#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f0b n GLY 4 N 0.00 0.00 0.29 2.58 0.00 -1.26 -3.99 105.19 102.81 1f0b n GLY 4 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1f0b n GLY 4 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1f0b h GLU 5 N 0.00 0.54 -0.20 1.61 4.81 -1.94 -2.83 114.58 116.56 1f0b h GLU 5 Ca 0.00 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1f0b h GLU 5 Cb 0.08 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1f0b h GLU 5 CO 0.00 0.44 -0.04 1.05 -0.73 0.00 0.00 179.01 179.73 1f0b h GLU 6 N 0.54 0.31 0.00 1.92 -0.00 -1.96 -2.21 114.58 113.18 1f0b h GLU 6 Ca 0.14 -0.06 0.00 0.00 -0.00 0.00 0.00 59.36 59.44 1f0b h GLU 6 Cb 0.09 -0.05 0.00 0.00 -0.00 0.00 0.00 28.75 28.79 1f0b h GLU 6 CO -0.02 0.37 0.00 1.28 -0.00 0.00 0.00 179.01 180.64 1f0b n LEU 7 N -4.33 0.04 -0.44 3.06 4.32 -1.07 -3.14 117.00 115.44 1f0b n LEU 7 Ca -0.00 0.51 0.04 0.00 -0.02 0.00 0.00 56.01 56.54 1f0b n LEU 7 Cb 0.22 -0.50 0.09 0.00 -1.62 0.00 0.00 43.42 41.61 1f0b n LEU 7 CO 0.37 -0.26 0.54 0.49 -1.22 0.00 0.00 177.39 177.31 1f0b n PHE 8 N -1.54 0.26 -0.21 -1.77 3.01 -0.83 -4.70 117.46 111.68 1f0b n PHE 8 Ca 0.04 -0.37 0.12 0.00 1.01 0.00 0.00 57.45 58.25 1f0b n PHE 8 Cb 0.18 -0.02 0.42 0.00 -0.01 0.00 0.00 39.48 40.05 1f0b n PHE 8 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1f0b h THR 9 N 1.55 0.86 -3.14 4.37 2.02 -1.58 -3.38 112.91 113.61 1f0b h THR 9 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1f0b h THR 9 Cb 0.59 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1f0b h THR 9 CO 0.00 0.11 0.00 0.61 0.37 0.00 0.00 175.52 176.61 1f0b n GLY 10 N -1.47 7.27 3.66 2.16 0.00 -1.26 -4.85 105.19 110.71 1f0b n GLY 10 Ca 0.15 -2.05 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 1f0b n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f0b s VAL 11 N 0.74 4.37 -0.11 1.61 1.01 -1.26 -4.61 120.40 122.15 1f0b s VAL 11 Ca 0.00 1.65 -0.02 0.00 0.00 0.00 0.00 61.98 63.61 1f0b s VAL 11 Cb 0.00 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 1f0b s VAL 11 CO 0.00 -0.13 -0.02 -0.69 0.00 0.00 0.00 175.10 174.26 1f0b s VAL 12 N 3.33 4.12 0.42 2.92 1.01 0.21 -4.92 120.40 127.49 1f0b s VAL 12 Ca 0.53 -0.30 -0.23 0.00 0.00 0.00 0.00 61.98 61.97 1f0b s VAL 12 Cb -0.21 -2.76 -0.09 0.00 0.00 0.00 0.00 36.38 33.33 1f0b s VAL 12 CO 0.13 0.56 1.05 -2.16 0.00 0.00 0.00 175.10 174.68 1f0b s PRO 13 N -0.39 4.07 -0.04 2.72 0.05 -1.26 0.42 135.00 140.57 1f0b s PRO 13 Ca 0.07 1.47 -0.05 0.00 0.05 0.00 0.00 61.00 62.54 1f0b s PRO 13 Cb -0.12 -2.42 0.01 0.00 0.05 0.00 0.00 34.50 32.01 1f0b s PRO 13 CO 0.02 -0.22 0.12 0.42 0.05 0.00 0.00 177.00 177.40 1f0b s ILE 14 N -1.75 0.02 -0.01 0.56 1.01 -0.94 -0.51 121.20 119.58 1f0b s ILE 14 Ca 0.60 -0.17 0.01 0.00 0.00 0.00 0.00 60.65 61.09 1f0b s ILE 14 Cb -0.20 -0.23 0.01 0.00 0.01 0.00 0.00 42.46 42.04 1f0b s ILE 14 CO 0.25 -0.10 -0.02 -0.22 0.00 0.00 0.00 174.94 174.86 1f0b s LEU 15 N -0.27 1.75 -0.01 2.97 0.20 -0.55 -1.33 118.68 121.45 1f0b s LEU 15 Ca -0.03 -0.05 -0.02 0.00 0.69 0.00 0.00 54.13 54.72 1f0b s LEU 15 Cb -0.03 -0.18 -0.00 0.00 -0.43 0.00 0.00 46.19 45.55 1f0b s LEU 15 CO 0.00 -0.00 0.03 -0.69 -0.29 0.00 0.00 176.35 175.40 1f0b s VAL 16 N 0.26 0.04 -0.07 1.68 1.01 0.11 -2.54 120.40 120.88 1f0b s VAL 16 Ca -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.67 1f0b s VAL 16 Cb -0.05 -0.15 0.02 0.00 0.00 0.00 0.00 36.38 36.20 1f0b s VAL 16 CO -0.01 -0.16 -0.05 -1.61 0.00 0.00 0.00 175.10 173.28 1f0b s GLU 17 N -0.48 1.01 -0.08 2.72 0.41 -0.83 0.83 118.70 122.28 1f0b s GLU 17 Ca -0.05 -0.10 0.03 0.00 -0.41 0.00 0.00 54.97 54.43 1f0b s GLU 17 Cb -0.03 -1.12 0.01 0.00 -1.78 0.00 0.00 34.13 31.21 1f0b s GLU 17 CO -0.00 -0.18 -0.15 -1.17 -0.49 0.00 0.00 175.26 173.26 1f0b s LEU 18 N 1.41 1.75 -0.10 1.80 1.98 0.47 -0.48 118.68 125.52 1f0b s LEU 18 Ca -0.03 -0.38 -0.01 0.00 -2.89 0.00 0.00 54.13 50.82 1f0b s LEU 18 Cb -0.13 -1.01 -0.03 0.00 0.66 0.00 0.00 46.19 45.68 1f0b s LEU 18 CO -0.03 0.06 -0.04 -1.81 -1.89 0.00 0.00 176.35 172.63 1f0b s ASP 19 N 0.66 4.85 0.05 3.68 1.01 -0.13 -0.55 116.67 126.23 1f0b s ASP 19 Ca -0.14 -0.01 -0.02 0.00 0.71 0.00 0.00 52.55 53.09 1f0b s ASP 19 Cb -0.16 -1.44 -0.03 0.00 1.01 0.00 0.00 42.92 42.30 1f0b s ASP 19 CO 0.04 0.31 -0.00 -0.83 0.21 0.00 0.00 175.17 174.89 1f0b s GLY 20 N -0.46 0.38 -0.29 0.21 0.00 0.27 -1.05 107.32 106.37 1f0b s GLY 20 Ca 0.07 -1.00 -0.02 0.00 0.00 0.00 0.00 44.72 43.78 1f0b s GLY 20 CO 0.02 -1.11 0.58 -0.35 0.00 0.00 0.00 173.10 172.24 1f0b s ASP 21 N -2.59 -1.22 -0.31 1.64 -1.08 -1.11 0.34 116.67 112.35 1f0b s ASP 21 Ca 0.02 0.86 0.03 0.00 -0.52 0.00 0.00 52.55 52.94 1f0b s ASP 21 Cb 0.04 2.08 0.09 0.00 -1.46 0.00 0.00 42.92 43.66 1f0b s ASP 21 CO -0.08 -0.26 0.00 -0.69 0.52 0.00 0.00 175.17 174.66 1f0b s VAL 22 N 2.83 2.13 -0.86 1.11 1.01 0.67 0.12 120.40 127.42 1f0b s VAL 22 Ca 0.18 -2.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.12 1f0b s VAL 22 Cb -0.15 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.76 1f0b s VAL 22 CO -0.20 -0.42 0.72 0.59 0.00 0.00 0.00 175.10 175.79 1f0b n ASN 23 N 4.36 -2.28 0.00 3.32 5.03 0.79 -1.82 115.26 124.66 1f0b n ASN 23 Ca -0.02 -0.44 0.00 0.00 0.87 0.00 0.00 54.58 54.99 1f0b n ASN 23 Cb 0.42 -3.79 0.00 0.00 -1.02 0.00 0.00 39.78 35.39 1f0b n ASN 23 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1f0b n GLY 24 N -1.13 0.57 3.43 7.41 0.00 -1.26 -4.95 105.19 109.26 1f0b n GLY 24 Ca -0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.39 1f0b n GLY 24 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1f0b s HIS 25 N -2.67 2.89 -0.19 1.61 5.04 -0.75 -5.04 115.29 116.17 1f0b s HIS 25 Ca 0.00 -0.62 -0.23 0.00 -1.54 0.00 0.00 55.06 52.67 1f0b s HIS 25 Cb 0.00 -3.98 -0.02 0.00 0.04 0.00 0.00 32.58 28.62 1f0b s HIS 25 CO 0.00 -1.34 0.75 0.15 -2.34 0.00 0.00 174.74 171.96 1f0b s LYS 26 N 3.23 4.24 0.11 2.88 1.02 -1.26 -0.23 119.74 129.72 1f0b s LYS 26 Ca 0.18 0.84 -0.10 0.00 0.02 0.00 0.00 55.97 56.91 1f0b s LYS 26 Cb -0.19 -3.59 0.00 0.00 -0.52 0.00 0.00 37.83 33.53 1f0b s LYS 26 CO 0.10 -0.33 0.24 -0.59 -0.92 0.00 0.00 175.35 173.86 1f0b s PHE 27 N 2.17 0.16 0.11 3.18 -0.12 0.15 -4.96 117.98 118.68 1f0b s PHE 27 Ca 0.34 -0.56 0.05 0.00 -0.05 0.00 0.00 56.93 56.70 1f0b s PHE 27 Cb -0.16 -0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.18 1f0b s PHE 27 CO 0.11 -0.60 -0.12 -1.12 -0.05 0.00 0.00 175.22 173.44 1f0b s SER 28 N -2.88 1.74 -0.07 1.98 0.01 -1.26 0.98 113.70 114.20 1f0b s SER 28 Ca 0.07 -0.83 -0.09 0.00 1.31 0.00 0.00 55.95 56.42 1f0b s SER 28 Cb 0.04 -0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.26 1f0b s SER 28 CO -0.09 -0.21 0.23 -0.69 0.41 0.00 0.00 173.24 172.89 1f0b s VAL 29 N -2.38 0.02 -0.00 3.43 1.01 0.29 -2.49 120.40 120.27 1f0b s VAL 29 Ca 0.08 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 61.96 1f0b s VAL 29 Cb -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 1f0b s VAL 29 CO 0.02 -0.08 -0.14 -0.94 0.00 0.00 0.00 175.10 173.96 1f0b s SER 30 N -0.22 1.59 0.03 3.32 1.04 -0.75 -0.40 113.70 118.31 1f0b s SER 30 Ca -0.03 -0.28 0.03 0.00 0.48 0.00 0.00 55.95 56.14 1f0b s SER 30 Cb -0.03 -0.16 -0.02 0.00 0.10 0.00 0.00 66.02 65.91 1f0b s SER 30 CO 0.01 0.14 -0.08 -0.83 0.98 0.00 0.00 173.24 173.46 1f0b s GLY 31 N -0.45 0.49 0.01 7.32 0.00 0.24 -1.31 107.32 113.63 1f0b s GLY 31 Ca 0.05 -0.63 0.01 0.00 0.00 0.00 0.00 44.72 44.15 1f0b s GLY 31 CO -0.00 -0.65 -0.05 -0.54 0.00 0.00 0.00 173.10 171.87 1f0b s GLU 32 N -1.11 0.35 0.00 2.90 2.02 -0.26 0.07 118.70 122.68 1f0b s GLU 32 Ca -0.04 -0.32 0.00 0.00 0.02 0.00 0.00 54.97 54.62 1f0b s GLU 32 Cb -0.07 -0.25 0.00 0.00 0.10 0.00 0.00 34.13 33.90 1f0b s GLU 32 CO 0.00 0.06 0.00 0.41 0.02 0.00 0.00 175.26 175.76 1f0b n GLY 33 N 2.51 1.35 3.08 -1.39 0.00 -0.44 -2.19 105.19 108.11 1f0b n GLY 33 Ca -0.16 -0.63 -0.16 0.00 0.00 0.00 0.00 46.02 45.07 1f0b n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1f0b s GLU 34 N 1.02 0.64 0.06 1.61 2.02 0.52 -2.22 118.70 122.36 1f0b s GLU 34 Ca 0.00 -0.69 0.06 0.00 0.02 0.00 0.00 54.97 54.36 1f0b s GLU 34 Cb 0.00 -0.53 -0.03 0.00 0.10 0.00 0.00 34.13 33.68 1f0b s GLU 34 CO 0.00 0.12 -0.17 0.20 0.02 0.00 0.00 175.26 175.43 1f0b s GLY 35 N -1.27 0.98 -0.43 -1.39 0.00 0.17 -1.09 107.32 104.29 1f0b s GLY 35 Ca -0.04 -1.00 0.04 0.00 0.00 0.00 0.00 44.72 43.72 1f0b s GLY 35 CO 0.01 -0.98 0.43 -0.35 0.00 0.00 0.00 173.10 172.21 1f0b s ASP 36 N -1.40 0.78 0.32 1.64 3.68 0.16 0.64 116.67 122.49 1f0b s ASP 36 Ca 0.04 -2.50 0.10 0.00 2.13 0.00 0.00 52.55 52.32 1f0b s ASP 36 Cb -0.09 0.26 0.95 0.00 -1.45 0.00 0.00 42.92 42.59 1f0b s ASP 36 CO 0.02 -0.16 1.68 0.00 0.13 0.00 0.00 175.17 176.84 1f0b h ALA 37 N 5.77 1.77 -0.79 3.66 0.00 -1.73 0.11 119.26 128.05 1f0b h ALA 37 Ca 0.18 0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.37 1f0b h ALA 37 Cb 0.98 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 1f0b h ALA 37 CO 0.25 -0.45 0.52 1.79 0.00 0.00 0.00 179.25 181.36 1f0b h THR 38 N 0.39 0.92 -0.63 0.00 1.35 -1.84 -1.36 112.91 111.74 1f0b h THR 38 Ca 0.67 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 66.30 1f0b h THR 38 Cb 1.42 0.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 1f0b h THR 38 CO -0.57 0.12 0.00 -1.22 -0.25 0.00 0.00 175.52 173.60 1f0b n TYR 39 N -4.51 1.28 -1.20 4.73 4.01 0.32 -4.92 117.16 116.88 1f0b n TYR 39 Ca 0.14 -0.59 -0.10 0.00 -0.16 0.00 0.00 57.90 57.19 1f0b n TYR 39 Cb 0.36 -0.18 -0.04 0.00 -0.31 0.00 0.00 39.34 39.17 1f0b n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1f0b n GLY 40 N 1.13 0.94 3.70 2.72 0.00 -0.51 -4.73 105.19 108.44 1f0b n GLY 40 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 1f0b n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1f0b s LYS 41 N -2.66 4.27 -0.11 1.61 2.20 -0.96 0.11 119.74 124.20 1f0b s LYS 41 Ca 0.00 0.34 0.02 0.00 -0.36 0.00 0.00 55.97 55.97 1f0b s LYS 41 Cb 0.00 -3.47 0.01 0.00 -1.51 0.00 0.00 37.83 32.86 1f0b s LYS 41 CO 0.00 0.08 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.38 1f0b s LEU 42 N 0.89 1.87 -0.19 5.43 1.43 -0.70 0.37 118.68 127.79 1f0b s LEU 42 Ca 0.23 -0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 52.82 1f0b s LEU 42 Cb -0.15 -1.22 0.05 0.00 0.03 0.00 0.00 46.19 44.91 1f0b s LEU 42 CO 0.09 0.05 -0.00 -0.89 0.23 0.00 0.00 176.35 175.82 1f0b s THR 43 N 0.85 0.86 0.06 5.49 2.01 -0.25 -1.67 115.64 122.99 1f0b s THR 43 Ca -0.08 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.23 1f0b s THR 43 Cb -0.15 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.09 1f0b s THR 43 CO -0.00 -0.10 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.01 1f0b s LEU 44 N 1.71 2.40 -0.04 4.42 2.01 -0.66 0.20 118.68 128.72 1f0b s LEU 44 Ca -0.02 -0.82 -0.01 0.00 0.01 0.00 0.00 54.13 53.30 1f0b s LEU 44 Cb -0.17 -0.03 0.03 0.00 0.01 0.00 0.00 46.19 46.03 1f0b s LEU 44 CO -0.07 -0.40 0.02 -0.75 1.01 0.00 0.00 176.35 176.16 1f0b s LYS 45 N -2.94 0.18 -0.02 1.70 2.20 -0.93 -0.34 119.74 119.60 1f0b s LYS 45 Ca 0.02 0.18 0.05 0.00 -0.36 0.00 0.00 55.97 55.86 1f0b s LYS 45 Cb -0.00 -0.52 -0.03 0.00 -1.51 0.00 0.00 37.83 35.77 1f0b s LYS 45 CO -0.04 -0.22 -0.17 -0.06 -0.36 0.00 0.00 175.35 174.50 1f0b s PHE 46 N 1.48 2.59 -0.02 4.03 0.40 -0.60 -1.10 117.98 124.77 1f0b s PHE 46 Ca -0.03 -0.24 0.02 0.00 -0.60 0.00 0.00 56.93 56.08 1f0b s PHE 46 Cb -0.13 -1.56 0.01 0.00 0.51 0.00 0.00 43.02 41.85 1f0b s PHE 46 CO -0.03 0.16 -0.06 0.42 0.70 0.00 0.00 175.22 176.41 1f0b s ILE 47 N -0.76 0.58 -0.75 0.64 1.01 -0.42 -1.50 121.20 120.00 1f0b s ILE 47 Ca 0.12 -0.24 -0.25 0.00 0.00 0.00 0.00 60.65 60.29 1f0b s ILE 47 Cb -0.10 -0.54 0.05 0.00 0.01 0.00 0.00 42.46 41.87 1f0b s ILE 47 CO 0.01 0.20 1.19 0.00 0.00 0.00 0.00 174.94 176.34 1f0b n THR 49 N 6.24 0.04 -0.03 0.00 -2.24 -1.04 -3.29 114.28 113.97 1f0b n THR 49 Ca 0.04 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1f0b n THR 49 Cb 0.48 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 1f0b n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1f0b n THR 50 N -0.49 0.81 0.00 4.28 -2.24 -1.26 -4.93 114.28 110.46 1f0b n THR 50 Ca 0.06 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1f0b n THR 50 Cb 0.06 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 1f0b n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f0b n GLY 51 N -0.41 0.22 3.77 3.38 0.00 -1.21 -4.98 105.19 105.96 1f0b n GLY 51 Ca 0.00 -1.93 -0.37 0.00 0.00 0.00 0.00 46.02 43.72 1f0b n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f0b s LYS 52 N 0.00 3.92 0.31 1.61 -0.14 -1.26 -4.66 119.74 119.52 1f0b s LYS 52 Ca 0.00 1.76 -0.28 0.00 -1.36 0.00 0.00 55.97 56.10 1f0b s LYS 52 Cb 0.00 -2.52 -0.09 0.00 -1.68 0.00 0.00 37.83 33.54 1f0b s LYS 52 CO 0.00 -0.41 1.04 -1.17 -0.76 0.00 0.00 175.35 174.05 1f0b s LEU 53 N -2.79 4.43 0.18 3.17 2.96 -1.26 -4.93 118.68 120.45 1f0b s LEU 53 Ca 0.60 2.10 0.24 0.00 -0.22 0.00 0.00 54.13 56.85 1f0b s LEU 53 Cb -0.28 -3.83 0.32 0.00 0.50 0.00 0.00 46.19 42.90 1f0b s LEU 53 CO 0.35 -0.18 1.34 -0.65 -1.32 0.00 0.00 176.35 175.89 1f0b h PRO 54 N 3.42 0.00 -5.36 0.98 0.11 -1.95 -3.46 132.00 125.74 1f0b h PRO 54 Ca -0.47 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 64.98 1f0b h PRO 54 Cb 1.21 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.19 1f0b h PRO 54 CO 0.66 0.00 -0.54 0.14 -0.21 0.00 0.00 178.00 178.04 1f0b s VAL 55 N -3.21 1.45 0.18 3.15 -7.23 -1.26 -4.62 120.40 108.86 1f0b s VAL 55 Ca 0.05 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.93 1f0b s VAL 55 Cb 0.11 -2.45 -0.08 0.00 0.56 0.00 0.00 36.38 34.53 1f0b s VAL 55 CO 0.72 0.00 1.22 -2.84 -0.31 0.00 0.00 175.10 173.88 1f0b s PRO 56 N -3.82 4.47 0.26 4.82 0.02 -1.26 -4.94 135.00 134.55 1f0b s PRO 56 Ca 0.16 1.90 -0.01 0.00 0.02 0.00 0.00 61.00 63.06 1f0b s PRO 56 Cb 0.04 -3.24 0.51 0.00 0.02 0.00 0.00 34.50 31.83 1f0b s PRO 56 CO 0.08 -0.13 1.79 -1.49 -0.33 0.00 0.00 177.00 176.92 1f0b h TRP 57 N 5.38 0.87 -0.37 6.54 4.06 -1.96 -2.11 115.95 128.36 1f0b h TRP 57 Ca -0.44 0.03 0.11 0.00 2.06 0.00 0.00 58.89 60.65 1f0b h TRP 57 Cb 1.21 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 29.10 1f0b h TRP 57 CO 0.63 0.28 0.32 -1.35 -3.56 0.00 0.00 178.44 174.75 1f0b h PRO 58 N 0.74 0.00 0.00 0.49 0.11 -1.89 0.44 132.00 131.88 1f0b h PRO 58 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 1f0b h PRO 58 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 1f0b h PRO 58 CO -0.31 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.73 1f0b n THR 59 N -4.06 0.70 0.64 -1.15 -2.24 -0.79 -3.08 114.28 104.30 1f0b n THR 59 Ca 0.06 0.13 0.07 0.00 -2.27 0.00 0.00 64.05 62.04 1f0b n THR 59 Cb 0.49 -0.89 0.02 0.00 -2.10 0.00 0.00 70.33 67.86 1f0b n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1f0b n LEU 60 N -1.77 1.81 -0.13 3.22 4.77 0.14 -4.71 117.00 120.32 1f0b n LEU 60 Ca 0.04 -0.85 -0.05 0.00 -0.03 0.00 0.00 56.01 55.12 1f0b n LEU 60 Cb 0.25 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.37 1f0b n LEU 60 CO 0.20 0.34 0.94 0.58 -1.33 0.00 0.00 177.39 178.11 1f0b h VAL 61 N 2.15 0.85 -0.13 4.08 2.07 -1.51 -1.67 116.25 122.08 1f0b h VAL 61 Ca 0.00 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.34 1f0b h VAL 61 Cb 0.55 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1f0b h VAL 61 CO 0.00 0.05 -0.30 0.71 0.02 0.00 0.00 177.57 178.05 1f0b h THR 62 N 0.28 1.26 -0.25 2.57 1.35 -1.84 -2.77 112.91 113.50 1f0b h THR 62 Ca 0.19 -1.24 -0.18 0.00 -0.55 0.00 0.00 66.41 64.63 1f0b h THR 62 Cb 0.20 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 68.11 1f0b h THR 62 CO -0.22 0.38 -0.56 0.74 -0.25 0.00 0.00 175.52 175.61 1f0b h THR 63 N 0.22 1.29 0.00 6.82 2.02 -1.82 -3.45 112.91 117.99 1f0b h THR 63 Ca 0.03 -1.76 0.00 0.00 0.77 0.00 0.00 66.41 65.45 1f0b h THR 63 Cb 0.65 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.74 1f0b h THR 63 CO 0.05 0.57 0.37 0.49 0.37 0.00 0.00 175.52 177.36 1f0b n PHE 64 N -3.99 0.27 0.00 3.16 0.99 -0.65 -5.11 117.46 112.13 1f0b n PHE 64 Ca -0.04 0.14 0.00 0.00 -0.00 0.00 0.00 57.45 57.55 1f0b n PHE 64 Cb 0.63 -0.46 0.00 0.00 -1.00 0.00 0.00 39.48 38.65 1f0b n PHE 64 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1f0b n LEU 68 N -1.81 0.00 0.09 4.37 4.77 -1.26 -5.06 117.00 118.09 1f0b n LEU 68 Ca -0.01 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 1f0b n LEU 68 Cb 0.38 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.63 1f0b n LEU 68 CO 0.03 0.00 0.65 0.00 -1.33 0.00 0.00 177.39 176.75 1f0b n GLN 69 N 0.00 0.04 0.14 3.23 6.02 -1.26 -0.64 117.38 124.91 1f0b n GLN 69 Ca 0.00 0.41 0.12 0.00 -0.01 0.00 0.00 57.00 57.53 1f0b n GLN 69 Cb 0.00 -1.94 0.49 0.00 1.02 0.00 0.00 30.24 29.82 1f0b n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1f0b n PHE 71 N -2.29 0.28 -1.44 0.00 3.72 0.19 -4.69 117.46 113.24 1f0b n PHE 71 Ca 0.02 -0.14 -0.33 0.00 -0.05 0.00 0.00 57.45 56.96 1f0b n PHE 71 Cb 0.25 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.87 1f0b n PHE 71 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1f0b s ALA 72 N -1.72 2.22 -0.37 4.37 0.00 -0.55 -3.98 121.76 121.73 1f0b s ALA 72 Ca 0.16 0.55 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 1f0b s ALA 72 Cb 0.09 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.88 1f0b s ALA 72 CO 0.12 -1.70 0.21 0.50 0.00 0.00 0.00 175.76 174.88 1f0b s ARG 73 N -4.33 2.88 -0.37 0.00 3.52 -0.08 -4.57 118.95 116.00 1f0b s ARG 73 Ca 0.67 -1.05 -0.21 0.00 -0.13 0.00 0.00 55.73 55.01 1f0b s ARG 73 Cb -0.22 -3.74 0.01 0.00 -1.56 0.00 0.00 34.95 29.44 1f0b s ARG 73 CO 0.48 -0.68 0.66 0.71 -0.81 0.00 0.00 175.30 175.66 1f0b s TYR 74 N 1.57 3.13 0.65 5.12 1.51 -1.26 -2.03 117.35 126.04 1f0b s TYR 74 Ca 0.02 0.34 -0.18 0.00 -1.01 0.00 0.00 57.07 56.25 1f0b s TYR 74 Cb -0.19 -3.21 -0.01 0.00 -0.11 0.00 0.00 41.96 38.44 1f0b s TYR 74 CO 0.07 -0.67 1.24 -2.30 -1.11 0.00 0.00 175.55 172.78 1f0b n PRO 75 N 6.14 1.06 -0.38 -1.71 -0.02 -1.26 -4.72 135.00 134.11 1f0b n PRO 75 Ca -0.01 0.42 -0.04 0.00 -2.02 0.00 0.00 63.50 61.85 1f0b n PRO 75 Cb 0.48 -2.48 -0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1f0b n PRO 75 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1f0b h ASP 76 N 0.49 -1.63 0.01 2.55 1.82 -2.00 0.29 116.42 117.95 1f0b h ASP 76 Ca -0.51 0.31 -0.00 0.00 -0.39 0.00 0.00 57.03 56.45 1f0b h ASP 76 Cb 1.34 0.81 -0.00 0.00 0.68 0.00 0.00 39.33 42.16 1f0b h ASP 76 CO 0.52 -0.28 -0.00 1.12 -1.61 0.00 0.00 179.24 179.00 1f0b h HIS 77 N -0.02 0.00 -0.26 0.28 2.07 -2.02 -2.88 115.15 112.32 1f0b h HIS 77 Ca 0.29 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.81 1f0b h HIS 77 Cb 0.54 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.52 1f0b h HIS 77 CO -0.90 0.00 0.00 -1.33 -3.07 0.00 0.00 177.93 172.63 1f0b n MET 78 N -3.56 2.87 0.18 5.12 2.81 0.97 -4.66 117.12 120.85 1f0b n MET 78 Ca -0.03 -2.76 0.13 0.00 -1.81 0.00 0.00 57.70 53.23 1f0b n MET 78 Cb 0.08 -1.78 0.63 0.00 -0.71 0.00 0.00 33.22 31.44 1f0b n MET 78 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1f0b h LYS 79 N 1.76 0.00 0.00 0.03 1.79 -1.22 -2.84 116.57 116.10 1f0b h LYS 79 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1f0b h LYS 79 Cb 1.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.01 1f0b h LYS 79 CO 0.20 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.57 1f0b h ARG 80 N 0.00 0.00 -0.31 3.15 3.08 -1.86 -2.15 114.38 116.29 1f0b h ARG 80 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1f0b h ARG 80 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1f0b h ARG 80 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.62 1f0b n HIS 81 N -2.86 0.41 -2.80 3.04 8.25 -1.07 -4.50 115.22 115.69 1f0b n HIS 81 Ca 0.01 -0.20 -0.43 0.00 -0.26 0.00 0.00 57.72 56.84 1f0b n HIS 81 Cb 0.29 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.39 1f0b n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1f0b s ASP 82 N -1.38 6.76 0.27 0.41 -1.08 -0.81 -4.53 116.67 116.31 1f0b s ASP 82 Ca 0.34 -2.25 0.11 0.00 -0.52 0.00 0.00 52.55 50.22 1f0b s ASP 82 Cb 0.18 -2.47 0.35 0.00 -1.46 0.00 0.00 42.92 39.53 1f0b s ASP 82 CO 0.26 -1.09 1.60 0.15 0.52 0.00 0.00 175.17 176.62 1f0b h PHE 83 N 8.36 0.00 -0.14 -5.34 3.57 -1.87 -3.01 116.94 118.51 1f0b h PHE 83 Ca 0.26 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.77 1f0b h PHE 83 Cb 0.95 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 1f0b h PHE 83 CO 1.22 0.62 0.06 0.74 -2.23 0.00 0.00 178.31 178.72 1f0b h PHE 84 N 0.00 0.12 0.00 0.41 -1.00 -1.86 -2.44 116.94 112.17 1f0b h PHE 84 Ca -0.01 0.01 -0.13 0.00 2.81 0.00 0.00 57.97 60.65 1f0b h PHE 84 Cb 1.11 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 40.62 1f0b h PHE 84 CO 0.00 0.07 -0.60 0.87 -1.61 0.00 0.00 178.31 177.04 1f0b h LYS 85 N 0.14 0.00 -1.11 1.51 1.57 -1.84 -3.22 116.57 113.63 1f0b h LYS 85 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1f0b h LYS 85 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1f0b h LYS 85 CO -0.04 0.60 0.00 -1.13 -0.57 0.00 0.00 179.45 178.31 1f0b n SER 86 N -3.30 1.44 0.00 0.86 3.41 -0.92 -1.90 113.62 113.20 1f0b n SER 86 Ca 0.01 -1.26 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 1f0b n SER 86 Cb 0.75 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1f0b n SER 86 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f0b n ALA 87 N 0.51 0.00 -2.57 7.33 0.00 -1.19 -3.94 120.51 120.65 1f0b n ALA 87 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1f0b n ALA 87 Cb 0.26 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.68 1f0b n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1f0b s MET 88 N 0.00 3.61 0.43 0.00 1.00 -0.80 0.39 119.30 123.93 1f0b s MET 88 Ca 0.00 -0.07 0.23 0.00 0.00 0.00 0.00 55.69 55.85 1f0b s MET 88 Cb 0.00 -2.68 0.40 0.00 0.00 0.00 0.00 34.83 32.54 1f0b s MET 88 CO 0.00 0.25 1.62 -1.00 0.00 0.00 0.00 175.02 175.89 1f0b h PRO 89 N 1.73 0.00 -0.70 2.03 0.13 -1.86 -3.39 132.00 129.93 1f0b h PRO 89 Ca -0.48 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.78 1f0b h PRO 89 Cb 1.19 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 1f0b h PRO 89 CO 0.66 0.07 -0.32 0.93 -0.23 0.00 0.00 178.00 179.11 1f0b h GLU 90 N 0.00 -0.10 0.00 0.86 3.07 -1.92 -3.27 114.58 113.22 1f0b h GLU 90 Ca -0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1f0b h GLU 90 Cb 1.00 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.94 1f0b h GLU 90 CO 0.01 -0.07 0.00 0.41 -1.40 0.00 0.00 179.01 177.96 1f0b n GLY 91 N -1.45 -3.05 3.18 -3.84 0.00 0.16 -4.74 105.19 95.44 1f0b n GLY 91 Ca 0.06 -2.10 -0.11 0.00 0.00 0.00 0.00 46.02 43.88 1f0b n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f0b s TYR 92 N -0.55 0.96 -0.20 1.61 -0.85 -0.41 0.04 117.35 117.94 1f0b s TYR 92 Ca 0.00 -1.18 -0.06 0.00 -0.52 0.00 0.00 57.07 55.31 1f0b s TYR 92 Cb 0.00 -0.54 -0.03 0.00 0.38 0.00 0.00 41.96 41.77 1f0b s TYR 92 CO 0.00 -0.44 0.03 0.08 -1.52 0.00 0.00 175.55 173.70 1f0b s VAL 93 N -3.95 4.21 -0.18 -3.49 1.01 0.20 0.45 120.40 118.65 1f0b s VAL 93 Ca 0.24 -0.23 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 1f0b s VAL 93 Cb 0.07 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 1f0b s VAL 93 CO 0.03 0.42 -0.02 -1.58 0.00 0.00 0.00 175.10 173.94 1f0b s GLN 94 N 0.97 3.63 -0.01 2.72 2.00 -0.16 -0.77 119.66 128.05 1f0b s GLN 94 Ca 0.02 -0.52 0.04 0.00 -2.00 0.00 0.00 55.36 52.90 1f0b s GLN 94 Cb -0.14 -3.00 -0.01 0.00 0.80 0.00 0.00 33.01 30.66 1f0b s GLN 94 CO 0.02 0.11 -0.13 -1.21 -0.50 0.00 0.00 175.29 173.58 1f0b s GLU 95 N 0.72 1.05 0.08 1.67 2.02 -0.30 0.13 118.70 124.07 1f0b s GLU 95 Ca -0.01 -0.49 -0.15 0.00 0.02 0.00 0.00 54.97 54.35 1f0b s GLU 95 Cb -0.14 -1.02 0.03 0.00 0.10 0.00 0.00 34.13 33.10 1f0b s GLU 95 CO 0.02 0.28 0.34 1.03 0.02 0.00 0.00 175.26 176.95 1f0b s ARG 96 N -0.37 0.94 -0.04 1.61 0.52 0.12 -1.89 118.95 119.84 1f0b s ARG 96 Ca 0.05 -0.64 -0.00 0.00 -0.52 0.00 0.00 55.73 54.62 1f0b s ARG 96 Cb -0.05 0.41 0.03 0.00 0.52 0.00 0.00 34.95 35.85 1f0b s ARG 96 CO -0.00 -0.34 0.00 0.99 0.02 0.00 0.00 175.30 175.98 1f0b s THR 97 N -3.27 0.20 -0.20 0.02 2.01 -0.35 0.81 115.64 114.86 1f0b s THR 97 Ca -0.00 0.12 -0.02 0.00 0.31 0.00 0.00 61.69 62.10 1f0b s THR 97 Cb 0.01 -0.32 0.06 0.00 0.01 0.00 0.00 72.50 72.26 1f0b s THR 97 CO -0.08 0.17 0.01 -0.63 -0.69 0.00 0.00 174.62 173.40 1f0b s ILE 98 N 1.30 0.82 -0.26 1.82 1.01 0.23 -1.06 121.20 125.07 1f0b s ILE 98 Ca -0.06 -0.72 -0.14 0.00 0.00 0.00 0.00 60.65 59.73 1f0b s ILE 98 Cb -0.13 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 1f0b s ILE 98 CO -0.02 -0.15 0.35 -0.36 0.00 0.00 0.00 174.94 174.76 1f0b s PHE 99 N 1.73 3.26 -0.35 3.97 0.40 -0.77 0.16 117.98 126.37 1f0b s PHE 99 Ca -0.02 0.40 -0.29 0.00 -0.60 0.00 0.00 56.93 56.42 1f0b s PHE 99 Cb -0.17 -2.53 0.01 0.00 0.51 0.00 0.00 43.02 40.83 1f0b s PHE 99 CO -0.07 -0.19 1.24 -0.06 0.70 0.00 0.00 175.22 176.84 1f0b s PHE 100 N 1.91 2.78 0.00 0.36 0.40 0.27 -2.18 117.98 121.51 1f0b s PHE 100 Ca 0.14 0.89 0.00 0.00 -0.60 0.00 0.00 56.93 57.37 1f0b s PHE 100 Cb -0.16 -4.00 0.00 0.00 0.51 0.00 0.00 43.02 39.38 1f0b s PHE 100 CO 0.10 -1.46 0.00 1.17 0.70 0.00 0.00 175.22 175.73 1f0b n LYS 101 N 7.40 0.00 -1.64 0.44 3.00 0.15 0.90 118.16 128.41 1f0b n LYS 101 Ca 0.14 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 58.13 1f0b n LYS 101 Cb 0.47 0.00 0.06 0.00 0.00 0.00 0.00 35.03 35.56 1f0b n LYS 101 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1f0b n ASP 102 N -0.29 6.79 0.00 3.14 8.00 -1.26 -4.95 116.55 127.97 1f0b n ASP 102 Ca 0.00 -3.78 0.00 0.00 0.71 0.00 0.00 54.79 51.72 1f0b n ASP 102 Cb 0.00 -0.79 0.00 0.00 -0.02 0.00 0.00 41.12 40.31 1f0b n ASP 102 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1f0b n ASP 103 N -0.80 0.00 -3.29 -2.24 4.64 0.26 -5.00 116.55 110.12 1f0b n ASP 103 Ca 0.56 0.00 -0.21 0.00 -1.38 0.00 0.00 54.79 53.75 1f0b n ASP 103 Cb 0.70 0.00 0.17 0.00 -1.04 0.00 0.00 41.12 40.94 1f0b n ASP 103 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1f0b n GLY 104 N 0.00 -2.22 3.17 0.27 0.00 -1.13 -4.52 105.19 100.76 1f0b n GLY 104 Ca 0.00 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.36 1f0b n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f0b s ASN 105 N -3.92 0.71 -0.05 1.61 4.22 -1.01 0.94 114.94 117.43 1f0b s ASN 105 Ca 0.52 -1.13 0.06 0.00 -2.14 0.00 0.00 52.86 50.16 1f0b s ASN 105 Cb -0.04 0.20 -0.02 0.00 1.28 0.00 0.00 41.25 42.68 1f0b s ASN 105 CO 0.38 -0.62 -0.23 -0.31 -2.04 0.00 0.00 177.10 174.28 1f0b s TYR 106 N -3.86 2.48 -0.20 1.54 2.02 0.41 -2.61 117.35 117.14 1f0b s TYR 106 Ca 0.19 -0.58 -0.02 0.00 -0.37 0.00 0.00 57.07 56.29 1f0b s TYR 106 Cb 0.07 -1.60 -0.00 0.00 -0.40 0.00 0.00 41.96 40.03 1f0b s TYR 106 CO -0.01 -0.12 -0.09 0.21 -1.57 0.00 0.00 175.55 173.97 1f0b s LYS 107 N -0.30 3.27 0.10 -0.62 2.20 0.27 -0.60 119.74 124.06 1f0b s LYS 107 Ca 0.01 -0.68 0.07 0.00 -0.36 0.00 0.00 55.97 55.00 1f0b s LYS 107 Cb -0.13 -2.86 -0.03 0.00 -1.51 0.00 0.00 37.83 33.30 1f0b s LYS 107 CO 0.02 -0.16 -0.18 0.95 -0.36 0.00 0.00 175.35 175.62 1f0b s THR 108 N 1.33 1.47 -0.08 3.43 -4.23 0.24 -0.07 115.64 117.73 1f0b s THR 108 Ca 0.04 -1.52 -0.01 0.00 -1.18 0.00 0.00 61.69 59.02 1f0b s THR 108 Cb -0.14 -1.42 0.03 0.00 1.34 0.00 0.00 72.50 72.31 1f0b s THR 108 CO -0.05 -0.18 0.01 -0.60 -0.54 0.00 0.00 174.62 173.25 1f0b s ARG 109 N -2.03 0.57 0.03 3.99 3.52 -0.94 -0.70 118.95 123.38 1f0b s ARG 109 Ca 0.05 0.10 0.05 0.00 -0.13 0.00 0.00 55.73 55.80 1f0b s ARG 109 Cb -0.09 -1.00 -0.02 0.00 -1.56 0.00 0.00 34.95 32.28 1f0b s ARG 109 CO 0.04 -0.32 -0.15 0.00 -0.81 0.00 0.00 175.30 174.06 1f0b s ALA 110 N 1.98 1.24 -0.36 6.12 0.00 0.12 -1.74 121.76 129.12 1f0b s ALA 110 Ca 0.05 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 1f0b s ALA 110 Cb -0.12 -0.23 0.09 0.00 0.00 0.00 0.00 23.12 22.85 1f0b s ALA 110 CO -0.05 0.26 0.11 -2.00 0.00 0.00 0.00 175.76 174.08 1f0b s GLU 111 N -0.92 2.06 -0.27 0.00 2.12 -0.14 -0.99 118.70 120.55 1f0b s GLU 111 Ca 0.03 -1.65 -0.12 0.00 0.36 0.00 0.00 54.97 53.60 1f0b s GLU 111 Cb -0.07 -3.39 -0.05 0.00 0.26 0.00 0.00 34.13 30.88 1f0b s GLU 111 CO 0.01 -0.90 0.24 0.08 -0.54 0.00 0.00 175.26 174.15 1f0b s VAL 112 N 1.14 5.28 -0.13 3.70 1.01 0.17 -2.40 120.40 129.17 1f0b s VAL 112 Ca 0.04 0.29 -0.31 0.00 0.00 0.00 0.00 61.98 62.00 1f0b s VAL 112 Cb -0.21 -3.58 0.13 0.00 0.00 0.00 0.00 36.38 32.72 1f0b s VAL 112 CO -0.04 0.23 1.06 -1.59 0.00 0.00 0.00 175.10 174.76 1f0b s LYS 113 N 1.78 0.53 0.35 2.72 -2.85 0.36 -1.29 119.74 121.34 1f0b s LYS 113 Ca 0.09 -0.09 -0.26 0.00 -1.00 0.00 0.00 55.97 54.72 1f0b s LYS 113 Cb -0.16 0.25 -0.09 0.00 -2.06 0.00 0.00 37.83 35.76 1f0b s LYS 113 CO 0.10 -0.21 1.01 -0.06 0.10 0.00 0.00 175.35 176.30 1f0b s PHE 114 N -2.17 3.49 -0.41 1.78 0.40 -1.24 -0.88 117.98 118.96 1f0b s PHE 114 Ca 0.05 1.71 0.03 0.00 -0.60 0.00 0.00 56.93 58.12 1f0b s PHE 114 Cb -0.01 -3.07 0.12 0.00 0.51 0.00 0.00 43.02 40.57 1f0b s PHE 114 CO -0.05 -0.28 0.16 -1.21 0.70 0.00 0.00 175.22 174.54 1f0b s GLU 115 N -2.15 1.54 5.54 0.44 0.41 0.26 -4.91 118.70 119.83 1f0b s GLU 115 Ca 0.53 -2.07 0.00 0.00 -0.41 0.00 0.00 54.97 53.02 1f0b s GLU 115 Cb -0.22 -2.98 0.00 0.00 -1.78 0.00 0.00 34.13 29.15 1f0b s GLU 115 CO 0.28 -1.04 0.00 0.41 -0.49 0.00 0.00 175.26 174.43 1f0b n GLY 116 N 3.82 1.31 0.11 -1.39 0.00 -1.26 -2.58 105.19 105.19 1f0b n GLY 116 Ca 0.04 -0.64 0.14 0.00 0.00 0.00 0.00 46.02 45.57 1f0b n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f0b n ASP 117 N 4.44 0.45 -4.85 1.61 10.43 -1.26 -4.89 116.55 122.48 1f0b n ASP 117 Ca 0.00 -0.60 -0.37 0.00 2.57 0.00 0.00 54.79 56.39 1f0b n ASP 117 Cb 0.00 -0.08 -0.07 0.00 1.84 0.00 0.00 41.12 42.81 1f0b n ASP 117 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1f0b s THR 118 N -2.43 5.42 -0.38 -3.53 2.01 -1.07 -4.42 115.64 111.23 1f0b s THR 118 Ca 0.30 0.18 -0.20 0.00 0.31 0.00 0.00 61.69 62.28 1f0b s THR 118 Cb 0.20 -3.37 0.01 0.00 0.01 0.00 0.00 72.50 69.35 1f0b s THR 118 CO 0.46 0.59 0.63 -0.22 -0.69 0.00 0.00 174.62 175.40 1f0b s LEU 119 N -0.82 4.33 0.07 4.42 1.98 0.33 0.93 118.68 129.92 1f0b s LEU 119 Ca 0.14 -0.02 0.03 0.00 -2.89 0.00 0.00 54.13 51.39 1f0b s LEU 119 Cb -0.12 -2.76 -0.04 0.00 0.66 0.00 0.00 46.19 43.94 1f0b s LEU 119 CO 0.03 -0.65 0.06 -0.69 -1.89 0.00 0.00 176.35 173.21 1f0b s VAL 120 N 2.73 4.44 -0.19 1.68 1.01 -0.06 -1.48 120.40 128.54 1f0b s VAL 120 Ca 0.24 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 1f0b s VAL 120 Cb -0.14 -3.12 0.09 0.00 0.00 0.00 0.00 36.38 33.22 1f0b s VAL 120 CO 0.16 0.16 0.28 0.21 0.00 0.00 0.00 175.10 175.91 1f0b s ASN 121 N -2.26 0.76 -0.18 3.32 2.47 -1.05 -0.49 114.94 117.50 1f0b s ASN 121 Ca 0.28 0.16 -0.04 0.00 0.42 0.00 0.00 52.86 53.67 1f0b s ASN 121 Cb -0.12 0.68 -0.02 0.00 -1.45 0.00 0.00 41.25 40.34 1f0b s ASN 121 CO 0.20 -0.29 -0.03 -0.60 -3.72 0.00 0.00 177.10 172.65 1f0b s ARG 122 N 2.41 3.56 0.03 0.43 3.52 -1.01 -1.97 118.95 125.92 1f0b s ARG 122 Ca 0.06 -0.56 0.00 0.00 -0.13 0.00 0.00 55.73 55.11 1f0b s ARG 122 Cb -0.14 -2.97 -0.02 0.00 -1.56 0.00 0.00 34.95 30.25 1f0b s ARG 122 CO -0.12 0.05 -0.04 0.42 -0.81 0.00 0.00 175.30 174.81 1f0b s ILE 123 N 0.85 0.18 0.02 4.11 1.09 0.37 -0.97 121.20 126.85 1f0b s ILE 123 Ca -0.01 -1.05 0.06 0.00 -1.10 0.00 0.00 60.65 58.56 1f0b s ILE 123 Cb -0.14 -0.46 -0.02 0.00 -1.06 0.00 0.00 42.46 40.77 1f0b s ILE 123 CO 0.02 -0.55 -0.19 -1.61 -0.10 0.00 0.00 174.94 172.51 1f0b s GLU 124 N -1.79 1.36 -0.04 2.79 2.02 -0.71 -0.96 118.70 121.37 1f0b s GLU 124 Ca -0.12 -0.80 -0.04 0.00 0.02 0.00 0.00 54.97 54.02 1f0b s GLU 124 Cb -0.08 -1.40 0.01 0.00 0.10 0.00 0.00 34.13 32.76 1f0b s GLU 124 CO -0.02 0.37 0.12 -1.17 0.02 0.00 0.00 175.26 174.57 1f0b s LEU 125 N -0.88 1.57 -0.16 1.80 2.96 -0.22 -2.22 118.68 121.53 1f0b s LEU 125 Ca 0.06 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.17 1f0b s LEU 125 Cb -0.08 0.42 0.01 0.00 0.50 0.00 0.00 46.19 47.04 1f0b s LEU 125 CO 0.01 -0.08 -0.19 -0.75 -1.32 0.00 0.00 176.35 174.02 1f0b s LYS 126 N -0.11 3.08 -0.13 1.98 2.20 0.90 -2.74 119.74 124.92 1f0b s LYS 126 Ca -0.02 -0.81 -0.04 0.00 -0.36 0.00 0.00 55.97 54.75 1f0b s LYS 126 Cb -0.02 -2.56 -0.03 0.00 -1.51 0.00 0.00 37.83 33.71 1f0b s LYS 126 CO 0.00 -0.08 0.01 0.20 -0.36 0.00 0.00 175.35 175.12 1f0b s GLY 127 N 1.00 1.83 0.18 5.54 0.00 0.32 -0.57 107.32 115.62 1f0b s GLY 127 Ca -0.02 -0.79 -0.06 0.00 0.00 0.00 0.00 44.72 43.84 1f0b s GLY 127 CO -0.05 -0.26 0.24 -0.26 0.00 0.00 0.00 173.10 172.77 1f0b s ILE 128 N -0.21 0.05 -1.92 0.90 -4.36 -1.07 -0.14 121.20 114.44 1f0b s ILE 128 Ca 0.05 -1.62 0.00 0.00 -0.26 0.00 0.00 60.65 58.83 1f0b s ILE 128 Cb -0.12 -2.09 0.00 0.00 1.25 0.00 0.00 42.46 41.50 1f0b s ILE 128 CO 0.02 -0.21 0.00 0.47 0.24 0.00 0.00 174.94 175.46 1f0b n ASP 129 N -0.24 -5.80 -4.88 4.36 8.00 -1.26 -2.42 116.55 114.32 1f0b n ASP 129 Ca -0.04 0.15 -0.31 0.00 0.71 0.00 0.00 54.79 55.30 1f0b n ASP 129 Cb 0.64 -4.90 -0.04 0.00 -0.02 0.00 0.00 41.12 36.79 1f0b n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1f0b s PHE 130 N -2.96 3.44 0.03 1.24 0.40 -1.26 -2.83 117.98 116.04 1f0b s PHE 130 Ca 0.00 0.93 -0.22 0.00 -0.60 0.00 0.00 56.93 57.05 1f0b s PHE 130 Cb 0.00 -2.33 -0.06 0.00 0.51 0.00 0.00 43.02 41.14 1f0b s PHE 130 CO 0.00 0.10 0.64 0.15 0.70 0.00 0.00 175.22 176.80 1f0b s LYS 131 N -3.35 4.35 0.45 0.44 3.01 -1.26 -4.94 119.74 118.44 1f0b s LYS 131 Ca 0.49 0.83 0.24 0.00 -1.01 0.00 0.00 55.97 56.52 1f0b s LYS 131 Cb -0.11 -3.32 0.47 0.00 -1.01 0.00 0.00 37.83 33.86 1f0b s LYS 131 CO 0.26 0.41 1.65 1.05 0.51 0.00 0.00 175.35 179.24 1f0b h GLU 132 N 5.35 0.00 0.00 1.68 9.09 -1.96 -3.24 114.58 125.50 1f0b h GLU 132 Ca -0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.95 1f0b h GLU 132 Cb 1.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.30 1f0b h GLU 132 CO 0.68 0.03 -1.68 -0.40 0.05 0.00 0.00 179.01 177.69 1f0b n ASP 133 N -3.11 0.28 -3.44 3.06 5.75 -1.26 -3.60 116.55 114.24 1f0b n ASP 133 Ca 0.03 -0.19 -0.10 0.00 -0.01 0.00 0.00 54.79 54.53 1f0b n ASP 133 Cb 0.51 1.64 0.09 0.00 -1.03 0.00 0.00 41.12 42.33 1f0b n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1f0b n GLY 134 N 1.31 -1.54 0.33 6.12 0.00 -1.22 -4.45 105.19 105.74 1f0b n GLY 134 Ca -0.02 -0.50 -0.05 0.00 0.00 0.00 0.00 46.02 45.45 1f0b n GLY 134 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1f0b h ASN 135 N -2.41 1.03 0.00 1.61 2.35 -1.90 -2.83 115.58 113.43 1f0b h ASN 135 Ca -0.13 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1f0b h ASN 135 Cb 0.42 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1f0b h ASN 135 CO 0.08 0.92 0.00 -0.38 -1.65 0.00 0.00 177.43 176.40 1f0b n ILE 136 N -4.28 0.00 -0.07 2.81 5.41 -1.26 -0.54 119.36 121.44 1f0b n ILE 136 Ca 0.07 0.34 0.24 0.00 1.00 0.00 0.00 62.75 64.39 1f0b n ILE 136 Cb 0.19 -0.72 0.71 0.00 -0.71 0.00 0.00 39.64 39.11 1f0b n ILE 136 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1f0b h LEU 137 N 0.00 0.00 -3.53 1.39 3.38 -1.74 0.18 115.31 114.98 1f0b h LEU 137 Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 1f0b h LEU 137 Cb 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.59 1f0b h LEU 137 CO 0.00 0.00 0.34 0.61 0.09 0.00 0.00 178.44 179.48 1f0b n GLY 138 N -1.66 3.61 3.69 0.83 0.00 -1.07 -4.93 105.19 105.66 1f0b n GLY 138 Ca 0.13 -0.89 -0.25 0.00 0.00 0.00 0.00 46.02 45.01 1f0b n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1f0b n HIS 139 N -0.33 -1.46 -0.12 1.61 8.25 0.63 -4.90 115.22 118.90 1f0b n HIS 139 Ca 0.41 0.48 0.07 0.00 -0.26 0.00 0.00 57.72 58.42 1f0b n HIS 139 Cb 1.34 -2.19 0.18 0.00 1.12 0.00 0.00 29.99 30.45 1f0b n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1f0b n LYS 140 N -2.82 2.60 -3.45 -0.41 4.76 0.30 -4.98 118.16 114.16 1f0b n LYS 140 Ca -0.21 -2.11 -0.37 0.00 -2.87 0.00 0.00 58.31 52.74 1f0b n LYS 140 Cb 0.53 -1.34 -0.06 0.00 -1.84 0.00 0.00 35.03 32.31 1f0b n LYS 140 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1f0b s LEU 141 N -1.03 4.44 0.32 -0.35 1.43 -1.25 -3.99 118.68 118.25 1f0b s LEU 141 Ca 0.29 1.00 -0.23 0.00 -1.03 0.00 0.00 54.13 54.15 1f0b s LEU 141 Cb 0.15 -2.81 -0.10 0.00 0.03 0.00 0.00 46.19 43.47 1f0b s LEU 141 CO 0.20 0.26 0.89 -1.61 0.23 0.00 0.00 176.35 176.32 1f0b s GLU 142 N -1.36 4.44 -1.22 1.70 2.02 -0.78 -4.93 118.70 118.56 1f0b s GLU 142 Ca 0.28 1.17 -0.14 0.00 0.02 0.00 0.00 54.97 56.30 1f0b s GLU 142 Cb -0.16 -2.71 -0.05 0.00 0.10 0.00 0.00 34.13 31.30 1f0b s GLU 142 CO 0.16 0.25 2.27 0.98 0.02 0.00 0.00 175.26 178.94 1f0b n TYR 143 N 0.38 2.54 -3.89 1.61 9.36 -1.26 -4.81 117.16 121.09 1f0b n TYR 143 Ca 0.02 -2.52 -0.11 0.00 3.32 0.00 0.00 57.90 58.61 1f0b n TYR 143 Cb 0.51 -2.18 -0.02 0.00 -0.63 0.00 0.00 39.34 37.03 1f0b n TYR 143 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1f0b n ASN 144 N 5.71 -1.14 -3.67 2.98 6.94 -1.26 -4.81 115.26 120.01 1f0b n ASN 144 Ca 0.55 -2.41 -0.09 0.00 -0.02 0.00 0.00 54.58 52.62 1f0b n ASN 144 Cb 0.32 2.08 -0.09 0.00 -2.36 0.00 0.00 39.78 39.73 1f0b n ASN 144 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 1f0b s TYR 145 N -3.49 -0.80 0.61 -2.53 5.04 -1.26 -4.88 117.35 110.04 1f0b s TYR 145 Ca 0.21 1.61 -0.09 0.00 -2.44 0.00 0.00 57.07 56.36 1f0b s TYR 145 Cb -0.01 0.40 -0.02 0.00 0.35 0.00 0.00 41.96 42.68 1f0b s TYR 145 CO 0.15 -0.43 0.98 -0.80 -1.34 0.00 0.00 175.55 174.11 1f0b s ASN 146 N 1.73 6.02 0.33 4.32 0.01 -1.26 -4.70 114.94 121.38 1f0b s ASN 146 Ca -0.08 1.20 -0.09 0.00 -0.71 0.00 0.00 52.86 53.17 1f0b s ASN 146 Cb -0.08 -2.24 -0.06 0.00 0.41 0.00 0.00 41.25 39.27 1f0b s ASN 146 CO -0.15 -0.93 0.65 -0.55 -1.51 0.00 0.00 177.10 174.62 1f0b s SER 147 N -4.21 6.55 0.06 -1.22 0.15 -1.26 -4.65 113.70 109.11 1f0b s SER 147 Ca 0.54 0.98 -0.27 0.00 0.70 0.00 0.00 55.95 57.89 1f0b s SER 147 Cb -0.11 -2.25 0.09 0.00 -1.71 0.00 0.00 66.02 62.04 1f0b s SER 147 CO 0.51 -0.25 0.92 -1.58 1.20 0.00 0.00 173.24 174.04 1f0b s GLN 148 N -3.46 0.97 0.04 5.44 2.00 -0.90 -5.01 119.66 118.74 1f0b s GLN 148 Ca 0.48 -0.45 0.01 0.00 -2.00 0.00 0.00 55.36 53.40 1f0b s GLN 148 Cb -0.11 0.39 -0.04 0.00 0.80 0.00 0.00 33.01 34.06 1f0b s GLN 148 CO 0.27 -0.44 0.12 -0.80 -0.50 0.00 0.00 175.29 173.95 1f0b s ASN 149 N -2.68 5.85 -0.13 6.67 -0.87 -1.26 0.01 114.94 122.53 1f0b s ASN 149 Ca 0.08 0.14 -0.00 0.00 -1.57 0.00 0.00 52.86 51.51 1f0b s ASN 149 Cb -0.01 -1.69 0.02 0.00 -0.02 0.00 0.00 41.25 39.56 1f0b s ASN 149 CO -0.04 0.21 -0.11 -0.69 -2.57 0.00 0.00 177.10 173.90 1f0b s VAL 150 N -1.35 1.27 -0.34 1.60 1.01 0.40 -4.94 120.40 118.05 1f0b s VAL 150 Ca 0.28 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.63 1f0b s VAL 150 Cb -0.12 -1.24 -0.00 0.00 0.00 0.00 0.00 36.38 35.01 1f0b s VAL 150 CO 0.21 0.41 0.55 -0.31 0.00 0.00 0.00 175.10 175.95 1f0b s TYR 151 N 1.60 3.18 -0.04 5.22 1.51 -1.26 -0.45 117.35 127.11 1f0b s TYR 151 Ca 0.05 0.28 -0.15 0.00 -1.01 0.00 0.00 57.07 56.24 1f0b s TYR 151 Cb -0.13 -2.96 -0.05 0.00 -0.11 0.00 0.00 41.96 38.71 1f0b s TYR 151 CO -0.09 -0.53 0.40 0.42 -1.11 0.00 0.00 175.55 174.64 1f0b s ILE 152 N 2.47 5.10 0.01 2.71 1.09 0.21 -3.81 121.20 128.98 1f0b s ILE 152 Ca 0.21 0.82 -0.04 0.00 -1.10 0.00 0.00 60.65 60.54 1f0b s ILE 152 Cb -0.15 -3.72 -0.01 0.00 -1.06 0.00 0.00 42.46 37.52 1f0b s ILE 152 CO 0.13 0.51 0.06 0.00 -0.10 0.00 0.00 174.94 175.54 1f0b s MET 153 N -0.57 0.38 0.92 2.79 0.23 0.07 -2.54 119.30 120.58 1f0b s MET 153 Ca 0.23 -0.46 -0.12 0.00 -1.03 0.00 0.00 55.69 54.32 1f0b s MET 153 Cb -0.16 0.15 0.14 0.00 -1.53 0.00 0.00 34.83 33.43 1f0b s MET 153 CO 0.12 -0.08 1.09 0.00 -2.03 0.00 0.00 175.02 174.12 1f0b s ALA 154 N -1.32 1.41 -0.39 3.16 0.00 -1.18 -0.43 121.76 123.00 1f0b s ALA 154 Ca -0.14 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 51.79 1f0b s ALA 154 Cb -0.08 -3.20 0.16 0.00 0.00 0.00 0.00 23.12 20.00 1f0b s ALA 154 CO 0.00 -2.47 0.30 0.34 0.00 0.00 0.00 175.76 173.93 1f0b s ASP 155 N -3.35 1.90 0.00 0.00 2.15 -0.23 -4.31 116.67 112.84 1f0b s ASP 155 Ca 0.64 -2.68 0.00 0.00 0.43 0.00 0.00 52.55 50.94 1f0b s ASP 155 Cb -0.19 -0.34 0.00 0.00 -0.30 0.00 0.00 42.92 42.09 1f0b s ASP 155 CO 0.57 -0.22 0.56 1.17 -0.17 0.00 0.00 175.17 177.08 1f0b n LYS 156 N 3.32 0.84 -0.06 4.34 4.81 -1.26 0.70 118.16 130.84 1f0b n LYS 156 Ca 0.23 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.56 1f0b n LYS 156 Cb 0.44 -1.28 -0.04 0.00 0.02 0.00 0.00 35.03 34.18 1f0b n LYS 156 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1f0b n GLN 157 N -0.12 0.37 0.06 1.64 6.02 -1.26 -4.31 117.38 119.78 1f0b n GLN 157 Ca 0.00 0.15 0.09 0.00 -0.01 0.00 0.00 57.00 57.23 1f0b n GLN 157 Cb 0.14 -1.13 0.37 0.00 1.02 0.00 0.00 30.24 30.64 1f0b n GLN 157 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1f0b n LYS 158 N -4.03 0.08 -3.77 -1.09 4.01 -1.06 -4.87 118.16 107.43 1f0b n LYS 158 Ca -0.19 0.34 -0.23 0.00 -0.51 0.00 0.00 58.31 57.73 1f0b n LYS 158 Cb 0.49 -1.66 0.02 0.00 -0.51 0.00 0.00 35.03 33.37 1f0b n LYS 158 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1f0b n ASN 159 N -1.81 -1.05 0.00 4.39 5.15 0.22 -4.75 115.26 117.41 1f0b n ASN 159 Ca 0.03 -0.86 0.00 0.00 -0.60 0.00 0.00 54.58 53.14 1f0b n ASN 159 Cb 0.18 -3.81 0.00 0.00 -0.53 0.00 0.00 39.78 35.62 1f0b n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1f0b n GLY 160 N -1.67 3.72 3.21 8.20 0.00 -0.47 -4.52 105.19 113.67 1f0b n GLY 160 Ca -0.29 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.42 1f0b n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1f0b s ILE 161 N -0.06 0.29 0.00 -0.61 -4.36 -1.08 -1.07 121.20 114.32 1f0b s ILE 161 Ca 0.00 -1.96 0.07 0.00 -0.26 0.00 0.00 60.65 58.50 1f0b s ILE 161 Cb 0.00 -2.26 -0.02 0.00 1.25 0.00 0.00 42.46 41.43 1f0b s ILE 161 CO 0.00 -0.29 -0.22 -0.54 0.24 0.00 0.00 174.94 174.13 1f0b s LYS 162 N -4.04 1.67 -0.01 0.37 1.02 0.42 -1.28 119.74 117.88 1f0b s LYS 162 Ca 0.30 -0.83 0.01 0.00 0.02 0.00 0.00 55.97 55.46 1f0b s LYS 162 Cb 0.07 -1.66 0.01 0.00 -0.52 0.00 0.00 37.83 35.73 1f0b s LYS 162 CO 0.06 0.45 -0.01 0.08 -0.92 0.00 0.00 175.35 175.01 1f0b s VAL 163 N -0.59 0.19 -0.05 3.17 1.01 -0.90 -0.75 120.40 122.48 1f0b s VAL 163 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 1f0b s VAL 163 Cb -0.08 -0.22 0.03 0.00 0.00 0.00 0.00 36.38 36.10 1f0b s VAL 163 CO -0.00 0.10 0.01 0.21 0.00 0.00 0.00 175.10 175.42 1f0b s ASN 164 N 0.45 1.19 -0.02 3.32 2.47 -1.25 -1.56 114.94 119.54 1f0b s ASN 164 Ca -0.04 -0.04 -0.29 0.00 0.42 0.00 0.00 52.86 52.91 1f0b s ASN 164 Cb -0.07 -0.32 0.10 0.00 -1.45 0.00 0.00 41.25 39.51 1f0b s ASN 164 CO -0.01 -0.18 0.98 0.72 -3.72 0.00 0.00 177.10 174.90 1f0b s PHE 165 N 1.74 -0.25 0.03 0.43 -0.12 -0.92 -4.07 117.98 114.81 1f0b s PHE 165 Ca 0.01 0.11 0.03 0.00 -0.05 0.00 0.00 56.93 57.03 1f0b s PHE 165 Cb -0.13 0.55 -0.02 0.00 -0.63 0.00 0.00 43.02 42.80 1f0b s PHE 165 CO -0.04 -0.51 -0.10 -1.59 -0.05 0.00 0.00 175.22 172.94 1f0b s LYS 166 N -2.97 0.68 -0.10 1.99 -2.85 -1.26 0.37 119.74 115.59 1f0b s LYS 166 Ca 0.07 -0.61 -0.03 0.00 -1.00 0.00 0.00 55.97 54.40 1f0b s LYS 166 Cb -0.01 -0.60 -0.03 0.00 -2.06 0.00 0.00 37.83 35.13 1f0b s LYS 166 CO -0.06 0.14 0.03 0.42 0.10 0.00 0.00 175.35 175.98 1f0b s ILE 167 N -0.83 4.52 -0.23 3.79 -1.09 0.33 -4.93 121.20 122.76 1f0b s ILE 167 Ca -0.02 -0.16 -0.09 0.00 -2.23 0.00 0.00 60.65 58.15 1f0b s ILE 167 Cb -0.07 -2.93 -0.04 0.00 -1.58 0.00 0.00 42.46 37.84 1f0b s ILE 167 CO 0.01 0.59 0.11 -0.13 -1.23 0.00 0.00 174.94 174.28 1f0b s ARG 168 N -0.70 3.92 -0.26 2.79 0.52 -1.26 -1.37 118.95 122.59 1f0b s ARG 168 Ca 0.11 -0.35 -0.08 0.00 -0.52 0.00 0.00 55.73 54.89 1f0b s ARG 168 Cb -0.12 -3.39 -0.04 0.00 0.52 0.00 0.00 34.95 31.93 1f0b s ARG 168 CO 0.02 0.05 0.11 -1.01 0.02 0.00 0.00 175.30 174.49 1f0b s HIS 169 N 1.03 3.13 0.33 -0.53 3.76 -0.03 -4.63 115.29 118.35 1f0b s HIS 169 Ca 0.05 -0.24 -0.28 0.00 -0.15 0.00 0.00 55.06 54.45 1f0b s HIS 169 Cb -0.14 -2.28 -0.09 0.00 1.11 0.00 0.00 32.58 31.18 1f0b s HIS 169 CO 0.04 -0.29 1.13 -0.80 -0.85 0.00 0.00 174.74 173.97 1f0b s ASN 170 N 1.64 6.99 -0.02 1.40 0.02 -1.26 0.12 114.94 123.82 1f0b s ASN 170 Ca 0.07 2.30 0.03 0.00 -1.02 0.00 0.00 52.86 54.24 1f0b s ASN 170 Cb -0.15 -2.62 -0.03 0.00 0.02 0.00 0.00 41.25 38.46 1f0b s ASN 170 CO 0.06 -0.35 -0.08 -0.63 0.02 0.00 0.00 177.10 176.12 1f0b s ILE 171 N -1.28 3.54 0.16 0.60 1.01 0.12 -1.87 121.20 123.47 1f0b s ILE 171 Ca 0.49 -0.73 -0.19 0.00 0.00 0.00 0.00 60.65 60.22 1f0b s ILE 171 Cb -0.31 -2.50 0.06 0.00 0.01 0.00 0.00 42.46 39.72 1f0b s ILE 171 CO 0.40 0.46 1.66 1.05 0.00 0.00 0.00 174.94 178.51 1f0b h GLU 172 N 4.78 -0.10 -5.27 2.79 4.11 -1.81 -2.72 114.58 116.36 1f0b h GLU 172 Ca -0.48 0.01 -0.37 0.00 0.07 0.00 0.00 59.36 58.58 1f0b h GLU 172 Cb 1.17 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1f0b h GLU 172 CO 0.53 -0.07 1.22 -0.40 0.07 0.00 0.00 179.01 180.36 1f0b n ASP 173 N -5.32 2.85 0.00 3.06 5.68 -1.26 -4.62 116.55 116.94 1f0b n ASP 173 Ca 0.00 -2.68 0.00 0.00 -0.50 0.00 0.00 54.79 51.61 1f0b n ASP 173 Cb 0.24 -1.61 0.00 0.00 -1.14 0.00 0.00 41.12 38.61 1f0b n ASP 173 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1f0b n GLY 174 N 5.58 0.00 3.87 6.12 0.00 -1.03 -4.54 105.19 115.19 1f0b n GLY 174 Ca 0.46 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.18 1f0b n GLY 174 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1f0b s SER 175 N 0.00 2.64 0.07 1.61 0.15 -1.22 -4.82 113.70 112.13 1f0b s SER 175 Ca 0.00 0.31 0.03 0.00 0.70 0.00 0.00 55.95 57.00 1f0b s SER 175 Cb 0.00 -0.37 -0.03 0.00 -1.71 0.00 0.00 66.02 63.91 1f0b s SER 175 CO 0.00 -3.03 -0.10 -0.69 1.20 0.00 0.00 173.24 170.62 1f0b s VAL 176 N -3.74 0.83 -0.40 4.45 1.01 -1.26 0.12 120.40 121.41 1f0b s VAL 176 Ca 0.74 -1.38 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 1f0b s VAL 176 Cb -0.05 -1.05 0.07 0.00 0.00 0.00 0.00 36.38 35.35 1f0b s VAL 176 CO 0.54 -0.44 0.22 -1.58 0.00 0.00 0.00 175.10 173.84 1f0b s GLN 177 N -2.18 2.59 0.26 2.72 2.00 0.32 -4.88 119.66 120.48 1f0b s GLN 177 Ca -0.01 -1.39 -0.30 0.00 -2.00 0.00 0.00 55.36 51.66 1f0b s GLN 177 Cb -0.07 -3.70 -0.09 0.00 0.80 0.00 0.00 33.01 29.95 1f0b s GLN 177 CO 0.00 -0.88 1.27 -1.17 -0.50 0.00 0.00 175.29 174.01 1f0b s LEU 178 N 1.41 4.45 -0.28 3.68 0.20 -1.26 -0.85 118.68 126.02 1f0b s LEU 178 Ca 0.02 2.47 -0.02 0.00 0.69 0.00 0.00 54.13 57.30 1f0b s LEU 178 Cb -0.22 -3.63 0.09 0.00 -0.43 0.00 0.00 46.19 42.01 1f0b s LEU 178 CO 0.02 -0.46 0.09 0.00 -0.29 0.00 0.00 176.35 175.72 1f0b s ALA 179 N -0.56 1.27 -0.19 5.97 0.00 -0.47 0.33 121.76 128.10 1f0b s ALA 179 Ca 0.52 -1.37 -0.18 0.00 0.00 0.00 0.00 51.96 50.92 1f0b s ALA 179 Cb -0.37 -1.49 -0.03 0.00 0.00 0.00 0.00 23.12 21.23 1f0b s ALA 179 CO 0.44 -1.56 0.50 -0.51 0.00 0.00 0.00 175.76 174.62 1f0b s ASP 180 N 1.75 6.55 -0.11 0.00 1.01 -0.93 0.12 116.67 125.07 1f0b s ASP 180 Ca 0.07 0.66 -0.04 0.00 0.71 0.00 0.00 52.55 53.96 1f0b s ASP 180 Cb -0.17 -2.28 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 1f0b s ASP 180 CO -0.24 -0.15 0.05 -1.00 0.21 0.00 0.00 175.17 174.03 1f0b s HIS 181 N 1.53 3.29 -0.14 4.23 3.76 1.18 -1.85 115.29 127.28 1f0b s HIS 181 Ca 0.23 0.27 -0.02 0.00 -0.15 0.00 0.00 55.06 55.39 1f0b s HIS 181 Cb -0.15 -1.86 0.04 0.00 1.11 0.00 0.00 32.58 31.72 1f0b s HIS 181 CO 0.09 0.51 0.01 0.71 -0.85 0.00 0.00 174.74 175.21 1f0b s TYR 182 N -0.78 0.97 0.10 1.40 1.51 -0.22 -2.17 117.35 118.15 1f0b s TYR 182 Ca 0.12 -0.61 0.06 0.00 -1.01 0.00 0.00 57.07 55.63 1f0b s TYR 182 Cb -0.12 -0.98 -0.03 0.00 -0.11 0.00 0.00 41.96 40.72 1f0b s TYR 182 CO 0.03 -0.50 -0.15 -1.14 -1.11 0.00 0.00 175.55 172.67 1f0b s GLN 183 N 1.88 0.95 -0.22 -0.62 0.74 -0.60 -1.22 119.66 120.57 1f0b s GLN 183 Ca 0.02 -1.11 -0.10 0.00 0.05 0.00 0.00 55.36 54.21 1f0b s GLN 183 Cb -0.15 -0.95 0.08 0.00 1.10 0.00 0.00 33.01 33.10 1f0b s GLN 183 CO -0.07 0.20 0.52 -1.14 -0.55 0.00 0.00 175.29 174.25 1f0b s GLN 184 N -2.18 0.47 0.05 1.67 2.00 -0.79 -2.12 119.66 118.76 1f0b s GLN 184 Ca 0.04 1.07 0.06 0.00 -2.00 0.00 0.00 55.36 54.53 1f0b s GLN 184 Cb -0.08 0.27 -0.04 0.00 0.80 0.00 0.00 33.01 33.97 1f0b s GLN 184 CO 0.03 -0.19 -0.11 -0.80 -0.50 0.00 0.00 175.29 173.72 1f0b s ASN 185 N 2.06 4.32 -0.05 6.67 -0.87 -0.41 -1.15 114.94 125.51 1f0b s ASN 185 Ca -0.07 -0.30 -0.15 0.00 -1.57 0.00 0.00 52.86 50.77 1f0b s ASN 185 Cb -0.09 -0.87 0.03 0.00 -0.02 0.00 0.00 41.25 40.30 1f0b s ASN 185 CO -0.15 0.24 0.34 0.28 -2.57 0.00 0.00 177.10 175.24 1f0b s THR 186 N -1.05 0.04 -0.01 1.60 -1.32 0.05 -2.62 115.64 112.33 1f0b s THR 186 Ca 0.18 -0.31 -0.30 0.00 -1.21 0.00 0.00 61.69 60.05 1f0b s THR 186 Cb -0.11 -0.60 -0.05 0.00 -1.51 0.00 0.00 72.50 70.23 1f0b s THR 186 CO 0.09 -0.17 1.36 -2.16 -2.21 0.00 0.00 174.62 171.53 1f0b s PRO 187 N -0.86 4.29 0.30 7.08 0.04 -1.26 -0.63 135.00 143.97 1f0b s PRO 187 Ca -0.09 1.91 0.07 0.00 0.04 0.00 0.00 61.00 62.92 1f0b s PRO 187 Cb -0.04 -3.57 0.48 0.00 0.04 0.00 0.00 34.50 31.41 1f0b s PRO 187 CO 0.03 -0.55 1.72 0.82 0.04 0.00 0.00 177.00 179.06 1f0b h ILE 188 N 4.94 1.30 -3.98 0.56 2.04 -0.71 -3.46 117.51 118.21 1f0b h ILE 188 Ca -0.37 -1.46 -0.44 0.00 1.00 0.00 0.00 64.86 63.59 1f0b h ILE 188 Cb 1.17 1.64 0.16 0.00 -0.74 0.00 0.00 36.82 39.06 1f0b h ILE 188 CO 0.90 0.44 0.37 -0.83 0.00 0.00 0.00 178.15 179.02 1f0b s GLY 189 N -4.20 1.72 0.09 5.37 0.00 -1.25 -4.99 107.32 104.05 1f0b s GLY 189 Ca -0.05 -1.09 0.23 0.00 0.00 0.00 0.00 44.72 43.81 1f0b s GLY 189 CO 0.77 -0.33 1.04 1.22 0.00 0.00 0.00 173.10 175.80 1f0b n ASP 190 N -3.92 0.63 -3.75 1.64 9.92 -1.26 -5.03 116.55 114.78 1f0b n ASP 190 Ca 0.14 -0.03 -0.30 0.00 -0.53 0.00 0.00 54.79 54.07 1f0b n ASP 190 Cb 0.60 0.71 0.24 0.00 -0.64 0.00 0.00 41.12 42.02 1f0b n ASP 190 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1f0b s GLY 191 N -3.86 1.60 0.32 0.44 0.00 -1.26 -5.07 107.32 99.49 1f0b s GLY 191 Ca 0.02 -1.02 -0.27 0.00 0.00 0.00 0.00 44.72 43.45 1f0b s GLY 191 CO 0.79 -0.12 1.00 -4.14 0.00 0.00 0.00 173.10 170.64 1f0b s PRO 192 N -5.48 4.54 0.09 2.90 0.02 -1.26 -5.05 135.00 130.75 1f0b s PRO 192 Ca 0.72 1.50 -0.04 0.00 0.02 0.00 0.00 61.00 63.20 1f0b s PRO 192 Cb -0.08 -2.89 -0.03 0.00 0.02 0.00 0.00 34.50 31.52 1f0b s PRO 192 CO 0.56 0.20 0.07 0.14 -0.33 0.00 0.00 177.00 177.64 1f0b s VAL 193 N -1.46 0.16 -0.07 3.83 -7.23 -1.26 -4.75 120.40 109.61 1f0b s VAL 193 Ca 0.49 -1.65 -0.21 0.00 -1.81 0.00 0.00 61.98 58.81 1f0b s VAL 193 Cb -0.23 -1.62 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 1f0b s VAL 193 CO 0.29 -0.74 0.60 -0.76 -0.31 0.00 0.00 175.10 174.18 1f0b s LEU 194 N -2.94 4.32 -0.33 1.32 1.02 -1.25 -5.05 118.68 115.77 1f0b s LEU 194 Ca 0.11 1.04 -0.06 0.00 0.02 0.00 0.00 54.13 55.25 1f0b s LEU 194 Cb 0.07 -2.91 0.04 0.00 0.02 0.00 0.00 46.19 43.41 1f0b s LEU 194 CO -0.07 -0.03 0.09 -0.76 0.02 0.00 0.00 176.35 175.60 1f0b s LEU 195 N 0.54 4.26 0.39 1.79 2.01 -1.26 -3.87 118.68 122.54 1f0b s LEU 195 Ca 0.32 -1.14 -0.10 0.00 0.01 0.00 0.00 54.13 53.22 1f0b s LEU 195 Cb -0.17 -1.85 -0.06 0.00 0.01 0.00 0.00 46.19 44.12 1f0b s LEU 195 CO 0.15 -0.32 0.74 -2.16 1.01 0.00 0.00 176.35 175.78 1f0b s PRO 196 N 1.39 3.75 0.57 1.29 0.04 -1.26 -4.85 135.00 135.93 1f0b s PRO 196 Ca -0.02 0.40 -0.11 0.00 0.04 0.00 0.00 61.00 61.30 1f0b s PRO 196 Cb -0.19 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 31.88 1f0b s PRO 196 CO 0.02 -0.01 0.98 -0.51 0.04 0.00 0.00 177.00 177.52 1f0b s ASP 197 N -3.20 6.33 0.33 6.66 1.01 -1.26 -3.12 116.67 123.41 1f0b s ASP 197 Ca 0.50 1.38 -0.28 0.00 0.71 0.00 0.00 52.55 54.87 1f0b s ASP 197 Cb -0.10 -2.45 -0.13 0.00 1.01 0.00 0.00 42.92 41.25 1f0b s ASP 197 CO 0.32 -0.76 1.20 0.59 0.21 0.00 0.00 175.17 176.73 1f0b n ASN 198 N -2.39 2.27 -2.75 0.27 3.02 -1.26 -4.85 115.26 109.57 1f0b n ASN 198 Ca 0.05 1.19 -0.00 0.00 -0.03 0.00 0.00 54.58 55.79 1f0b n ASN 198 Cb 0.54 -1.42 0.01 0.00 -0.61 0.00 0.00 39.78 38.30 1f0b n ASN 198 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1f0b n HIS 199 N 0.27 -0.79 -4.12 3.10 1.44 -1.05 -4.47 115.22 109.59 1f0b n HIS 199 Ca 0.06 -0.73 -0.09 0.00 -2.01 0.00 0.00 57.72 54.95 1f0b n HIS 199 Cb 0.35 0.35 -0.10 0.00 0.12 0.00 0.00 29.99 30.71 1f0b n HIS 199 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1f0b s TYR 200 N -2.90 0.79 -0.28 -1.40 1.13 0.18 0.67 117.35 115.53 1f0b s TYR 200 Ca 0.18 -1.17 -0.09 0.00 -1.41 0.00 0.00 57.07 54.58 1f0b s TYR 200 Cb -0.01 -0.43 -0.03 0.00 -1.10 0.00 0.00 41.96 40.39 1f0b s TYR 200 CO 0.02 -0.53 0.13 -0.48 -2.51 0.00 0.00 175.55 172.17 1f0b s LEU 201 N -3.03 3.80 -0.28 -3.49 0.05 0.41 -1.31 118.68 114.82 1f0b s LEU 201 Ca 0.22 -0.26 -0.13 0.00 0.05 0.00 0.00 54.13 54.01 1f0b s LEU 201 Cb 0.07 -2.00 -0.04 0.00 -2.05 0.00 0.00 46.19 42.17 1f0b s LEU 201 CO 0.01 -0.09 0.28 -0.55 -0.55 0.00 0.00 176.35 175.45 1f0b s SER 202 N 1.65 6.13 0.21 1.48 0.15 0.07 -0.45 113.70 122.93 1f0b s SER 202 Ca 0.06 0.08 0.08 0.00 0.70 0.00 0.00 55.95 56.87 1f0b s SER 202 Cb -0.16 -2.16 -0.04 0.00 -1.71 0.00 0.00 66.02 61.95 1f0b s SER 202 CO 0.06 -0.13 0.01 -0.31 1.20 0.00 0.00 173.24 174.07 1f0b s TYR 203 N 1.90 2.81 -0.19 3.44 1.51 0.10 -1.55 117.35 125.38 1f0b s TYR 203 Ca 0.11 -0.16 -0.07 0.00 -1.01 0.00 0.00 57.07 55.93 1f0b s TYR 203 Cb -0.16 -1.32 0.08 0.00 -0.11 0.00 0.00 41.96 40.45 1f0b s TYR 203 CO 0.11 0.55 0.40 -0.65 -1.11 0.00 0.00 175.55 174.85 1f0b s GLN 204 N -3.23 0.32 0.12 -0.62 -1.52 -1.16 -2.12 119.66 111.46 1f0b s GLN 204 Ca 0.29 0.96 0.07 0.00 -1.95 0.00 0.00 55.36 54.73 1f0b s GLN 204 Cb -0.08 0.23 -0.04 0.00 -0.22 0.00 0.00 33.01 32.90 1f0b s GLN 204 CO 0.19 -0.24 -0.17 -1.12 -0.25 0.00 0.00 175.29 173.71 1f0b s SER 205 N 2.35 2.22 -0.03 5.90 0.01 -1.26 -1.82 113.70 121.07 1f0b s SER 205 Ca -0.03 -0.76 -0.00 0.00 1.31 0.00 0.00 55.95 56.47 1f0b s SER 205 Cb -0.11 -0.10 0.03 0.00 0.21 0.00 0.00 66.02 66.04 1f0b s SER 205 CO -0.12 -0.06 0.01 0.00 0.41 0.00 0.00 173.24 173.48 1f0b s ALA 206 N -1.72 0.30 0.09 1.44 0.00 -0.24 -4.68 121.76 116.96 1f0b s ALA 206 Ca 0.08 0.16 -0.03 0.00 0.00 0.00 0.00 51.96 52.17 1f0b s ALA 206 Cb -0.07 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.61 1f0b s ALA 206 CO 0.04 -0.17 0.30 -0.51 0.00 0.00 0.00 175.76 175.42 1f0b s LEU 207 N 1.28 4.32 0.32 0.00 1.43 -1.26 -2.27 118.68 122.49 1f0b s LEU 207 Ca -0.06 0.48 -0.19 0.00 -1.03 0.00 0.00 54.13 53.33 1f0b s LEU 207 Cb -0.13 -3.09 0.03 0.00 0.03 0.00 0.00 46.19 43.03 1f0b s LEU 207 CO -0.02 0.13 0.74 -0.94 0.23 0.00 0.00 176.35 176.48 1f0b s SER 208 N -2.33 -0.16 0.03 2.29 1.04 0.06 -4.95 113.70 109.67 1f0b s SER 208 Ca 0.37 -0.80 0.08 0.00 0.48 0.00 0.00 55.95 56.08 1f0b s SER 208 Cb -0.13 0.77 -0.02 0.00 0.10 0.00 0.00 66.02 66.74 1f0b s SER 208 CO 0.24 -1.46 -0.22 -0.54 0.98 0.00 0.00 173.24 172.24 1f0b s LYS 209 N -3.38 1.56 -0.28 4.02 -0.14 -1.26 -0.70 119.74 119.56 1f0b s LYS 209 Ca 0.13 -0.93 -0.21 0.00 -1.36 0.00 0.00 55.97 53.59 1f0b s LYS 209 Cb -0.06 -1.65 -0.01 0.00 -1.68 0.00 0.00 37.83 34.44 1f0b s LYS 209 CO 0.09 0.43 0.67 0.34 -0.76 0.00 0.00 175.35 176.12 1f0b s ASP 210 N -1.03 6.59 0.19 2.83 -1.08 -1.26 -4.92 116.67 117.99 1f0b s ASP 210 Ca 0.09 0.65 -0.12 0.00 -0.52 0.00 0.00 52.55 52.64 1f0b s ASP 210 Cb -0.09 -2.36 0.21 0.00 -1.46 0.00 0.00 42.92 39.23 1f0b s ASP 210 CO 0.01 -0.46 1.73 1.55 0.52 0.00 0.00 175.17 178.53 1f0b h PRO 211 N 8.00 0.29 -0.44 4.34 0.13 -2.03 -2.72 132.00 139.58 1f0b h PRO 211 Ca -0.26 -0.02 0.08 0.00 -0.87 0.00 0.00 66.00 64.93 1f0b h PRO 211 Cb 1.11 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.15 1f0b h PRO 211 CO 0.81 0.19 0.30 -0.91 -0.23 0.00 0.00 178.00 178.16 1f0b h ASN 212 N 0.30 0.22 -3.15 1.44 4.21 -2.04 -3.44 115.58 113.12 1f0b h ASN 212 Ca 0.26 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 57.22 1f0b h ASN 212 Cb 0.33 -0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.46 1f0b h ASN 212 CO -0.31 0.14 0.64 -0.70 -1.29 0.00 0.00 177.43 175.92 1f0b s GLU 213 N -5.25 4.38 0.05 0.81 2.56 -1.03 -4.98 118.70 115.26 1f0b s GLU 213 Ca -0.07 1.59 0.19 0.00 0.00 0.00 0.00 54.97 56.68 1f0b s GLU 213 Cb 0.19 -3.54 -0.15 0.00 2.00 0.00 0.00 34.13 32.63 1f0b s GLU 213 CO 0.73 -0.39 0.75 1.63 -0.56 0.00 0.00 175.26 177.42 1f0b n LYS 214 N 5.03 0.63 -2.24 4.30 5.02 -1.26 -4.91 118.16 124.73 1f0b n LYS 214 Ca 0.10 0.13 -0.29 0.00 -2.02 0.00 0.00 58.31 56.23 1f0b n LYS 214 Cb 0.47 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 1f0b n LYS 214 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1f0b s ARG 215 N -3.04 3.58 -0.28 1.97 0.52 -1.26 -4.99 118.95 115.44 1f0b s ARG 215 Ca -0.04 0.49 -0.28 0.00 -0.52 0.00 0.00 55.73 55.38 1f0b s ARG 215 Cb 0.09 -2.22 -0.03 0.00 0.52 0.00 0.00 34.95 33.32 1f0b s ARG 215 CO 0.82 -0.39 1.84 0.34 0.02 0.00 0.00 175.30 177.93 1f0b s ASP 216 N -4.13 5.92 0.25 0.23 3.68 -1.26 -4.93 116.67 116.43 1f0b s ASP 216 Ca 0.51 1.50 0.01 0.00 2.13 0.00 0.00 52.55 56.70 1f0b s ASP 216 Cb -0.11 -2.52 -0.00 0.00 -1.45 0.00 0.00 42.92 38.84 1f0b s ASP 216 CO 0.49 -1.65 0.31 0.00 0.13 0.00 0.00 175.17 174.45 1f0b n HIS 217 N 10.12 -1.00 -3.79 -5.34 1.44 -1.26 -0.61 115.22 114.78 1f0b n HIS 217 Ca 0.23 -1.83 -0.13 0.00 -2.01 0.00 0.00 57.72 53.98 1f0b n HIS 217 Cb 0.46 0.35 -0.13 0.00 0.12 0.00 0.00 29.99 30.79 1f0b n HIS 217 CO 0.00 0.00 0.00 1.41 -2.81 0.00 0.00 176.34 174.94 1f0b s MET 218 N -2.71 0.16 -0.22 -1.40 1.75 -0.56 -4.99 119.30 111.31 1f0b s MET 218 Ca 0.24 0.30 -0.09 0.00 -1.25 0.00 0.00 55.69 54.89 1f0b s MET 218 Cb -0.00 -0.02 -0.04 0.00 2.84 0.00 0.00 34.83 37.61 1f0b s MET 218 CO 0.17 -0.08 0.12 0.08 -0.65 0.00 0.00 175.02 174.66 1f0b s VAL 219 N 0.55 5.06 -0.10 10.11 1.01 0.12 -1.56 120.40 135.60 1f0b s VAL 219 Ca -0.04 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1f0b s VAL 219 Cb -0.05 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 33.00 1f0b s VAL 219 CO -0.03 0.38 -0.13 -0.22 0.00 0.00 0.00 175.10 175.11 1f0b s LEU 220 N 0.92 1.59 -0.16 3.92 2.96 0.54 -0.76 118.68 127.69 1f0b s LEU 220 Ca 0.06 -0.36 0.02 0.00 -0.22 0.00 0.00 54.13 53.63 1f0b s LEU 220 Cb -0.13 -0.95 0.01 0.00 0.50 0.00 0.00 46.19 45.61 1f0b s LEU 220 CO 0.03 -0.01 -0.20 -0.22 -1.32 0.00 0.00 176.35 174.63 1f0b s LEU 221 N 1.02 2.17 0.16 -0.68 1.98 -0.96 -1.66 118.68 120.72 1f0b s LEU 221 Ca -0.07 -0.60 0.08 0.00 -2.89 0.00 0.00 54.13 50.65 1f0b s LEU 221 Cb -0.15 -1.47 -0.04 0.00 0.66 0.00 0.00 46.19 45.19 1f0b s LEU 221 CO -0.01 0.05 -0.17 -1.61 -1.89 0.00 0.00 176.35 172.72 1f0b s GLU 222 N 0.97 1.21 -0.10 1.98 2.02 -0.67 -1.08 118.70 123.03 1f0b s GLU 222 Ca -0.03 -1.38 -0.02 0.00 0.02 0.00 0.00 54.97 53.56 1f0b s GLU 222 Cb -0.15 -1.21 0.04 0.00 0.10 0.00 0.00 34.13 32.91 1f0b s GLU 222 CO -0.05 0.24 0.02 -0.06 0.02 0.00 0.00 175.26 175.43 1f0b s PHE 223 N -2.13 0.67 -0.12 1.61 0.08 -0.76 -1.71 117.98 115.62 1f0b s PHE 223 Ca 0.14 -0.30 0.03 0.00 0.12 0.00 0.00 56.93 56.92 1f0b s PHE 223 Cb -0.05 -0.82 -0.00 0.00 -0.57 0.00 0.00 43.02 41.58 1f0b s PHE 223 CO 0.06 -0.40 -0.22 0.08 -0.10 0.00 0.00 175.22 174.64 1f0b s VAL 224 N 1.97 2.24 0.01 -0.44 1.01 0.31 -2.97 120.40 122.53 1f0b s VAL 224 Ca 0.03 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.10 1f0b s VAL 224 Cb -0.14 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 1f0b s VAL 224 CO -0.06 0.55 -0.11 -0.89 0.00 0.00 0.00 175.10 174.59 1f0b s THR 225 N 0.46 0.85 0.11 3.92 2.01 -0.60 -0.90 115.64 121.50 1f0b s THR 225 Ca -0.15 -0.65 -0.19 0.00 0.31 0.00 0.00 61.69 61.01 1f0b s THR 225 Cb -0.17 -0.75 -0.07 0.00 0.01 0.00 0.00 72.50 71.52 1f0b s THR 225 CO 0.06 0.10 0.60 0.00 -0.69 0.00 0.00 174.62 174.70 1f0b s ALA 226 N -0.52 3.55 0.26 7.40 0.00 -0.86 -0.75 121.76 130.85 1f0b s ALA 226 Ca 0.02 0.05 -0.18 0.00 0.00 0.00 0.00 51.96 51.85 1f0b s ALA 226 Cb -0.06 -2.67 0.01 0.00 0.00 0.00 0.00 23.12 20.41 1f0b s ALA 226 CO 0.00 0.39 0.61 0.00 0.00 0.00 0.00 175.76 176.77 1f0b s ALA 227 N -1.23 -0.83 0.00 0.00 0.00 -0.43 -4.55 121.76 114.72 1f0b s ALA 227 Ca 0.33 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1f0b s ALA 227 Cb -0.19 0.93 0.00 0.00 0.00 0.00 0.00 23.12 23.87 1f0b s ALA 227 CO 0.20 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.42 1f0b n GLY 228 N -0.42 2.75 3.61 0.00 0.00 -1.26 0.47 105.19 110.33 1f0b n GLY 228 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1f0b n GLY 228 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1f0b s ILE 229 N -2.47 4.49 0.00 -0.61 1.09 -1.26 -4.71 121.20 117.72 1f0b s ILE 229 Ca 0.00 1.35 0.00 0.00 -1.10 0.00 0.00 60.65 60.90 1f0b s ILE 229 Cb 0.00 -4.41 0.00 0.00 -1.06 0.00 0.00 42.46 36.99 1f0b s ILE 229 CO 0.00 -0.62 0.00 0.41 -0.10 0.00 0.00 174.94 174.63