Ca 0.12 0.17 0.21 0.00 0.43 0.00 0.00 52.55 53.48 1xso s ASP 99 Cb -0.09 0.21 0.08 0.00 -0.30 0.00 0.00 42.92 42.82 1xso s ASP 99 CO 0.06 -0.06 1.11 -1.54 -0.17 0.00 0.00 175.17 174.56 1xso n SER 100 N 2.89 2.37 -0.13 -0.34 3.41 -1.26 -0.88 113.62 119.69 1xso n SER 100 Ca -0.13 -1.69 -0.22 0.00 -0.26 0.00 0.00 58.87 56.57 1xso n SER 100 Cb 0.59 0.25 -0.11 0.00 -0.26 0.00 0.00 64.21 64.68 1xso n SER 100 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xso n LEU 101 N 0.58 2.53 -4.70 1.04 4.77 -1.26 -4.91 117.00 115.05 1xso n LEU 101 Ca 0.11 0.05 -0.30 0.00 -0.03 0.00 0.00 56.01 55.83 1xso n LEU 101 Cb 0.49 -0.83 0.14 0.00 -2.33 0.00 0.00 43.42 40.89 1xso n LEU 101 CO 0.20 0.77 0.67 0.27 -1.33 0.00 0.00 177.39 177.97 1xso s ILE 102 N -2.49 2.68 0.16 -0.08 -4.36 -1.26 -4.89 121.20 110.96 1xso s ILE 102 Ca -0.35 0.22 -0.10 0.00 -0.26 0.00 0.00 60.65 60.16 1xso s ILE 102 Cb 0.11 -2.57 -0.00 0.00 1.25 0.00 0.00 42.46 41.25 1xso s ILE 102 CO 0.53 -0.29 0.31 -0.94 0.24 0.00 0.00 174.94 174.79 1xso s SER 103 N -3.17 0.00 0.00 4.36 1.04 -1.11 -4.62 113.70 110.21 1xso s SER 103 Ca 0.64 -0.80 0.18 0.00 0.48 0.00 0.00 55.95 56.45 1xso s SER 103 Cb -0.19 0.45 0.42 0.00 0.10 0.00 0.00 66.02 66.80 1xso s SER 103 CO 0.58 -0.90 1.34 0.18 0.98 0.00 0.00 173.24 175.42 1xso n LEU 104 N -0.22 3.30 -3.70 2.42 4.77 -1.26 -1.72 117.00 120.59 1xso n LEU 104 Ca -0.08 -1.77 -0.10 0.00 -0.03 0.00 0.00 56.01 54.03 1xso n LEU 104 Cb 0.63 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 1xso n LEU 104 CO 0.23 0.78 0.09 -1.59 -1.33 0.00 0.00 177.39 175.57 1xso s LYS 105 N -1.12 1.01 1.18 3.23 -2.85 -1.26 -4.82 119.74 115.11 1xso s LYS 105 Ca 0.34 -0.79 0.00 0.00 -1.00 0.00 0.00 55.97 54.53 1xso s LYS 105 Cb 0.19 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.39 1xso s LYS 105 CO 0.25 -0.38 0.00 0.41 0.10 0.00 0.00 175.35 175.74 1xso n GLY 106 N -0.18 -1.91 0.36 0.59 0.00 -1.26 -3.72 105.19 99.07 1xso n GLY 106 Ca -0.16 -1.36 0.07 0.00 0.00 0.00 0.00 46.02 44.57 1xso n GLY 106 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xso h PRO 107 N 0.00 0.83 -0.64 1.61 0.11 -2.01 -1.63 132.00 130.26 1xso h PRO 107 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1xso h PRO 107 Cb 0.00 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 30.92 1xso h PRO 107 CO 0.00 0.55 0.00 0.09 -0.21 0.00 0.00 178.00 178.43 1xso n ASN 108 N -4.52 2.95 -4.74 -2.05 3.02 -1.26 -4.96 115.26 103.70 1xso n ASN 108 Ca 0.14 -2.31 -0.42 0.00 -0.03 0.00 0.00 54.58 51.96 1xso n ASN 108 Cb 0.29 -0.48 -0.02 0.00 -0.61 0.00 0.00 39.78 38.97 1xso n ASN 108 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1xso n SER 109 N 0.43 3.79 -1.15 6.41 2.88 -0.62 -2.75 113.62 122.61 1xso n SER 109 Ca 0.14 1.14 0.12 0.00 -1.33 0.00 0.00 58.87 58.93 1xso n SER 109 Cb 0.59 -1.58 0.22 0.00 -0.75 0.00 0.00 64.21 62.69 1xso n SER 109 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1xso n ILE 110 N 2.34 0.49 -2.06 2.46 -5.35 -0.70 -4.92 119.36 111.61 1xso n ILE 110 Ca 0.10 -0.73 -0.41 0.00 -0.27 0.00 0.00 62.75 61.43 1xso n ILE 110 Cb 0.36 0.98 -0.02 0.00 -1.74 0.00 0.00 39.64 39.22 1xso n ILE 110 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1xso s ILE 111 N -1.51 2.79 0.00 7.28 -1.09 -1.26 -1.91 121.20 125.50 1xso s ILE 111 Ca 0.39 0.66 0.00 0.00 -2.23 0.00 0.00 60.65 59.47 1xso s ILE 111 Cb 0.23 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.68 1xso s ILE 111 CO 0.32 0.11 0.00 0.61 -1.23 0.00 0.00 174.94 174.74 1xso n GLY 112 N 2.20 0.75 2.31 6.18 0.00 -0.04 -5.01 105.19 111.58 1xso n GLY 112 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1xso n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xso n ARG 113 N -2.40 0.93 -5.15 1.61 1.74 -0.80 -2.64 116.66 109.95 1xso n ARG 113 Ca 0.00 -2.02 -0.32 0.00 -0.77 0.00 0.00 57.85 54.74 1xso n ARG 113 Cb 0.00 0.12 -0.17 0.00 -1.02 0.00 0.00 32.46 31.39 1xso n ARG 113 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1xso s THR 114 N -1.51 2.06 -0.01 0.55 2.01 -0.91 -1.34 115.64 116.49 1xso s THR 114 Ca 0.24 -1.01 -0.20 0.00 0.31 0.00 0.00 61.69 61.02 1xso s THR 114 Cb -0.02 -1.78 -0.05 0.00 0.01 0.00 0.00 72.50 70.65 1xso s THR 114 CO 0.15 0.56 0.58 0.00 -0.69 0.00 0.00 174.62 175.22 1xso s ALA 115 N 0.40 3.49 -0.04 7.40 0.00 -0.67 -0.37 121.76 131.98 1xso s ALA 115 Ca -0.17 0.01 0.05 0.00 0.00 0.00 0.00 51.96 51.84 1xso s ALA 115 Cb -0.18 -2.73 -0.01 0.00 0.00 0.00 0.00 23.12 20.21 1xso s ALA 115 CO 0.08 0.16 -0.17 0.08 0.00 0.00 0.00 175.76 175.90 1xso s VAL 116 N -0.15 1.43 -0.18 0.00 1.01 0.04 -1.96 120.40 120.58 1xso s VAL 116 Ca 0.31 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1xso s VAL 116 Cb -0.18 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 1xso s VAL 116 CO 0.17 0.41 -0.02 0.54 0.00 0.00 0.00 175.10 176.20 1xso s VAL 117 N -0.05 3.93 0.21 2.92 0.11 -0.74 -1.75 120.40 125.03 1xso s VAL 117 Ca -0.02 -0.33 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 1xso s VAL 117 Cb -0.11 -2.75 -0.04 0.00 -1.53 0.00 0.00 36.38 31.96 1xso s VAL 117 CO 0.02 0.46 0.38 -1.00 -3.33 0.00 0.00 175.10 171.63 1xso s HIS 118 N 0.64 3.48 0.15 1.54 3.76 -0.14 -1.44 115.29 123.29 1xso s HIS 118 Ca -0.01 0.23 -0.16 0.00 -0.15 0.00 0.00 55.06 54.96 1xso s HIS 118 Cb -0.14 -1.76 0.03 0.00 1.11 0.00 0.00 32.58 31.81 1xso s HIS 118 CO 0.02 0.39 1.79 1.49 -0.85 0.00 0.00 174.74 177.59 1xso h GLU 119 N 1.76 0.41 -5.79 1.40 4.81 -0.99 -3.38 114.58 112.80 1xso h GLU 119 Ca -0.49 -0.02 -0.59 0.00 -0.13 0.00 0.00 59.36 58.13 1xso h GLU 119 Cb 1.20 -0.09 -0.08 0.00 0.63 0.00 0.00 28.75 30.40 1xso h GLU 119 CO 0.66 0.27 -0.46 0.15 -0.73 0.00 0.00 179.01 178.90 1xso s LYS 120 N -6.16 2.22 0.41 1.92 1.02 -0.58 -4.91 119.74 113.66 1xso s LYS 120 Ca -0.13 -1.98 -0.25 0.00 0.02 0.00 0.00 55.97 53.63 1xso s LYS 120 Cb 0.11 -1.93 -0.08 0.00 -0.52 0.00 0.00 37.83 35.40 1xso s LYS 120 CO 0.72 -0.27 1.26 0.00 -0.92 0.00 0.00 175.35 176.14 1xso s ALA 121 N -2.68 3.20 -0.15 5.17 0.00 -1.15 -1.49 121.76 124.66 1xso s ALA 121 Ca 0.34 1.14 -0.27 0.00 0.00 0.00 0.00 51.96 53.17 1xso s ALA 121 Cb 0.02 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 1xso s ALA 121 CO 0.19 -0.75 0.92 0.34 0.00 0.00 0.00 175.76 176.47 1xso s ASP 122 N -0.89 7.09 0.00 0.00 -1.08 -1.26 -3.96 116.67 116.57 1xso s ASP 122 Ca 0.58 1.34 0.24 0.00 -0.52 0.00 0.00 52.55 54.19 1xso s ASP 122 Cb -0.36 -2.50 1.43 0.00 -1.46 0.00 0.00 42.92 40.03 1xso s ASP 122 CO 0.45 -0.45 1.91 -0.90 0.52 0.00 0.00 175.17 176.71 1xso n ASP 123 N 5.25 0.00 -1.71 -0.34 5.68 0.11 -4.90 116.55 120.64 1xso n ASP 123 Ca 0.07 -1.22 -0.17 0.00 -0.50 0.00 0.00 54.79 52.96 1xso n ASP 123 Cb 0.48 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.43 1xso n ASP 123 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1xso n LEU 124 N -0.88 -1.57 0.00 -2.12 4.77 -1.26 -1.85 117.00 114.08 1xso n LEU 124 Ca 0.18 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1xso n LEU 124 Cb 0.08 -2.52 0.00 0.00 -2.33 0.00 0.00 43.42 38.65 1xso n LEU 124 CO 0.13 -0.50 0.00 0.61 -1.33 0.00 0.00 177.39 176.30 1xso n GLY 125 N -0.93 0.76 1.20 -0.72 0.00 -1.25 -3.36 105.19 100.89 1xso n GLY 125 Ca -0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.91 1xso n GLY 125 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xso n LYS 126 N -2.38 3.39 0.11 1.61 4.76 -0.77 -4.64 118.16 120.23 1xso n LYS 126 Ca 0.00 -2.70 0.13 0.00 -2.87 0.00 0.00 58.31 52.87 1xso n LYS 126 Cb 0.00 -1.76 0.43 0.00 -1.84 0.00 0.00 35.03 31.86 1xso n LYS 126 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xso n GLY 127 N 0.52 -1.60 1.36 0.72 0.00 -1.26 -4.95 105.19 99.99 1xso n GLY 127 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1xso n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xso n GLY 128 N 1.00 0.59 3.61 -0.02 0.00 -1.26 -5.01 105.19 104.10 1xso n GLY 128 Ca 0.05 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.24 1xso n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xso s ASN 129 N -2.68 -0.12 0.32 1.61 2.20 -1.26 -5.05 114.94 109.96 1xso s ASN 129 Ca 0.00 -0.85 0.01 0.00 -0.94 0.00 0.00 52.86 51.08 1xso s ASN 129 Cb 0.00 0.60 0.54 0.00 -2.00 0.00 0.00 41.25 40.39 1xso s ASN 129 CO 0.00 -1.15 1.94 0.44 -2.94 0.00 0.00 177.10 175.39 1xso h ASP 130 N 2.23 0.75 0.19 3.54 5.19 -1.99 -1.91 116.42 124.42 1xso h ASP 130 Ca -0.25 -0.06 -0.05 0.00 -0.62 0.00 0.00 57.03 56.05 1xso h ASP 130 Cb 1.25 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 40.56 1xso h ASP 130 CO 0.34 0.61 -0.21 -0.08 -3.12 0.00 0.00 179.24 176.79 1xso h GLU 131 N 0.84 0.03 -0.84 3.56 4.57 -2.00 -1.59 114.58 119.15 1xso h GLU 131 Ca 0.21 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 1xso h GLU 131 Cb 0.04 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.59 1xso h GLU 131 CO -0.03 0.23 0.42 1.03 -1.18 0.00 0.00 179.01 179.48 1xso h SER 132 N 0.03 1.08 0.32 1.04 0.87 -1.69 -0.58 113.55 114.60 1xso h SER 132 Ca 0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1xso h SER 132 Cb 0.38 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1xso h SER 132 CO 0.03 0.89 0.00 0.18 -0.53 0.00 0.00 176.83 177.40 1xso n LEU 133 N -4.32 0.00 -0.06 2.23 4.77 -0.62 -1.69 117.00 117.31 1xso n LEU 133 Ca 0.08 0.21 -0.13 0.00 -0.03 0.00 0.00 56.01 56.14 1xso n LEU 133 Cb 0.12 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 40.96 1xso n LEU 133 CO 0.39 -0.05 -0.86 0.29 -1.33 0.00 0.00 177.39 175.83 1xso n LYS 134 N -1.21 0.31 0.00 3.23 5.02 -0.76 -1.20 118.16 123.54 1xso n LYS 134 Ca 0.13 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 1xso n LYS 134 Cb 0.16 -1.02 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 1xso n LYS 134 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1xso n THR 135 N -3.74 0.00 -1.05 -0.18 -2.24 -0.30 -4.68 114.28 102.10 1xso n THR 135 Ca -0.24 -0.36 -0.02 0.00 -2.27 0.00 0.00 64.05 61.16 1xso n THR 135 Cb 0.61 1.17 -0.01 0.00 -2.10 0.00 0.00 70.33 70.01 1xso n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xso n GLY 136 N 0.28 0.46 2.60 3.38 0.00 -0.68 -3.17 105.19 108.06 1xso n GLY 136 Ca 0.00 -0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 1xso n GLY 136 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xso n ASN 137 N -0.09 -6.03 0.00 1.61 4.13 -1.25 -0.71 115.26 112.92 1xso n ASN 137 Ca -0.02 -0.10 0.14 0.00 1.68 0.00 0.00 54.58 56.28 1xso n ASN 137 Cb 0.19 -4.97 0.69 0.00 -1.54 0.00 0.00 39.78 34.15 1xso n ASN 137 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1xso n ALA 138 N -2.51 2.37 -0.22 5.41 0.00 -1.19 -4.75 120.51 119.62 1xso n ALA 138 Ca -0.21 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1xso n ALA 138 Cb 0.67 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1xso n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xso n GLY 139 N 1.12 -0.47 3.48 0.00 0.00 -1.26 -1.53 105.19 106.53 1xso n GLY 139 Ca 0.12 -1.09 -0.28 0.00 0.00 0.00 0.00 46.02 44.77 1xso n GLY 139 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xso s GLY 140 N -0.64 1.54 -0.39 -0.02 0.00 -1.26 -4.64 107.32 101.91 1xso s GLY 140 Ca 0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 44.72 44.53 1xso s GLY 140 CO 0.00 0.61 0.20 0.50 0.00 0.00 0.00 173.10 174.41 1xso s ARG 141 N -4.43 2.48 0.11 2.90 0.52 -1.26 -0.84 118.95 118.43 1xso s ARG 141 Ca 0.69 -1.46 -0.04 0.00 -0.52 0.00 0.00 55.73 54.39 1xso s ARG 141 Cb -0.25 -3.64 -0.16 0.00 0.52 0.00 0.00 34.95 31.42 1xso s ARG 141 CO 0.65 -0.90 1.25 -0.07 0.02 0.00 0.00 175.30 176.25 1xso h LEU 142 N 8.27 0.50 -7.10 2.53 3.38 -1.56 -3.47 115.31 117.87 1xso h LEU 142 Ca -0.21 -0.44 -0.06 0.00 0.09 0.00 0.00 57.88 57.26 1xso h LEU 142 Cb 1.07 -0.16 -0.17 0.00 0.09 0.00 0.00 40.66 41.50 1xso h LEU 142 CO 0.70 1.27 0.11 0.00 0.09 0.00 0.00 178.44 180.61 1xso s ALA 143 N -3.06 -1.53 0.22 1.53 0.00 -1.21 -4.15 121.76 113.55 1xso s ALA 143 Ca -0.05 0.89 -0.20 0.00 0.00 0.00 0.00 51.96 52.59 1xso s ALA 143 Cb 0.08 0.27 0.04 0.00 0.00 0.00 0.00 23.12 23.51 1xso s ALA 143 CO 0.87 -0.47 0.62 0.00 0.00 0.00 0.00 175.76 176.78 1xso s GLY 145 N -2.85 -0.47 0.07 0.00 0.00 -0.83 -1.58 107.32 101.66 1xso s GLY 145 Ca 0.07 1.36 -0.28 0.00 0.00 0.00 0.00 44.72 45.87 1xso s GLY 145 CO -0.02 0.75 0.89 0.14 0.00 0.00 0.00 173.10 174.86 1xso s VAL 146 N -1.89 4.63 -0.19 1.40 1.01 -1.26 -1.66 120.40 122.43 1xso s VAL 146 Ca -0.04 1.91 -0.24 0.00 0.00 0.00 0.00 61.98 63.61 1xso s VAL 146 Cb -0.00 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 1xso s VAL 146 CO 0.01 0.31 0.80 -0.63 0.00 0.00 0.00 175.10 175.59 1xso s ILE 147 N 0.11 4.89 0.26 2.22 1.01 -0.45 -4.53 121.20 124.70 1xso s ILE 147 Ca 0.44 1.54 0.03 0.00 0.00 0.00 0.00 60.65 62.67 1xso s ILE 147 Cb -0.22 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 1xso s ILE 147 CO 0.27 0.01 0.03 -0.83 0.00 0.00 0.00 174.94 174.42 1xso s GLY 148 N 1.21 1.73 0.48 6.18 0.00 -0.45 -0.86 107.32 115.61 1xso s GLY 148 Ca 0.36 -1.86 -0.23 0.00 0.00 0.00 0.00 44.72 42.98 1xso s GLY 148 CO 0.11 -1.69 1.31 -0.19 0.00 0.00 0.00 173.10 172.63 1xso s TYR 149 N -3.44 2.56 0.08 1.90 2.02 -1.26 -0.81 117.35 118.40 1xso s TYR 149 Ca 0.32 1.41 0.03 0.00 -0.37 0.00 0.00 57.07 58.46 1xso s TYR 149 Cb 0.07 -3.69 -0.03 0.00 -0.40 0.00 0.00 41.96 37.91 1xso s TYR 149 CO 0.11 -2.40 -0.09 0.45 -1.57 0.00 0.00 175.55 172.06 1xso s SER 150 N -0.95 1.24 0.00 2.29 0.15 -0.55 -4.75 113.70 111.13 1xso s SER 150 Ca 0.65 -0.80 0.10 0.00 0.70 0.00 0.00 55.95 56.60 1xso s SER 150 Cb -0.37 0.04 0.58 0.00 -1.71 0.00 0.00 66.02 64.56 1xso s SER 150 CO 0.46 -0.30 1.03 -0.81 1.20 0.00 0.00 173.24 174.82