#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 1.10 0.13 1.45 1.02 -1.26 -1.69 119.74 120.49 1xso s LYS 3 Ca 0.00 -0.96 -0.02 0.00 0.02 0.00 0.00 55.97 55.01 1xso s LYS 3 Cb 0.00 -1.22 -0.04 0.00 -0.52 0.00 0.00 37.83 36.06 1xso s LYS 3 CO 0.00 0.30 0.08 0.00 -0.92 0.00 0.00 175.35 174.80 1xso s ALA 4 N -0.99 0.70 0.07 5.17 0.00 -0.24 -1.70 121.76 124.77 1xso s ALA 4 Ca 0.04 -1.36 -0.14 0.00 0.00 0.00 0.00 51.96 50.51 1xso s ALA 4 Cb -0.09 0.80 0.02 0.00 0.00 0.00 0.00 23.12 23.85 1xso s ALA 4 CO 0.02 -0.50 0.32 0.54 0.00 0.00 0.00 175.76 176.15 1xso s VAL 5 N -4.02 0.09 -0.04 0.00 0.11 0.12 -1.18 120.40 115.48 1xso s VAL 5 Ca 0.21 -0.72 -0.04 0.00 -2.93 0.00 0.00 61.98 58.50 1xso s VAL 5 Cb 0.07 -1.07 0.01 0.00 -1.53 0.00 0.00 36.38 33.86 1xso s VAL 5 CO 0.00 -0.40 0.11 0.00 -3.33 0.00 0.00 175.10 171.48 1xso s VAL 7 N -0.02 4.32 -0.09 0.00 1.01 -1.26 -1.63 120.40 122.73 1xso s VAL 7 Ca -0.01 -0.17 -0.16 0.00 0.00 0.00 0.00 61.98 61.64 1xso s VAL 7 Cb -0.01 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.30 1xso s VAL 7 CO 0.00 0.34 0.42 -0.76 0.00 0.00 0.00 175.10 175.10 1xso s LEU 8 N 1.61 4.34 0.09 3.92 1.43 -0.18 -3.92 118.68 125.97 1xso s LEU 8 Ca 0.06 0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 53.85 1xso s LEU 8 Cb -0.15 -2.60 0.01 0.00 0.03 0.00 0.00 46.19 43.49 1xso s LEU 8 CO 0.04 0.13 0.28 0.00 0.23 0.00 0.00 176.35 177.02 1xso s ALA 9 N 0.03 -0.53 0.00 4.21 0.00 -0.74 -2.02 121.76 122.70 1xso s ALA 9 Ca 0.23 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1xso s ALA 9 Cb -0.15 0.53 0.00 0.00 0.00 0.00 0.00 23.12 23.50 1xso s ALA 9 CO 0.10 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 175.73 1xso n GLY 10 N -0.01 3.45 0.15 0.00 0.00 -1.25 -0.84 105.19 106.69 1xso n GLY 10 Ca -0.16 -0.92 0.13 0.00 0.00 0.00 0.00 46.02 45.07 1xso n GLY 10 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xso h SER 11 N 0.00 0.00 0.00 1.61 4.64 -1.91 -3.45 113.55 114.44 1xso h SER 11 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xso h SER 11 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xso h SER 11 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1xso n GLY 12 N 0.72 4.99 0.86 -0.77 0.00 -1.26 -5.04 105.19 104.68 1xso n GLY 12 Ca 0.04 -1.70 0.12 0.00 0.00 0.00 0.00 46.02 44.48 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 2.63 -4.71 1.61 9.92 -1.26 -4.92 116.55 119.82 1xso n ASP 13 Ca 0.00 -1.86 -0.42 0.00 -0.53 0.00 0.00 54.79 51.98 1xso n ASP 13 Cb 0.00 -0.07 -0.03 0.00 -0.64 0.00 0.00 41.12 40.38 1xso n ASP 13 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1xso s VAL 14 N -1.85 4.54 0.07 2.53 1.01 -1.26 -4.61 120.40 120.83 1xso s VAL 14 Ca 0.33 1.82 -0.13 0.00 0.00 0.00 0.00 61.98 64.01 1xso s VAL 14 Cb 0.21 -4.17 0.02 0.00 0.00 0.00 0.00 36.38 32.43 1xso s VAL 14 CO 0.31 0.11 0.29 -1.59 0.00 0.00 0.00 175.10 174.21 1xso s LYS 15 N 1.30 0.87 0.02 2.72 -2.85 -0.86 -3.81 119.74 117.11 1xso s LYS 15 Ca 0.54 -0.67 -0.22 0.00 -1.00 0.00 0.00 55.97 54.62 1xso s LYS 15 Cb -0.24 0.37 0.07 0.00 -2.06 0.00 0.00 37.83 35.98 1xso s LYS 15 CO 0.26 -0.29 1.00 0.41 0.10 0.00 0.00 175.35 176.83 1xso n GLY 16 N 0.25 0.39 2.83 0.59 0.00 -0.86 -0.98 105.19 107.42 1xso n GLY 16 Ca -0.17 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.07 -0.02 -0.06 1.61 1.01 -0.69 -1.01 120.40 119.17 1xso s VAL 17 Ca 0.23 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.32 1xso s VAL 17 Cb -0.01 -0.04 0.01 0.00 0.00 0.00 0.00 36.38 36.34 1xso s VAL 17 CO 0.01 0.03 -0.13 -0.69 0.00 0.00 0.00 175.10 174.32 1xso s VAL 18 N 0.40 1.16 0.03 2.92 1.01 -0.65 -1.91 120.40 123.37 1xso s VAL 18 Ca -0.03 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.47 1xso s VAL 18 Cb -0.05 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 1xso s VAL 18 CO -0.01 0.36 0.01 -1.00 0.00 0.00 0.00 175.10 174.46 1xso s HIS 19 N 0.59 3.07 -0.02 5.22 3.76 0.89 -1.38 115.29 127.42 1xso s HIS 19 Ca -0.14 0.05 0.04 0.00 -0.15 0.00 0.00 55.06 54.86 1xso s HIS 19 Cb -0.15 -1.63 -0.00 0.00 1.11 0.00 0.00 32.58 31.90 1xso s HIS 19 CO 0.04 0.47 -0.12 -0.06 -0.85 0.00 0.00 174.74 174.22 1xso s PHE 20 N -1.18 1.19 -0.04 1.40 0.40 -0.33 -1.31 117.98 118.11 1xso s PHE 20 Ca 0.22 -0.27 -0.06 0.00 -0.60 0.00 0.00 56.93 56.22 1xso s PHE 20 Cb -0.12 -0.80 0.01 0.00 0.51 0.00 0.00 43.02 42.63 1xso s PHE 20 CO 0.14 -0.07 0.16 -2.00 0.70 0.00 0.00 175.22 174.14 1xso s GLU 21 N -0.09 0.27 -0.04 0.44 2.12 -0.31 -1.08 118.70 120.00 1xso s GLU 21 Ca 0.01 0.06 -0.03 0.00 0.36 0.00 0.00 54.97 55.38 1xso s GLU 21 Cb -0.07 0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.45 1xso s GLU 21 CO 0.00 -0.05 0.09 -1.14 -0.54 0.00 0.00 175.26 173.63 1xso s GLN 22 N -0.29 0.09 -0.07 4.30 0.74 -0.68 -0.88 119.66 122.87 1xso s GLN 22 Ca -0.04 0.16 0.02 0.00 0.05 0.00 0.00 55.36 55.55 1xso s GLN 22 Cb -0.03 0.00 -0.03 0.00 1.10 0.00 0.00 33.01 34.06 1xso s GLN 22 CO 0.01 -0.04 -0.12 -0.65 -0.55 0.00 0.00 175.29 173.93 1xso s GLN 23 N 0.26 2.74 5.16 1.67 -1.52 -1.26 -0.45 119.66 126.26 1xso s GLN 23 Ca -0.02 -0.65 0.00 0.00 -1.95 0.00 0.00 55.36 52.74 1xso s GLN 23 Cb -0.03 -2.49 0.00 0.00 -0.22 0.00 0.00 33.01 30.27 1xso s GLN 23 CO -0.01 0.56 0.00 -0.40 -0.25 0.00 0.00 175.29 175.19 1xso n ASP 24 N 2.52 0.00 -1.62 5.90 5.75 -1.26 -1.97 116.55 125.87 1xso n ASP 24 Ca -0.18 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 54.45 1xso n ASP 24 Cb 0.52 0.00 0.13 0.00 -1.03 0.00 0.00 41.12 40.74 1xso n ASP 24 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1xso n GLU 25 N 14.00 2.49 -0.09 0.11 1.02 -1.26 -4.93 120.64 131.98 1xso n GLU 25 Ca 0.00 -3.50 0.00 0.00 -0.02 0.00 0.00 57.16 53.64 1xso n GLU 25 Cb 0.00 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.39 1xso n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xso n GLY 25 N -0.97 0.20 3.74 0.62 0.00 -0.83 -5.03 105.19 102.92 1xso n GLY 25 Ca 0.42 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.30 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 -3.24 2.29 -0.18 4.61 0.00 -1.26 -4.80 121.76 119.18 1xso s ALA 26 Ca 0.00 0.78 -0.09 0.00 0.00 0.00 0.00 51.96 52.65 1xso s ALA 26 Cb 0.00 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.66 1xso s ALA 26 CO 0.00 -1.57 0.12 0.08 0.00 0.00 0.00 175.76 174.39 1xso s VAL 27 N -2.06 5.28 -0.15 0.00 1.01 0.23 -4.44 120.40 120.27 1xso s VAL 27 Ca 0.72 0.14 -0.18 0.00 0.00 0.00 0.00 61.98 62.66 1xso s VAL 27 Cb -0.26 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1xso s VAL 27 CO 0.42 0.48 0.48 -0.44 0.00 0.00 0.00 175.10 176.04 1xso s SER 28 N 0.11 6.62 -0.17 3.32 0.01 -0.06 -1.32 113.70 122.21 1xso s SER 28 Ca 0.08 0.74 0.01 0.00 1.31 0.00 0.00 55.95 58.09 1xso s SER 28 Cb -0.11 -2.28 0.02 0.00 0.21 0.00 0.00 66.02 63.85 1xso s SER 28 CO -0.01 -0.07 -0.19 -0.69 0.41 0.00 0.00 173.24 172.69 1xso s VAL 29 N 1.04 1.98 -0.06 3.43 1.01 0.21 -1.17 120.40 126.84 1xso s VAL 29 Ca 0.25 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1xso s VAL 29 Cb -0.15 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.46 1xso s VAL 29 CO 0.10 0.53 -0.08 -1.61 0.00 0.00 0.00 175.10 174.03 1xso s GLU 30 N 1.26 1.29 0.20 2.72 2.02 -0.43 -0.49 118.70 125.27 1xso s GLU 30 Ca 0.03 -0.26 -0.10 0.00 0.02 0.00 0.00 54.97 54.67 1xso s GLU 30 Cb -0.13 -1.16 -0.01 0.00 0.10 0.00 0.00 34.13 32.93 1xso s GLU 30 CO -0.11 -0.05 0.34 0.20 0.02 0.00 0.00 175.26 175.66 1xso s GLY 31 N 0.86 0.61 -0.07 -1.39 0.00 -0.45 -0.07 107.32 106.80 1xso s GLY 31 Ca -0.11 -0.97 -0.03 0.00 0.00 0.00 0.00 44.72 43.61 1xso s GLY 31 CO 0.01 -0.82 0.15 1.25 0.00 0.00 0.00 173.10 173.70 1xso s LYS 32 N -4.01 0.06 -0.07 2.90 2.20 -0.80 -1.58 119.74 118.44 1xso s LYS 32 Ca 0.22 0.46 0.02 0.00 -0.36 0.00 0.00 55.97 56.31 1xso s LYS 32 Cb 0.02 -0.23 0.02 0.00 -1.51 0.00 0.00 37.83 36.13 1xso s LYS 32 CO 0.05 -0.23 -0.10 0.42 -0.36 0.00 0.00 175.35 175.12 1xso s ILE 33 N 1.71 1.02 0.07 5.43 1.01 0.08 -1.71 121.20 128.82 1xso s ILE 33 Ca -0.03 -0.39 0.06 0.00 0.00 0.00 0.00 60.65 60.29 1xso s ILE 33 Cb -0.12 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 1xso s ILE 33 CO -0.06 0.34 -0.10 -1.61 0.00 0.00 0.00 174.94 173.50 1xso s GLU 34 N 0.86 2.21 0.00 2.79 2.02 -0.15 -0.67 118.70 125.76 1xso s GLU 34 Ca -0.11 -0.95 0.00 0.00 0.02 0.00 0.00 54.97 53.93 1xso s GLU 34 Cb -0.15 -2.33 0.00 0.00 0.10 0.00 0.00 34.13 31.75 1xso s GLU 34 CO 0.01 0.53 0.00 0.41 0.02 0.00 0.00 175.26 176.24 1xso n GLY 35 N 1.02 0.96 3.84 -1.39 0.00 0.57 -2.04 105.19 108.15 1xso n GLY 35 Ca -0.14 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 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 4.26 0.55 0.99 1.43 -1.00 -4.66 118.68 120.25 1xso s LEU 36 Ca 0.00 1.15 -0.18 0.00 -1.03 0.00 0.00 54.13 54.08 1xso s LEU 36 Cb 0.00 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.61 1xso s LEU 36 CO 0.00 0.00 1.06 0.42 0.23 0.00 0.00 176.35 178.06 1xso s THR 37 N -1.63 3.73 0.40 5.49 -4.23 -1.26 -4.08 115.64 114.07 1xso s THR 37 Ca 0.44 0.93 -0.27 0.00 -1.18 0.00 0.00 61.69 61.60 1xso s THR 37 Cb -0.14 -3.39 -0.10 0.00 1.34 0.00 0.00 72.50 70.21 1xso s THR 37 CO 0.20 -0.38 1.44 0.47 -0.54 0.00 0.00 174.62 175.80 1xso n ASP 38 N -1.61 3.46 0.00 3.99 9.92 -1.26 -4.67 116.55 126.37 1xso n ASP 38 Ca 0.09 1.18 0.00 0.00 -0.53 0.00 0.00 54.79 55.53 1xso n ASP 38 Cb 0.53 -1.60 0.00 0.00 -0.64 0.00 0.00 41.12 39.41 1xso n ASP 38 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1xso n GLY 39 N 0.55 0.44 3.77 0.44 0.00 -0.83 -4.95 105.19 104.61 1xso n GLY 39 Ca 0.03 -2.30 -0.39 0.00 0.00 0.00 0.00 46.02 43.36 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 4.56 -0.04 0.99 1.43 -1.26 -1.16 118.68 123.20 1xso s LEU 40 Ca 0.00 1.57 0.01 0.00 -1.03 0.00 0.00 54.13 54.68 1xso s LEU 40 Cb 0.00 -3.25 0.02 0.00 0.03 0.00 0.00 46.19 43.00 1xso s LEU 40 CO 0.00 0.18 -0.03 -1.00 0.23 0.00 0.00 176.35 175.73 1xso s HIS 41 N -0.92 0.60 0.39 0.29 3.76 -0.41 -2.69 115.29 116.30 1xso s HIS 41 Ca 0.36 -0.13 -0.27 0.00 -0.15 0.00 0.00 55.06 54.86 1xso s HIS 41 Cb -0.22 -0.57 -0.10 0.00 1.11 0.00 0.00 32.58 32.80 1xso s HIS 41 CO 0.25 -0.16 1.36 0.20 -0.85 0.00 0.00 174.74 175.54 1xso s GLY 42 N 0.91 2.95 -0.15 -2.22 0.00 -0.71 -0.57 107.32 107.53 1xso s GLY 42 Ca -0.11 1.35 -0.03 0.00 0.00 0.00 0.00 44.72 45.93 1xso s GLY 42 CO -0.00 1.98 0.03 -0.12 0.00 0.00 0.00 173.10 174.98 1xso s PHE 43 N -1.19 0.85 0.06 1.90 5.36 -0.14 -0.85 117.98 123.96 1xso s PHE 43 Ca 0.55 -0.60 -0.00 0.00 -0.96 0.00 0.00 56.93 55.92 1xso s PHE 43 Cb -0.41 -0.93 -0.04 0.00 -0.34 0.00 0.00 43.02 41.30 1xso s PHE 43 CO 0.54 -0.51 -0.04 -1.01 -1.46 0.00 0.00 175.22 172.74 1xso s HIS 44 N 1.92 0.58 -0.32 10.12 3.76 -0.66 -2.78 115.29 127.91 1xso s HIS 44 Ca 0.01 -0.97 -0.13 0.00 -0.15 0.00 0.00 55.06 53.83 1xso s HIS 44 Cb -0.15 -0.40 -0.03 0.00 1.11 0.00 0.00 32.58 33.11 1xso s HIS 44 CO -0.07 -0.30 0.25 0.42 -0.85 0.00 0.00 174.74 174.18 1xso s ILE 45 N -3.54 5.27 0.29 0.60 -1.09 -0.27 -0.71 121.20 121.75 1xso s ILE 45 Ca 0.05 -0.03 -0.01 0.00 -2.23 0.00 0.00 60.65 58.43 1xso s ILE 45 Cb 0.05 -3.67 -0.04 0.00 -1.58 0.00 0.00 42.46 37.22 1xso s ILE 45 CO -0.08 0.07 0.50 -1.00 -1.23 0.00 0.00 174.94 173.20 1xso s HIS 46 N 1.79 3.49 0.11 3.97 3.76 0.63 -1.64 115.29 127.40 1xso s HIS 46 Ca 0.07 0.42 -0.16 0.00 -0.15 0.00 0.00 55.06 55.25 1xso s HIS 46 Cb -0.17 -1.94 -0.04 0.00 1.11 0.00 0.00 32.58 31.55 1xso s HIS 46 CO 0.11 0.21 1.57 -0.24 -0.85 0.00 0.00 174.74 175.54 1xso h VAL 47 N 1.15 1.25 -2.93 -0.90 3.04 -0.92 -2.75 116.25 114.19 1xso h VAL 47 Ca -0.49 -0.91 -0.62 0.00 -1.01 0.00 0.00 66.70 63.67 1xso h VAL 47 Cb 1.20 1.17 -0.05 0.00 -2.01 0.00 0.00 31.29 31.60 1xso h VAL 47 CO 0.65 0.30 -0.36 -0.36 -1.01 0.00 0.00 177.57 176.79 1xso s PHE 48 N -5.08 3.59 -0.51 3.17 0.08 -0.55 -4.69 117.98 113.99 1xso s PHE 48 Ca -0.13 0.63 -0.02 0.00 0.12 0.00 0.00 56.93 57.53 1xso s PHE 48 Cb 0.09 -2.03 0.25 0.00 -0.57 0.00 0.00 43.02 40.75 1xso s PHE 48 CO 0.77 0.60 2.23 0.41 -0.10 0.00 0.00 175.22 179.14 1xso n GLY 49 N 1.17 4.77 3.17 4.36 0.00 -1.07 -3.52 105.19 114.07 1xso n GLY 49 Ca -0.11 -1.78 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 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 -0.41 5.02 -0.21 1.61 -1.08 -1.26 -4.95 116.67 115.39 1xso s ASP 50 Ca 0.49 -1.44 0.15 0.00 -0.52 0.00 0.00 52.55 51.23 1xso s ASP 50 Cb 0.37 -1.76 0.64 0.00 -1.46 0.00 0.00 42.92 40.71 1xso s ASP 50 CO -0.12 -0.33 1.56 -3.20 0.52 0.00 0.00 175.17 173.59 1xso n ASN 51 N 4.63 4.47 0.16 -0.34 4.05 -1.26 -3.15 115.26 123.82 1xso n ASN 51 Ca -0.10 -3.05 0.02 0.00 0.45 0.00 0.00 54.58 51.90 1xso n ASN 51 Cb 0.43 -0.61 0.36 0.00 1.23 0.00 0.00 39.78 41.19 1xso n ASN 51 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 1xso h THR 52 N 2.50 1.23 -1.70 -0.44 1.35 -1.93 -2.63 112.91 111.29 1xso h THR 52 Ca 0.03 -1.08 -0.63 0.00 -0.55 0.00 0.00 66.41 64.18 1xso h THR 52 Cb 1.70 1.50 -0.38 0.00 -1.73 0.00 0.00 68.15 69.23 1xso h THR 52 CO 0.36 0.32 -0.30 -3.20 -0.25 0.00 0.00 175.52 172.44 1xso n ASN 53 N -4.17 5.35 0.00 5.36 4.05 -1.26 -5.06 115.26 119.53 1xso n ASN 53 Ca -0.02 -3.74 0.00 0.00 0.45 0.00 0.00 54.58 51.27 1xso n ASN 53 Cb 0.35 -0.61 0.00 0.00 1.23 0.00 0.00 39.78 40.75 1xso n ASN 53 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1xso n GLY 54 N -0.47 1.33 0.08 8.20 0.00 -0.99 -2.63 105.19 110.71 1xso n GLY 54 Ca 0.42 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.99 1xso n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xso h MET 56 N 0.00 0.27 0.00 0.00 2.07 -1.84 -2.80 114.93 112.62 1xso h MET 56 Ca 0.00 -0.08 0.00 0.00 -2.07 0.00 0.00 59.70 57.55 1xso h MET 56 Cb 0.61 -0.03 0.00 0.00 -1.87 0.00 0.00 31.60 30.31 1xso h MET 56 CO 0.00 0.46 0.00 -1.13 1.07 0.00 0.00 176.91 177.31 1xso n SER 57 N -4.21 0.00 0.00 1.22 3.41 -1.23 -3.13 113.62 109.68 1xso n SER 57 Ca -0.01 -1.17 0.11 0.00 -0.26 0.00 0.00 58.87 57.55 1xso n SER 57 Cb 0.32 0.00 0.49 0.00 -0.26 0.00 0.00 64.21 64.77 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 -0.89 2.05 -0.23 7.33 0.00 -1.06 -4.46 120.51 123.25 1xso n ALA 58 Ca 0.18 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1xso n ALA 58 Cb 0.08 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.16 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 0.83 -0.91 1.63 0.00 0.00 -1.18 -1.49 105.19 104.07 1xso n GLY 59 Ca 0.06 -1.19 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.66 0.47 -4.77 1.61 3.41 -1.26 -4.68 113.62 107.75 1xso n SER 60 Ca 0.00 -1.43 -0.37 0.00 -0.26 0.00 0.00 58.87 56.81 1xso n SER 60 Cb 0.00 -0.30 -0.01 0.00 -0.26 0.00 0.00 64.21 63.64 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 -1.36 2.84 -0.19 7.33 3.76 -1.26 -0.86 115.29 125.55 1xso s HIS 61 Ca 0.29 1.53 -0.29 0.00 -0.15 0.00 0.00 55.06 56.44 1xso s HIS 61 Cb -0.01 -3.39 -0.03 0.00 1.11 0.00 0.00 32.58 30.26 1xso s HIS 61 CO 0.19 -1.56 1.64 0.12 -0.85 0.00 0.00 174.74 174.29 1xso s PHE 62 N -1.55 2.05 -0.39 1.40 5.36 -0.65 -4.57 117.98 119.63 1xso s PHE 62 Ca 0.64 0.48 0.10 0.00 -0.96 0.00 0.00 56.93 57.20 1xso s PHE 62 Cb -0.29 -3.97 0.32 0.00 -0.34 0.00 0.00 43.02 38.75 1xso s PHE 62 CO 0.35 -3.14 0.72 -1.71 -1.46 0.00 0.00 175.22 169.98 1xso n ASN 63 N 8.32 0.30 0.12 6.13 5.15 -1.26 -2.01 115.26 132.01 1xso n ASN 63 Ca 0.19 -3.01 0.12 0.00 -0.60 0.00 0.00 54.58 51.28 1xso n ASN 63 Cb 0.45 -0.34 0.47 0.00 -0.53 0.00 0.00 39.78 39.83 1xso n ASN 63 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1xso n PRO 64 N 0.58 0.20 -0.25 1.20 -0.04 -1.26 -2.24 135.00 133.20 1xso n PRO 64 Ca 0.22 0.37 0.12 0.00 -0.04 0.00 0.00 63.50 64.17 1xso n PRO 64 Cb 0.63 -1.85 0.26 0.00 -0.04 0.00 0.00 33.50 32.51 1xso n PRO 64 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1xso n GLU 65 N -2.23 2.51 -3.35 0.54 1.02 -1.26 -4.99 120.64 112.89 1xso n GLU 65 Ca 0.03 -2.31 -0.17 0.00 -0.02 0.00 0.00 57.16 54.69 1xso n GLU 65 Cb 0.27 -1.52 0.08 0.00 -0.02 0.00 0.00 31.44 30.25 1xso n GLU 65 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xso n ASN 66 N 1.45 -4.57 -4.67 1.62 3.02 -0.95 -5.02 115.26 106.15 1xso n ASN 66 Ca 0.21 -0.69 -0.30 0.00 -0.03 0.00 0.00 54.58 53.77 1xso n ASN 66 Cb 0.59 -5.08 -0.09 0.00 -0.61 0.00 0.00 39.78 34.58 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 -4.89 2.07 0.72 3.52 -0.14 -1.26 -5.12 119.74 114.64 1xso s LYS 67 Ca 0.26 -2.26 -0.08 0.00 -1.36 0.00 0.00 55.97 52.53 1xso s LYS 67 Cb -0.04 -1.52 0.06 0.00 -1.68 0.00 0.00 37.83 34.65 1xso s LYS 67 CO 0.74 -0.23 1.04 -0.80 -0.76 0.00 0.00 175.35 175.34 1xso s ASN 68 N -3.79 4.86 0.31 2.83 0.02 -1.26 -4.71 114.94 113.20 1xso s ASN 68 Ca 0.19 0.59 -0.29 0.00 -1.02 0.00 0.00 52.86 52.33 1xso s ASN 68 Cb 0.05 -1.24 -0.10 0.00 0.02 0.00 0.00 41.25 39.98 1xso s ASN 68 CO 0.10 -1.60 1.26 -2.28 0.02 0.00 0.00 177.10 174.60 1xso s HIS 69 N -3.30 3.17 0.00 2.20 5.65 -0.36 -2.70 115.29 119.95 1xso s HIS 69 Ca 0.60 1.46 0.00 0.00 0.25 0.00 0.00 55.06 57.37 1xso s HIS 69 Cb -0.11 -3.59 0.00 0.00 -1.18 0.00 0.00 32.58 27.70 1xso s HIS 69 CO 0.46 -1.59 0.00 0.41 -0.65 0.00 0.00 174.74 173.37 1xso n GLY 70 N 1.00 2.89 3.89 1.59 0.00 -1.24 -4.37 105.19 108.95 1xso n GLY 70 Ca 0.00 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.27 3.40 0.42 4.61 0.00 -1.24 -4.72 121.76 122.96 1xso s ALA 71 Ca 0.00 -0.37 0.13 0.00 0.00 0.00 0.00 51.96 51.71 1xso s ALA 71 Cb 0.00 -2.61 0.99 0.00 0.00 0.00 0.00 23.12 21.50 1xso s ALA 71 CO 0.00 -0.13 1.97 -1.35 0.00 0.00 0.00 175.76 176.25 1xso h PRO 72 N 0.85 0.45 -0.00 0.00 0.10 -1.90 -1.42 132.00 130.08 1xso h PRO 72 Ca -0.47 -0.03 0.00 0.00 0.10 0.00 0.00 66.00 65.60 1xso h PRO 72 Cb 1.20 -0.10 0.00 0.00 0.10 0.00 0.00 31.00 32.19 1xso h PRO 72 CO 0.63 0.30 -0.01 0.41 0.10 0.00 0.00 178.00 179.43 1xso n GLY 73 N -1.51 -1.26 3.88 -0.55 0.00 -1.26 -4.91 105.19 99.59 1xso n GLY 73 Ca 0.10 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.56 6.37 0.07 1.61 1.01 -0.54 -5.00 116.67 117.64 1xso s ASP 74 Ca 0.29 1.14 -0.13 0.00 0.71 0.00 0.00 52.55 54.56 1xso s ASP 74 Cb 0.20 -2.33 -0.25 0.00 1.01 0.00 0.00 42.92 41.55 1xso s ASP 74 CO 0.46 -0.57 1.15 0.74 0.21 0.00 0.00 175.17 177.16 1xso h THR 75 N 0.48 1.30 -2.51 -1.27 2.02 -1.91 -3.39 112.91 107.64 1xso h THR 75 Ca -0.46 -2.44 -0.70 0.00 0.77 0.00 0.00 66.41 63.58 1xso h THR 75 Cb 1.19 2.60 -0.18 0.00 -1.74 0.00 0.00 68.15 70.02 1xso h THR 75 CO 0.62 0.74 0.82 -0.62 0.37 0.00 0.00 175.52 177.46 1xso s ASP 76 N -7.34 6.69 0.14 4.18 2.15 -1.26 -4.93 116.67 116.30 1xso s ASP 76 Ca -0.09 -2.21 -0.11 0.00 0.43 0.00 0.00 52.55 50.57 1xso s ASP 76 Cb 0.06 -2.38 0.01 0.00 -0.30 0.00 0.00 42.92 40.31 1xso s ASP 76 CO 0.92 -0.98 0.31 0.00 -0.17 0.00 0.00 175.17 175.25 1xso s ARG 77 N 2.33 1.08 0.44 4.34 1.70 -1.15 -3.71 118.95 123.98 1xso s ARG 77 Ca 0.32 -0.98 -0.20 0.00 -0.47 0.00 0.00 55.73 54.41 1xso s ARG 77 Cb -0.05 0.40 -0.10 0.00 -0.57 0.00 0.00 34.95 34.63 1xso s ARG 77 CO -0.09 -0.40 0.94 -1.01 -1.08 0.00 0.00 175.30 173.66 1xso s HIS 78 N -3.89 3.34 0.29 5.89 3.76 -1.10 -4.61 115.29 118.98 1xso s HIS 78 Ca 0.10 1.54 0.04 0.00 -0.15 0.00 0.00 55.06 56.59 1xso s HIS 78 Cb 0.03 -2.81 0.67 0.00 1.11 0.00 0.00 32.58 31.58 1xso s HIS 78 CO -0.06 -0.15 1.79 0.28 -0.85 0.00 0.00 174.74 175.76 1xso h VAL 79 N 1.71 0.76 0.00 -0.90 2.07 -1.89 -1.40 116.25 116.59 1xso h VAL 79 Ca -0.48 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1xso h VAL 79 Cb 1.18 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1xso h VAL 79 CO 0.61 0.15 0.00 0.61 0.02 0.00 0.00 177.57 178.96 1xso n GLY 80 N -1.33 -0.89 3.47 2.17 0.00 -0.85 -4.39 105.19 103.37 1xso n GLY 80 Ca 0.22 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.54 6.32 -0.06 1.61 1.01 -0.53 -1.11 116.67 122.37 1xso s ASP 81 Ca 0.20 -1.25 0.18 0.00 0.71 0.00 0.00 52.55 52.39 1xso s ASP 81 Cb 0.09 -2.44 0.61 0.00 1.01 0.00 0.00 42.92 42.19 1xso s ASP 81 CO 0.16 -1.39 1.52 0.18 0.21 0.00 0.00 175.17 175.85 1xso n LEU 82 N 7.70 4.15 0.00 1.23 4.77 -1.12 -4.01 117.00 129.72 1xso n LEU 82 Ca 0.08 -2.27 0.00 0.00 -0.03 0.00 0.00 56.01 53.78 1xso n LEU 82 Cb 0.47 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1xso n LEU 82 CO 0.61 0.84 0.00 0.61 -1.33 0.00 0.00 177.39 178.13 1xso n GLY 83 N 1.06 0.09 3.55 -0.72 0.00 -1.23 -4.80 105.19 103.14 1xso n GLY 83 Ca 0.23 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 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 4.31 0.13 1.61 0.01 -1.26 -0.97 114.94 114.78 1xso s ASN 84 Ca 0.00 -0.31 0.05 0.00 -0.71 0.00 0.00 52.86 51.90 1xso s ASN 84 Cb 0.00 -0.86 -0.04 0.00 0.41 0.00 0.00 41.25 40.76 1xso s ASN 84 CO 0.00 0.24 0.05 0.68 -1.51 0.00 0.00 177.10 176.56 1xso s VAL 85 N -1.05 4.16 -0.18 1.60 -7.23 0.26 -4.93 120.40 113.03 1xso s VAL 85 Ca 0.18 -1.10 -0.03 0.00 -1.81 0.00 0.00 61.98 59.21 1xso s VAL 85 Cb -0.11 -3.06 -0.02 0.00 0.56 0.00 0.00 36.38 33.75 1xso s VAL 85 CO 0.09 -0.01 -0.05 -0.89 -0.31 0.00 0.00 175.10 173.93 1xso s THR 86 N -1.57 3.63 -0.13 5.32 2.01 -1.26 -1.29 115.64 122.35 1xso s THR 86 Ca 0.28 -0.43 -0.06 0.00 0.31 0.00 0.00 61.69 61.79 1xso s THR 86 Cb -0.11 -2.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 1xso s THR 86 CO 0.20 0.46 0.09 0.00 -0.69 0.00 0.00 174.62 174.69 1xso s ALA 87 N 0.81 3.64 -0.07 7.40 0.00 -0.31 -4.30 121.76 128.93 1xso s ALA 87 Ca -0.01 -0.70 -0.05 0.00 0.00 0.00 0.00 51.96 51.20 1xso s ALA 87 Cb -0.15 -1.88 0.03 0.00 0.00 0.00 0.00 23.12 21.12 1xso s ALA 87 CO 0.02 0.47 0.16 -2.00 0.00 0.00 0.00 175.76 174.41 1xso s GLU 88 N -0.56 0.15 -1.66 0.00 2.12 -0.46 -1.96 118.70 116.33 1xso s GLU 88 Ca 0.11 0.30 0.00 0.00 0.36 0.00 0.00 54.97 55.75 1xso s GLU 88 Cb -0.12 -0.02 0.00 0.00 0.26 0.00 0.00 34.13 34.25 1xso s GLU 88 CO 0.02 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.07 1xso n GLY 90 N 3.53 -0.40 2.45 -1.50 0.00 -1.26 -2.27 105.19 105.74 1xso n GLY 90 Ca -0.18 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 0.78 3.03 -0.02 0.00 -1.26 -5.00 105.19 101.71 1xso n GLY 91 Ca -0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 1xso n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xso s VAL 92 N -3.08 0.88 -0.24 1.61 1.01 -0.96 -0.31 120.40 119.31 1xso s VAL 92 Ca 0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 1xso s VAL 92 Cb 0.00 -0.78 -0.00 0.00 0.00 0.00 0.00 36.38 35.60 1xso s VAL 92 CO 0.00 0.27 -0.01 0.00 0.00 0.00 0.00 175.10 175.36 1xso s ALA 93 N 0.12 2.88 -0.14 5.51 0.00 0.15 -1.35 121.76 128.92 1xso s ALA 93 Ca -0.02 -1.25 0.02 0.00 0.00 0.00 0.00 51.96 50.71 1xso s ALA 93 Cb -0.08 -1.82 0.01 0.00 0.00 0.00 0.00 23.12 21.23 1xso s ALA 93 CO 0.01 -0.57 -0.20 -0.65 0.00 0.00 0.00 175.76 174.35 1xso s GLN 94 N 1.48 2.87 0.02 0.00 -0.21 -1.26 -0.74 119.66 121.82 1xso s GLN 94 Ca 0.05 -0.80 -0.06 0.00 0.02 0.00 0.00 55.36 54.57 1xso s GLN 94 Cb -0.15 -2.36 -0.01 0.00 1.00 0.00 0.00 33.01 31.49 1xso s GLN 94 CO -0.02 -0.06 0.10 -0.59 -2.12 0.00 0.00 175.29 172.60 1xso s PHE 95 N 0.95 0.14 -0.06 0.91 -0.71 -0.61 -4.95 117.98 113.65 1xso s PHE 95 Ca -0.04 -0.37 -0.01 0.00 -1.04 0.00 0.00 56.93 55.47 1xso s PHE 95 Cb -0.15 -0.11 0.03 0.00 -1.21 0.00 0.00 43.02 41.58 1xso s PHE 95 CO -0.04 -0.33 -0.01 0.21 -1.34 0.00 0.00 175.22 173.71 1xso s LYS 96 N -2.10 0.65 0.11 1.99 2.36 -1.26 -1.34 119.74 120.15 1xso s LYS 96 Ca -0.09 0.06 0.05 0.00 -2.55 0.00 0.00 55.97 53.43 1xso s LYS 96 Cb -0.04 -0.92 -0.04 0.00 -1.05 0.00 0.00 37.83 35.78 1xso s LYS 96 CO -0.02 -0.24 -0.11 0.42 1.55 0.00 0.00 175.35 176.94 1xso s ILE 97 N 1.68 1.11 -0.08 5.43 1.01 0.36 -5.00 121.20 125.72 1xso s ILE 97 Ca 0.01 -1.74 0.04 0.00 0.00 0.00 0.00 60.65 58.95 1xso s ILE 97 Cb -0.13 -1.51 0.00 0.00 0.01 0.00 0.00 42.46 40.84 1xso s ILE 97 CO -0.04 -0.55 -0.19 -0.89 0.00 0.00 0.00 174.94 173.27 1xso s THR 98 N -2.51 1.67 0.00 2.92 2.01 -1.26 -0.62 115.64 117.85 1xso s THR 98 Ca 0.09 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.29 1xso s THR 98 Cb -0.02 -1.45 -0.00 0.00 0.01 0.00 0.00 72.50 71.03 1xso s THR 98 CO 0.01 0.47 -0.02 -0.62 -0.69 0.00 0.00 174.62 173.78 1xso s ASP 99 N 0.36 0.18 0.00 3.53 2.15 -0.43 -4.98 116.67 117.47 1xso s ASP 99 Ca -0.14 -0.07 0.18 0.00 0.43 0.00 0.00 52.55 52.96 1xso s ASP 99 Cb -0.16 -0.01 0.16 0.00 -0.30 0.00 0.00 42.92 42.61 1xso s ASP 99 CO 0.06 -0.01 1.09 -1.20 -0.17 0.00 0.00 175.17 174.94 1xso n SER 100 N 2.91 2.56 -0.11 -0.34 7.64 -1.26 -0.60 113.62 124.43 1xso n SER 100 Ca -0.13 -1.77 -0.22 0.00 1.01 0.00 0.00 58.87 57.75 1xso n SER 100 Cb 0.59 -0.01 -0.12 0.00 -1.01 0.00 0.00 64.21 63.66 1xso n SER 100 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1xso n LEU 101 N 1.04 2.52 -4.72 -3.43 4.77 -1.26 -4.91 117.00 111.01 1xso n LEU 101 Ca 0.11 0.11 -0.32 0.00 -0.03 0.00 0.00 56.01 55.88 1xso n LEU 101 Cb 0.46 -0.92 0.11 0.00 -2.33 0.00 0.00 43.42 40.74 1xso n LEU 101 CO 0.12 0.76 0.72 0.27 -1.33 0.00 0.00 177.39 177.93 1xso s ILE 102 N -2.51 2.59 0.18 -0.08 -4.36 -1.26 -4.90 121.20 110.86 1xso s ILE 102 Ca -0.34 0.23 -0.09 0.00 -0.26 0.00 0.00 60.65 60.19 1xso s ILE 102 Cb 0.10 -2.57 -0.01 0.00 1.25 0.00 0.00 42.46 41.23 1xso s ILE 102 CO 0.59 -0.22 0.30 -0.55 0.24 0.00 0.00 174.94 175.30 1xso s SER 103 N -2.69 0.03 0.00 4.36 0.15 -1.14 -4.60 113.70 109.82 1xso s SER 103 Ca 0.67 -0.92 0.13 0.00 0.70 0.00 0.00 55.95 56.54 1xso s SER 103 Cb -0.23 0.45 0.30 0.00 -1.71 0.00 0.00 66.02 64.84 1xso s SER 103 CO 0.52 -0.92 1.21 0.18 1.20 0.00 0.00 173.24 175.43 1xso n LEU 104 N -0.24 2.86 -3.79 3.45 4.77 -1.26 -1.47 117.00 121.33 1xso n LEU 104 Ca -0.06 -1.71 -0.10 0.00 -0.03 0.00 0.00 56.01 54.11 1xso n LEU 104 Cb 0.63 -0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1xso n LEU 104 CO 0.25 0.67 0.04 -1.59 -1.33 0.00 0.00 177.39 175.43 1xso s LYS 105 N -1.04 1.02 1.16 3.23 -2.85 -1.26 -4.80 119.74 115.20 1xso s LYS 105 Ca 0.25 -0.90 0.00 0.00 -1.00 0.00 0.00 55.97 54.32 1xso s LYS 105 Cb 0.14 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.32 1xso s LYS 105 CO 0.19 -0.37 0.00 0.41 0.10 0.00 0.00 175.35 175.67 1xso n GLY 106 N -0.17 -1.91 0.28 0.59 0.00 -1.26 -3.63 105.19 99.09 1xso n GLY 106 Ca -0.14 -1.36 0.13 0.00 0.00 0.00 0.00 46.02 44.66 1xso n GLY 106 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xso h PRO 107 N 0.00 0.00 -0.64 1.61 0.13 -2.01 -1.29 132.00 129.80 1xso h PRO 107 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1xso h PRO 107 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1xso h PRO 107 CO 0.00 0.06 0.00 0.09 -0.23 0.00 0.00 178.00 177.92 1xso n ASN 108 N -3.78 4.71 -4.75 1.44 4.13 -1.26 -4.96 115.26 110.78 1xso n ASN 108 Ca -0.02 -2.62 -0.41 0.00 1.68 0.00 0.00 54.58 53.21 1xso n ASN 108 Cb 0.16 -0.61 -0.01 0.00 -1.54 0.00 0.00 39.78 37.78 1xso n ASN 108 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1xso s SER 109 N -0.75 6.36 0.00 6.41 0.15 -0.49 -2.89 113.70 122.49 1xso s SER 109 Ca 0.46 2.97 0.22 0.00 0.70 0.00 0.00 55.95 60.30 1xso s SER 109 Cb 0.33 -2.64 0.25 0.00 -1.71 0.00 0.00 66.02 62.25 1xso s SER 109 CO 0.17 -0.92 1.25 2.30 1.20 0.00 0.00 173.24 177.24 1xso n ILE 110 N 2.04 0.18 -1.90 6.45 -5.35 -0.54 -4.93 119.36 115.31 1xso n ILE 110 Ca 0.08 -0.59 -0.42 0.00 -0.27 0.00 0.00 62.75 61.55 1xso n ILE 110 Cb 0.37 1.28 -0.03 0.00 -1.74 0.00 0.00 39.64 39.53 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 -1.68 2.47 0.00 7.28 -1.09 -1.26 -1.95 121.20 124.97 1xso s ILE 111 Ca 0.29 0.36 0.00 0.00 -2.23 0.00 0.00 60.65 59.07 1xso s ILE 111 Cb 0.19 -3.23 0.00 0.00 -1.58 0.00 0.00 42.46 37.84 1xso s ILE 111 CO 0.28 0.04 0.00 0.61 -1.23 0.00 0.00 174.94 174.64 1xso n GLY 112 N 3.26 0.51 3.88 6.18 0.00 0.11 -5.01 105.19 114.12 1xso n GLY 112 Ca 0.12 -0.13 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1xso n GLY 112 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xso s ARG 113 N -0.29 2.28 -0.12 1.61 0.52 -0.82 -2.61 118.95 119.50 1xso s ARG 113 Ca 0.00 -1.97 0.00 0.00 -0.52 0.00 0.00 55.73 53.24 1xso s ARG 113 Cb 0.00 -2.08 -0.01 0.00 0.52 0.00 0.00 34.95 33.37 1xso s ARG 113 CO 0.00 -0.51 -0.14 0.99 0.02 0.00 0.00 175.30 175.65 1xso s THR 114 N -2.73 2.93 0.01 0.02 2.01 -1.04 -1.20 115.64 115.64 1xso s THR 114 Ca 0.35 -0.71 -0.20 0.00 0.31 0.00 0.00 61.69 61.44 1xso s THR 114 Cb -0.01 -2.22 -0.06 0.00 0.01 0.00 0.00 72.50 70.22 1xso s THR 114 CO 0.21 0.53 0.59 0.00 -0.69 0.00 0.00 174.62 175.26 1xso s ALA 115 N 0.33 3.51 -0.03 7.40 0.00 -0.67 -0.27 121.76 132.03 1xso s ALA 115 Ca -0.12 0.03 0.03 0.00 0.00 0.00 0.00 51.96 51.90 1xso s ALA 115 Cb -0.16 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.24 1xso s ALA 115 CO 0.06 0.21 -0.12 0.08 0.00 0.00 0.00 175.76 175.99 1xso s VAL 116 N -0.36 1.02 -0.17 0.00 1.01 0.11 -2.05 120.40 119.95 1xso s VAL 116 Ca 0.30 -0.49 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 1xso s VAL 116 Cb -0.18 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 1xso s VAL 116 CO 0.17 0.31 0.02 0.54 0.00 0.00 0.00 175.10 176.14 1xso s VAL 117 N 0.14 4.42 0.23 2.92 0.11 -0.78 -1.65 120.40 125.79 1xso s VAL 117 Ca -0.03 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 58.85 1xso s VAL 117 Cb -0.10 -2.97 -0.04 0.00 -1.53 0.00 0.00 36.38 31.74 1xso s VAL 117 CO 0.01 0.47 0.41 -1.00 -3.33 0.00 0.00 175.10 171.66 1xso s HIS 118 N 0.39 3.48 0.18 1.54 3.76 -0.03 -1.05 115.29 123.56 1xso s HIS 118 Ca 0.00 0.27 -0.14 0.00 -0.15 0.00 0.00 55.06 55.05 1xso s HIS 118 Cb -0.13 -1.80 0.07 0.00 1.11 0.00 0.00 32.58 31.83 1xso s HIS 118 CO 0.01 0.35 1.84 1.49 -0.85 0.00 0.00 174.74 177.59 1xso h GLU 119 N 1.67 0.73 -5.57 1.40 4.81 -1.11 -3.38 114.58 113.12 1xso h GLU 119 Ca -0.49 -0.05 -0.64 0.00 -0.13 0.00 0.00 59.36 58.06 1xso h GLU 119 Cb 1.20 -0.16 -0.12 0.00 0.63 0.00 0.00 28.75 30.29 1xso h GLU 119 CO 0.66 0.48 -0.57 0.15 -0.73 0.00 0.00 179.01 179.00 1xso s LYS 120 N -6.14 2.04 0.48 1.92 1.02 -0.52 -4.91 119.74 113.62 1xso s LYS 120 Ca -0.13 -2.16 -0.23 0.00 0.02 0.00 0.00 55.97 53.48 1xso s LYS 120 Cb 0.13 -1.65 -0.07 0.00 -0.52 0.00 0.00 37.83 35.72 1xso s LYS 120 CO 0.75 -0.14 1.22 0.00 -0.92 0.00 0.00 175.35 176.26 1xso s ALA 121 N -2.74 2.95 -0.09 5.17 0.00 -1.10 -1.73 121.76 124.22 1xso s ALA 121 Ca 0.28 1.05 -0.28 0.00 0.00 0.00 0.00 51.96 53.02 1xso s ALA 121 Cb 0.07 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 1xso s ALA 121 CO 0.15 -0.84 0.91 0.34 0.00 0.00 0.00 175.76 176.32 1xso s ASP 122 N -1.22 7.17 0.00 0.00 -1.08 -1.26 -4.10 116.67 116.18 1xso s ASP 122 Ca 0.65 1.43 0.25 0.00 -0.52 0.00 0.00 52.55 54.36 1xso s ASP 122 Cb -0.32 -2.51 1.50 0.00 -1.46 0.00 0.00 42.92 40.12 1xso s ASP 122 CO 0.39 -0.34 1.95 -0.90 0.52 0.00 0.00 175.17 176.79 1xso n ASP 123 N 4.61 0.00 -1.53 -0.34 5.68 -0.14 -4.91 116.55 119.92 1xso n ASP 123 Ca 0.06 -1.19 -0.17 0.00 -0.50 0.00 0.00 54.79 52.98 1xso n ASP 123 Cb 0.50 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.42 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 -0.90 -1.43 0.00 -2.12 4.77 -1.26 -1.82 117.00 114.25 1xso n LEU 124 Ca 0.19 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 1xso n LEU 124 Cb 0.09 -2.49 0.00 0.00 -2.33 0.00 0.00 43.42 38.69 1xso n LEU 124 CO 0.14 -0.69 0.00 0.61 -1.33 0.00 0.00 177.39 176.12 1xso n GLY 125 N -0.89 0.69 0.94 -0.72 0.00 -1.26 -3.59 105.19 100.37 1xso n GLY 125 Ca -0.18 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.55 2.77 0.00 1.61 4.76 -0.75 -4.67 118.16 119.33 1xso n LYS 126 Ca 0.00 -2.89 0.13 0.00 -2.87 0.00 0.00 58.31 52.68 1xso n LYS 126 Cb 0.00 -1.85 0.61 0.00 -1.84 0.00 0.00 35.03 31.95 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 -0.60 -1.41 1.69 0.72 0.00 -1.26 -4.94 105.19 99.39 1xso n GLY 127 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 1.31 0.48 3.40 -0.02 0.00 -1.26 -5.01 105.19 104.09 1xso n GLY 128 Ca 0.08 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.84 -0.01 0.30 1.61 2.20 -1.26 -5.05 114.94 109.89 1xso s ASN 129 Ca 0.00 -0.89 -0.00 0.00 -0.94 0.00 0.00 52.86 51.03 1xso s ASN 129 Cb 0.00 0.48 0.47 0.00 -2.00 0.00 0.00 41.25 40.19 1xso s ASN 129 CO 0.00 -0.96 1.87 0.44 -2.94 0.00 0.00 177.10 175.51 1xso h ASP 130 N 2.46 0.74 -0.55 3.54 5.19 -2.01 -2.42 116.42 123.37 1xso h ASP 130 Ca -0.31 -0.11 -0.00 0.00 -0.62 0.00 0.00 57.03 56.00 1xso h ASP 130 Cb 1.24 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 40.53 1xso h ASP 130 CO 0.45 0.69 0.34 -0.08 -3.12 0.00 0.00 179.24 177.52 1xso h GLU 131 N 0.79 0.75 -0.96 3.56 4.57 -2.00 -1.85 114.58 119.43 1xso h GLU 131 Ca 0.18 -0.06 0.11 0.00 -1.18 0.00 0.00 59.36 58.41 1xso h GLU 131 Cb 0.21 -0.16 -0.08 0.00 -0.16 0.00 0.00 28.75 28.56 1xso h GLU 131 CO -0.01 0.53 0.62 1.03 -1.18 0.00 0.00 179.01 179.99 1xso h SER 132 N 0.77 0.89 0.24 1.04 0.87 -1.78 -0.26 113.55 115.32 1xso h SER 132 Ca 0.20 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1xso h SER 132 Cb -0.03 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.78 1xso h SER 132 CO -0.04 0.50 0.00 0.18 -0.53 0.00 0.00 176.83 176.94 1xso n LEU 133 N -4.57 0.00 -0.06 2.23 4.77 -0.70 -2.13 117.00 116.53 1xso n LEU 133 Ca 0.17 0.14 -0.13 0.00 -0.03 0.00 0.00 56.01 56.16 1xso n LEU 133 Cb 0.32 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 41.23 1xso n LEU 133 CO 0.29 -0.02 -0.94 0.29 -1.33 0.00 0.00 177.39 175.69 1xso n LYS 134 N -1.14 0.28 0.00 3.23 4.76 -0.44 -1.23 118.16 123.63 1xso n LYS 134 Ca 0.17 0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.72 1xso n LYS 134 Cb 0.15 -1.03 0.00 0.00 -1.84 0.00 0.00 35.03 32.32 1xso n LYS 134 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1xso n THR 135 N -3.42 0.00 -1.15 -0.18 -2.24 -0.24 -4.69 114.28 102.36 1xso n THR 135 Ca -0.25 -0.24 -0.05 0.00 -2.27 0.00 0.00 64.05 61.24 1xso n THR 135 Cb 0.69 1.13 -0.02 0.00 -2.10 0.00 0.00 70.33 70.03 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 0.37 0.74 2.98 3.38 0.00 -0.91 -3.29 105.19 108.47 1xso n GLY 136 Ca 0.00 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 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 0.11 -5.33 0.00 1.61 3.02 -1.26 -0.97 115.26 112.44 1xso n ASN 137 Ca -0.05 -0.24 0.13 0.00 -0.03 0.00 0.00 54.58 54.39 1xso n ASN 137 Cb 0.27 -4.35 0.63 0.00 -0.61 0.00 0.00 39.78 35.71 1xso n ASN 137 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xso n ALA 138 N -3.26 2.28 -0.42 5.41 0.00 -1.21 -4.77 120.51 118.54 1xso n ALA 138 Ca -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1xso n ALA 138 Cb 0.61 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 0.07 3.59 0.00 0.00 -1.26 -1.44 105.19 107.25 1xso n GLY 139 Ca 0.10 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 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 -1.02 1.61 -0.45 -0.02 0.00 -1.26 -4.67 107.32 101.52 1xso s GLY 140 Ca 0.00 0.20 -0.09 0.00 0.00 0.00 0.00 44.72 44.82 1xso s GLY 140 CO 0.00 0.76 0.31 0.50 0.00 0.00 0.00 173.10 174.67 1xso s ARG 141 N -4.58 2.56 0.11 2.90 0.52 -1.26 -1.08 118.95 118.11 1xso s ARG 141 Ca 0.67 -1.61 -0.09 0.00 -0.52 0.00 0.00 55.73 54.19 1xso s ARG 141 Cb -0.23 -3.87 -0.15 0.00 0.52 0.00 0.00 34.95 31.22 1xso s ARG 141 CO 0.61 -1.08 1.26 -0.07 0.02 0.00 0.00 175.30 176.05 1xso h LEU 142 N 8.45 0.73 -7.21 2.53 3.38 -1.39 -3.47 115.31 118.31 1xso h LEU 142 Ca -0.22 -0.57 -0.05 0.00 0.09 0.00 0.00 57.88 57.13 1xso h LEU 142 Cb 1.08 -0.22 -0.14 0.00 0.09 0.00 0.00 40.66 41.47 1xso h LEU 142 CO 0.82 1.36 0.04 0.00 0.09 0.00 0.00 178.44 180.75 1xso s ALA 143 N -3.35 -1.27 0.20 1.53 0.00 -1.19 -4.15 121.76 113.53 1xso s ALA 143 Ca -0.08 0.36 -0.23 0.00 0.00 0.00 0.00 51.96 52.02 1xso s ALA 143 Cb 0.08 0.61 0.05 0.00 0.00 0.00 0.00 23.12 23.86 1xso s ALA 143 CO 0.89 -0.62 0.66 0.00 0.00 0.00 0.00 175.76 176.70 1xso s GLY 145 N -2.81 -0.56 0.05 0.00 0.00 -0.87 -1.80 107.32 101.34 1xso s GLY 145 Ca 0.05 0.73 -0.26 0.00 0.00 0.00 0.00 44.72 45.24 1xso s GLY 145 CO -0.05 0.40 0.81 0.14 0.00 0.00 0.00 173.10 174.40 1xso s VAL 146 N -2.74 4.71 -0.17 1.40 1.01 -1.26 -1.67 120.40 121.67 1xso s VAL 146 Ca -0.04 1.72 -0.26 0.00 0.00 0.00 0.00 61.98 63.40 1xso s VAL 146 Cb -0.01 -4.16 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1xso s VAL 146 CO -0.04 0.34 0.89 -0.63 0.00 0.00 0.00 175.10 175.66 1xso s ILE 147 N 0.03 4.84 0.27 2.22 1.01 -0.34 -4.56 121.20 124.67 1xso s ILE 147 Ca 0.41 1.74 0.04 0.00 0.00 0.00 0.00 60.65 62.83 1xso s ILE 147 Cb -0.21 -4.18 -0.06 0.00 0.01 0.00 0.00 42.46 38.02 1xso s ILE 147 CO 0.24 -0.01 0.02 -0.83 0.00 0.00 0.00 174.94 174.36 1xso s GLY 148 N 1.17 1.77 0.43 6.18 0.00 -0.56 -0.72 107.32 115.60 1xso s GLY 148 Ca 0.40 -1.89 -0.24 0.00 0.00 0.00 0.00 44.72 42.99 1xso s GLY 148 CO 0.12 -1.73 1.20 -0.19 0.00 0.00 0.00 173.10 172.50 1xso s TYR 149 N -3.36 2.92 0.16 1.90 2.02 -1.26 -0.70 117.35 119.02 1xso s TYR 149 Ca 0.32 1.52 0.07 0.00 -0.37 0.00 0.00 57.07 58.60 1xso s TYR 149 Cb 0.07 -3.45 -0.04 0.00 -0.40 0.00 0.00 41.96 38.13 1xso s TYR 149 CO 0.12 -1.59 -0.14 -1.54 -1.57 0.00 0.00 175.55 170.83 1xso s SER 150 N -1.15 2.26 0.00 2.29 1.04 -0.69 -4.72 113.70 112.73 1xso s SER 150 Ca 0.60 -0.93 0.25 0.00 0.48 0.00 0.00 55.95 56.35 1xso s SER 150 Cb -0.32 -0.09 1.51 0.00 0.10 0.00 0.00 66.02 67.22 1xso s SER 150 CO 0.39 -0.17 1.86 -0.81 0.98 0.00 0.00 173.24 175.49