#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f9b s VAL 17 N 0.00 3.14 0.00 1.39 1.01 0.86 -4.08 120.40 122.72 2f9b s VAL 17 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.34 2f9b s VAL 17 Cb 0.00 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 34.07 2f9b s VAL 17 CO 0.00 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.24 2f9b n GLY 18 N 3.36 1.28 3.60 4.51 0.00 -1.25 -0.86 105.19 115.83 2f9b n GLY 18 Ca -0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 2f9b n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f9b n GLY 19 N -2.00 -0.48 3.77 -0.02 0.00 -1.26 -4.96 105.19 100.24 2f9b n GLY 19 Ca 0.00 -1.86 -0.33 0.00 0.00 0.00 0.00 46.02 43.83 2f9b n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f9b s LYS 20 N -5.33 2.21 0.07 1.61 1.02 -0.94 -4.91 119.74 113.47 2f9b s LYS 20 Ca 0.66 -2.43 -0.21 0.00 0.02 0.00 0.00 55.97 54.02 2f9b s LYS 20 Cb -0.03 -1.48 -0.06 0.00 -0.52 0.00 0.00 37.83 35.74 2f9b s LYS 20 CO 0.45 -0.40 0.61 0.08 -0.92 0.00 0.00 175.35 175.17 2f9b s VAL 21 N -2.91 4.73 -0.40 3.17 1.01 -1.26 -0.86 120.40 123.88 2f9b s VAL 21 Ca 0.03 1.30 -0.29 0.00 0.00 0.00 0.00 61.98 63.03 2f9b s VAL 21 Cb 0.01 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.46 2f9b s VAL 21 CO 0.02 0.51 1.11 0.00 0.00 0.00 0.00 175.10 176.74 2f9b n PRO 23 N 7.36 0.27 -0.24 0.00 -0.02 -1.26 -4.70 135.00 136.42 2f9b n PRO 23 Ca 0.12 0.01 -0.09 0.00 -2.02 0.00 0.00 63.50 61.52 2f9b n PRO 23 Cb 0.48 -1.98 -0.01 0.00 -0.02 0.00 0.00 33.50 31.97 2f9b n PRO 23 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2f9b n LYS 24 N 8.56 0.00 -0.01 -0.52 4.81 -1.26 -0.69 118.16 129.06 2f9b n LYS 24 Ca 0.58 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 2f9b n LYS 24 Cb 0.15 -0.21 0.00 0.00 0.02 0.00 0.00 35.03 34.99 2f9b n LYS 24 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2f9b n GLY 25 N 0.51 0.18 1.18 3.14 0.00 -1.26 -4.92 105.19 104.03 2f9b n GLY 25 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2f9b n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2f9b n GLU 26 N -2.00 2.54 -2.30 1.61 1.02 0.14 -4.24 120.64 117.41 2f9b n GLU 26 Ca 0.00 -2.36 -0.11 0.00 -0.02 0.00 0.00 57.16 54.68 2f9b n GLU 26 Cb 0.00 -1.52 0.04 0.00 -0.02 0.00 0.00 31.44 29.94 2f9b n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2f9b h PRO 28 N 2.27 0.00 -0.53 0.00 0.13 -1.85 0.27 132.00 132.28 2f9b h PRO 28 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2f9b h PRO 28 Cb 1.41 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.54 2f9b h PRO 28 CO 0.43 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.53 2f9b n TRP 29 N -2.47 0.71 -2.76 1.56 2.14 -1.21 -3.29 117.44 112.11 2f9b n TRP 29 Ca -0.02 -0.35 -0.41 0.00 2.07 0.00 0.00 57.50 58.79 2f9b n TRP 29 Cb 0.29 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.76 2f9b n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2f9b s GLN 30 N -1.29 4.58 0.32 -2.67 2.00 0.95 -1.41 119.66 122.14 2f9b s GLN 30 Ca 0.36 1.36 0.09 0.00 -2.00 0.00 0.00 55.36 55.18 2f9b s GLN 30 Cb 0.19 -3.43 -0.05 0.00 0.80 0.00 0.00 33.01 30.52 2f9b s GLN 30 CO 0.25 0.06 -0.01 0.08 -0.50 0.00 0.00 175.29 175.17 2f9b s VAL 31 N 0.64 2.79 -0.04 1.34 1.01 -0.03 -4.48 120.40 121.62 2f9b s VAL 31 Ca 0.48 -2.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.45 2f9b s VAL 31 Cb -0.21 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.44 2f9b s VAL 31 CO 0.27 -0.26 0.04 -0.22 0.00 0.00 0.00 175.10 174.94 2f9b s LEU 32 N -3.69 0.51 0.03 3.92 2.96 -0.99 -2.74 118.68 118.68 2f9b s LEU 32 Ca 0.34 0.03 -0.01 0.00 -0.22 0.00 0.00 54.13 54.27 2f9b s LEU 32 Cb -0.02 -0.19 -0.04 0.00 0.50 0.00 0.00 46.19 46.44 2f9b s LEU 32 CO 0.19 -0.20 0.17 -0.76 -1.32 0.00 0.00 176.35 174.43 2f9b s LEU 33 N 1.79 4.23 0.04 -0.68 1.43 -0.41 -0.74 118.68 124.34 2f9b s LEU 33 Ca 0.01 0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 2f9b s LEU 33 Cb -0.12 -2.69 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 2f9b s LEU 33 CO -0.03 0.22 -0.10 -0.76 0.23 0.00 0.00 176.35 175.91 2f9b s LEU 34 N -2.20 2.19 -0.05 1.79 1.43 0.02 -1.06 118.68 120.81 2f9b s LEU 34 Ca 0.30 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 2f9b s LEU 34 Cb -0.13 -0.34 0.02 0.00 0.03 0.00 0.00 46.19 45.77 2f9b s LEU 34 CO 0.22 -0.07 -0.08 -0.69 0.23 0.00 0.00 176.35 175.96 2f9b s VAL 35 N -0.98 0.78 -0.50 -1.59 1.01 0.95 -1.03 120.40 119.04 2f9b s VAL 35 Ca -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2f9b s VAL 35 Cb -0.08 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.55 2f9b s VAL 35 CO 0.01 0.27 0.00 0.59 0.00 0.00 0.00 175.10 175.97 2f9b n ASN 37 N 3.87 -2.47 0.00 3.32 3.02 -0.76 0.78 115.26 123.02 2f9b n ASN 37 Ca -0.24 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 2f9b n ASN 37 Cb 0.51 -2.10 0.00 0.00 -0.61 0.00 0.00 39.78 37.59 2f9b n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2f9b n GLY 38 N 0.12 2.50 3.82 7.41 0.00 -1.26 -5.06 105.19 112.71 2f9b n GLY 38 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2f9b n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f9b s ALA 39 N -2.43 3.27 0.39 4.61 0.00 0.23 -4.97 121.76 122.88 2f9b s ALA 39 Ca 0.00 0.26 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 2f9b s ALA 39 Cb 0.00 -2.95 -0.11 0.00 0.00 0.00 0.00 23.12 20.06 2f9b s ALA 39 CO 0.00 0.26 1.49 -1.14 0.00 0.00 0.00 175.76 176.36 2f9b s GLN 40 N -2.48 4.02 0.00 0.00 0.74 -1.26 -0.03 119.66 120.64 2f9b s GLN 40 Ca 0.51 2.57 0.00 0.00 0.05 0.00 0.00 55.36 58.49 2f9b s GLN 40 Cb -0.14 -2.91 0.00 0.00 1.10 0.00 0.00 33.01 31.06 2f9b s GLN 40 CO 0.19 -0.61 0.00 -0.11 -0.55 0.00 0.00 175.29 174.22 2f9b n LEU 41 N 0.32 0.00 0.00 3.68 7.94 -0.22 -4.76 117.00 123.96 2f9b n LEU 41 Ca 0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 2f9b n LEU 41 Cb 0.39 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.34 2f9b n LEU 41 CO 0.63 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.91 2f9b n GLY 43 N 2.03 3.62 3.73 0.00 0.00 -0.23 -1.28 105.19 113.06 2f9b n GLY 43 Ca 0.00 -2.26 0.02 0.00 0.00 0.00 0.00 46.02 43.78 2f9b n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2f9b s GLY 44 N -2.29 -0.34 0.10 -0.02 0.00 -1.11 -3.81 107.32 99.85 2f9b s GLY 44 Ca 0.04 0.52 0.10 0.00 0.00 0.00 0.00 44.72 45.38 2f9b s GLY 44 CO 0.03 1.93 -0.25 -1.59 0.00 0.00 0.00 173.10 173.21 2f9b s THR 45 N -2.23 2.09 -0.35 0.90 2.01 0.58 -0.85 115.64 117.79 2f9b s THR 45 Ca 0.19 -1.61 -0.15 0.00 0.31 0.00 0.00 61.69 60.44 2f9b s THR 45 Cb 0.04 -1.84 -0.01 0.00 0.01 0.00 0.00 72.50 70.69 2f9b s THR 45 CO -0.03 0.12 0.34 -0.22 -0.69 0.00 0.00 174.62 174.14 2f9b s LEU 46 N -1.81 4.50 -0.02 4.42 2.96 -0.50 -0.13 118.68 128.09 2f9b s LEU 46 Ca 0.12 -0.31 0.22 0.00 -0.22 0.00 0.00 54.13 53.93 2f9b s LEU 46 Cb -0.10 -2.30 -0.32 0.00 0.50 0.00 0.00 46.19 43.98 2f9b s LEU 46 CO 0.05 -0.33 0.55 2.30 -1.32 0.00 0.00 176.35 177.59 2f9b n ILE 47 N 5.22 0.00 -3.55 6.68 -5.35 -0.15 -0.48 119.36 121.74 2f9b n ILE 47 Ca -0.10 -0.41 -0.06 0.00 -0.27 0.00 0.00 62.75 61.91 2f9b n ILE 47 Cb 0.49 0.19 -0.02 0.00 -1.74 0.00 0.00 39.64 38.56 2f9b n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2f9b s ASN 48 N -4.21 -0.26 0.42 7.28 2.20 -1.07 -4.49 114.94 114.81 2f9b s ASN 48 Ca -0.05 -0.01 0.37 0.00 -0.94 0.00 0.00 52.86 52.23 2f9b s ASN 48 Cb 0.14 0.28 1.34 0.00 -2.00 0.00 0.00 41.25 41.01 2f9b s ASN 48 CO 0.89 -0.46 1.24 0.35 -2.94 0.00 0.00 177.10 176.18 2f9b n THR 49 N -0.19 -0.04 -0.14 0.54 -2.24 -1.26 -0.55 114.28 110.40 2f9b n THR 49 Ca -0.05 1.24 0.00 0.00 -2.27 0.00 0.00 64.05 62.97 2f9b n THR 49 Cb 0.60 -2.06 0.00 0.00 -2.10 0.00 0.00 70.33 66.78 2f9b n THR 49 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2f9b n ILE 50 N -3.69 0.00 -5.24 2.28 -5.35 -1.26 -1.88 119.36 104.22 2f9b n ILE 50 Ca 0.35 -0.43 -0.32 0.00 -0.27 0.00 0.00 62.75 62.08 2f9b n ILE 50 Cb 1.53 1.14 -0.17 0.00 -1.74 0.00 0.00 39.64 40.40 2f9b n ILE 50 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 2f9b s TRP 51 N -0.02 2.48 0.05 4.28 0.52 0.29 -0.41 118.94 126.12 2f9b s TRP 51 Ca 0.00 -0.87 0.06 0.00 0.02 0.00 0.00 56.10 55.30 2f9b s TRP 51 Cb 0.00 -1.64 -0.02 0.00 -1.15 0.00 0.00 33.47 30.65 2f9b s TRP 51 CO 0.00 -0.31 -0.16 0.08 0.02 0.00 0.00 176.95 176.58 2f9b s VAL 52 N 0.08 1.26 -0.02 4.03 1.01 -0.64 -0.98 120.40 125.14 2f9b s VAL 52 Ca -0.11 -1.10 0.04 0.00 0.00 0.00 0.00 61.98 60.82 2f9b s VAL 52 Cb -0.16 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 2f9b s VAL 52 CO 0.06 0.02 -0.13 -0.69 0.00 0.00 0.00 175.10 174.36 2f9b s VAL 53 N -0.90 3.13 0.00 2.92 1.01 0.81 -0.23 120.40 127.14 2f9b s VAL 53 Ca 0.03 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.17 2f9b s VAL 53 Cb -0.08 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 34.02 2f9b s VAL 53 CO 0.02 0.49 0.00 -0.24 0.00 0.00 0.00 175.10 175.36 2f9b n SER 54 N 1.96 0.00 -4.38 3.32 2.88 0.26 -0.31 113.62 117.35 2f9b n SER 54 Ca -0.17 -0.74 -0.43 0.00 -1.33 0.00 0.00 58.87 56.20 2f9b n SER 54 Cb 0.52 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.89 2f9b n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2f9b s ALA 55 N -1.54 3.47 0.16 -1.46 0.00 -1.26 -0.06 121.76 121.07 2f9b s ALA 55 Ca 0.00 -1.99 0.09 0.00 0.00 0.00 0.00 51.96 50.06 2f9b s ALA 55 Cb 0.00 -2.92 0.58 0.00 0.00 0.00 0.00 23.12 20.79 2f9b s ALA 55 CO 0.00 -1.62 0.70 0.00 0.00 0.00 0.00 175.76 174.84 2f9b n ALA 56 N 5.13 0.44 0.24 0.00 0.00 -1.25 -0.75 120.51 124.33 2f9b n ALA 56 Ca -0.12 0.45 0.08 0.00 0.00 0.00 0.00 53.44 53.86 2f9b n ALA 56 Cb 0.45 -0.45 0.59 0.00 0.00 0.00 0.00 19.45 20.04 2f9b n ALA 56 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2f9b h HIS 57 N 0.00 0.00 0.00 0.00 2.07 -1.91 -2.27 115.15 113.04 2f9b h HIS 57 Ca 0.37 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.89 2f9b h HIS 57 Cb 0.97 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.95 2f9b h HIS 57 CO -0.02 0.16 0.14 0.00 -3.07 0.00 0.00 177.93 175.15 2f9b n PHE 59 N -1.57 0.99 0.04 0.00 3.72 -0.85 -4.54 117.46 115.25 2f9b n PHE 59 Ca -0.00 -1.50 -0.10 0.00 -0.05 0.00 0.00 57.45 55.80 2f9b n PHE 59 Cb 0.15 -0.45 -0.13 0.00 -0.94 0.00 0.00 39.48 38.11 2f9b n PHE 59 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2f9b h ASP 60 N 1.06 0.10 -2.21 4.37 3.32 0.25 -3.36 116.42 119.95 2f9b h ASP 60 Ca 0.18 -0.14 -0.58 0.00 0.02 0.00 0.00 57.03 56.51 2f9b h ASP 60 Cb 1.58 -0.03 -0.42 0.00 0.22 0.00 0.00 39.33 40.68 2f9b h ASP 60 CO 0.34 1.12 -0.71 0.29 -1.72 0.00 0.00 179.24 178.56 2f9b n LYS 60 N -3.29 3.01 -4.09 3.56 5.02 -1.26 -5.01 118.16 116.10 2f9b n LYS 60 Ca -0.09 -4.69 -0.33 0.00 -2.02 0.00 0.00 58.31 51.18 2f9b n LYS 60 Cb 1.00 -2.18 -0.16 0.00 -0.02 0.00 0.00 35.03 33.67 2f9b n LYS 60 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2f9b s ILE 60 N -4.31 2.20 -0.07 -0.18 -1.09 -1.26 -4.89 121.20 111.59 2f9b s ILE 60 Ca 0.48 -1.14 0.11 0.00 -2.23 0.00 0.00 60.65 57.87 2f9b s ILE 60 Cb 0.29 -2.05 0.16 0.00 -1.58 0.00 0.00 42.46 39.28 2f9b s ILE 60 CO -0.14 0.34 1.07 2.29 -1.23 0.00 0.00 174.94 177.28 2f9b n LYS 60 N 4.57 0.82 -2.55 2.79 2.85 -1.26 -4.65 118.16 120.74 2f9b n LYS 60 Ca -0.18 -1.90 -0.14 0.00 -1.05 0.00 0.00 58.31 55.04 2f9b n LYS 60 Cb 0.47 -1.08 0.03 0.00 -0.65 0.00 0.00 35.03 33.80 2f9b n LYS 60 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2f9b n ASN 60 N -0.83 2.90 0.08 -5.58 5.03 -1.26 -4.96 115.26 110.64 2f9b n ASN 60 Ca 0.09 -2.99 0.01 0.00 0.87 0.00 0.00 54.58 52.56 2f9b n ASN 60 Cb 0.65 -0.47 0.05 0.00 -1.02 0.00 0.00 39.78 38.99 2f9b n ASN 60 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 2f9b n TRP 61 N -0.40 0.07 0.25 3.10 7.02 -1.26 -0.48 117.44 125.73 2f9b n TRP 61 Ca 0.22 0.03 0.05 0.00 -1.02 0.00 0.00 57.50 56.79 2f9b n TRP 61 Cb 0.80 -0.14 -0.07 0.00 -2.42 0.00 0.00 31.31 29.48 2f9b n TRP 61 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2f9b n ARG 62 N -1.46 2.03 -0.51 -0.99 1.74 -1.26 -4.41 116.66 111.80 2f9b n ARG 62 Ca -0.00 -0.05 -0.10 0.00 -0.77 0.00 0.00 57.85 56.93 2f9b n ARG 62 Cb 0.52 -1.11 0.07 0.00 -1.02 0.00 0.00 32.46 30.91 2f9b n ARG 62 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2f9b n ASN 63 N -1.54 3.50 -4.34 0.55 4.13 0.36 -4.81 115.26 113.12 2f9b n ASN 63 Ca 0.00 -2.66 -0.34 0.00 1.68 0.00 0.00 54.58 53.26 2f9b n ASN 63 Cb 0.21 -0.66 -0.14 0.00 -1.54 0.00 0.00 39.78 37.65 2f9b n ASN 63 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2f9b s LEU 64 N -1.33 2.77 0.24 3.41 2.96 -1.26 -1.82 118.68 123.65 2f9b s LEU 64 Ca 0.23 -0.36 0.05 0.00 -0.22 0.00 0.00 54.13 53.83 2f9b s LEU 64 Cb 0.19 -1.66 -0.05 0.00 0.50 0.00 0.00 46.19 45.17 2f9b s LEU 64 CO 0.04 0.09 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.48 2f9b s ILE 65 N 0.83 1.36 -0.02 6.68 1.01 -0.20 -1.73 121.20 129.14 2f9b s ILE 65 Ca -0.03 -2.09 0.04 0.00 0.00 0.00 0.00 60.65 58.57 2f9b s ILE 65 Cb -0.15 -2.30 -0.01 0.00 0.01 0.00 0.00 42.46 40.01 2f9b s ILE 65 CO 0.01 -0.39 -0.14 0.00 0.00 0.00 0.00 174.94 174.42 2f9b s ALA 66 N -3.20 1.21 0.01 9.38 0.00 0.03 -0.80 121.76 128.39 2f9b s ALA 66 Ca 0.27 -0.60 0.08 0.00 0.00 0.00 0.00 51.96 51.71 2f9b s ALA 66 Cb 0.04 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 2f9b s ALA 66 CO 0.09 0.28 -0.25 0.08 0.00 0.00 0.00 175.76 175.96 2f9b s VAL 67 N -0.24 1.97 0.25 0.00 1.01 0.08 -1.68 120.40 121.79 2f9b s VAL 67 Ca 0.04 -1.17 0.05 0.00 0.00 0.00 0.00 61.98 60.90 2f9b s VAL 67 Cb -0.07 -1.66 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 2f9b s VAL 67 CO -0.00 0.46 -0.04 -0.76 0.00 0.00 0.00 175.10 174.75 2f9b s LEU 68 N -0.84 2.37 0.00 3.92 1.02 0.03 -2.35 118.68 122.83 2f9b s LEU 68 Ca 0.10 -1.18 0.00 0.00 0.02 0.00 0.00 54.13 53.07 2f9b s LEU 68 Cb -0.10 -0.47 0.00 0.00 0.02 0.00 0.00 46.19 45.65 2f9b s LEU 68 CO 0.00 -0.40 0.00 0.61 0.02 0.00 0.00 176.35 176.58 2f9b n GLY 69 N -0.48 2.67 3.47 -3.19 0.00 -1.24 -0.78 105.19 105.65 2f9b n GLY 69 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 2f9b n GLY 69 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2f9b n GLU 70 N -0.51 0.51 0.03 1.61 4.07 -1.26 -4.40 120.64 120.70 2f9b n GLU 70 Ca 0.00 0.20 0.00 0.00 -0.06 0.00 0.00 57.16 57.30 2f9b n GLU 70 Cb 0.00 -1.72 0.00 0.00 -0.06 0.00 0.00 31.44 29.66 2f9b n GLU 70 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65 2f9b n HIS 71 N -1.72 -2.09 -3.40 4.31 -0.00 -1.26 -4.95 115.22 106.10 2f9b n HIS 71 Ca 0.12 0.19 -0.42 0.00 -0.00 0.00 0.00 57.72 57.60 2f9b n HIS 71 Cb 0.48 0.87 -0.09 0.00 -0.00 0.00 0.00 29.99 31.24 2f9b n HIS 71 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2f9b s ASP 72 N -2.04 6.15 0.00 0.26 -1.08 -1.26 -2.22 116.67 116.49 2f9b s ASP 72 Ca 0.00 -0.61 0.15 0.00 -0.52 0.00 0.00 52.55 51.57 2f9b s ASP 72 Cb 0.00 -2.19 0.83 0.00 -1.46 0.00 0.00 42.92 40.10 2f9b s ASP 72 CO 0.00 -0.45 1.37 0.18 0.52 0.00 0.00 175.17 176.79 2f9b n LEU 73 N 5.37 0.00 -0.07 -1.34 4.77 0.68 -3.62 117.00 122.78 2f9b n LEU 73 Ca -0.09 0.15 -0.21 0.00 -0.03 0.00 0.00 56.01 55.82 2f9b n LEU 73 Cb 0.48 -0.15 -0.13 0.00 -2.33 0.00 0.00 43.42 41.30 2f9b n LEU 73 CO 0.42 -0.07 -1.02 -1.54 -1.33 0.00 0.00 177.39 173.84 2f9b n SER 74 N -1.15 2.03 -4.76 -1.43 3.41 -1.26 -4.97 113.62 105.49 2f9b n SER 74 Ca 0.09 0.13 -0.24 0.00 -0.26 0.00 0.00 58.87 58.59 2f9b n SER 74 Cb 0.09 -0.72 -0.06 0.00 -0.26 0.00 0.00 64.21 63.26 2f9b n SER 74 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2f9b s GLU 75 N -2.52 2.73 -0.03 4.33 -1.05 -1.24 -5.11 118.70 115.82 2f9b s GLU 75 Ca -0.29 -1.06 -0.01 0.00 -0.15 0.00 0.00 54.97 53.46 2f9b s GLU 75 Cb 0.08 -2.49 -0.04 0.00 -0.44 0.00 0.00 34.13 31.24 2f9b s GLU 75 CO 0.67 0.43 0.07 -1.58 0.95 0.00 0.00 175.26 175.80 2f9b s HIS 76 N -1.98 3.29 0.22 4.83 5.65 -1.26 -4.78 115.29 121.26 2f9b s HIS 76 Ca 0.31 0.23 0.03 0.00 0.25 0.00 0.00 55.06 55.88 2f9b s HIS 76 Cb -0.09 -1.76 -0.01 0.00 -1.18 0.00 0.00 32.58 29.54 2f9b s HIS 76 CO 0.23 0.55 0.11 -0.40 -0.65 0.00 0.00 174.74 174.58 2f9b n ASP 77 N 1.41 0.58 -4.14 9.88 5.68 -1.26 -5.04 116.55 123.66 2f9b n ASP 77 Ca -0.15 -2.23 -0.43 0.00 -0.50 0.00 0.00 54.79 51.49 2f9b n ASP 77 Cb 0.53 0.71 0.00 0.00 -1.14 0.00 0.00 41.12 41.22 2f9b n ASP 77 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2f9b n GLY 78 N 0.24 4.06 0.60 6.12 0.00 -1.26 -4.27 105.19 110.68 2f9b n GLY 78 Ca -0.01 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.02 2f9b n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f9b n ASP 79 N 5.00 0.00 -4.59 1.61 8.00 -1.26 -5.12 116.55 120.19 2f9b n ASP 79 Ca 0.40 0.00 -0.48 0.00 0.71 0.00 0.00 54.79 55.42 2f9b n ASP 79 Cb 0.40 0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.61 2f9b n ASP 79 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2f9b n GLU 80 N -1.80 1.31 -4.77 -1.24 4.71 -1.26 -4.51 120.64 113.08 2f9b n GLU 80 Ca 0.00 0.47 -0.24 0.00 -0.01 0.00 0.00 57.16 57.37 2f9b n GLU 80 Cb 0.00 -1.96 -0.15 0.00 -1.01 0.00 0.00 31.44 28.31 2f9b n GLU 80 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2f9b s GLN 81 N -0.58 1.41 -0.02 3.49 -0.21 0.04 -4.94 119.66 118.87 2f9b s GLN 81 Ca 0.70 -0.58 0.04 0.00 0.02 0.00 0.00 55.36 55.55 2f9b s GLN 81 Cb -0.80 -1.33 -0.01 0.00 1.00 0.00 0.00 33.01 31.88 2f9b s GLN 81 CO 0.53 0.32 -0.15 -1.12 -2.12 0.00 0.00 175.29 172.75 2f9b s SER 82 N -0.26 1.77 0.02 5.90 0.01 -1.26 -0.79 113.70 119.09 2f9b s SER 82 Ca 0.04 -0.28 0.01 0.00 1.31 0.00 0.00 55.95 57.03 2f9b s SER 82 Cb -0.08 -0.25 -0.01 0.00 0.21 0.00 0.00 66.02 65.88 2f9b s SER 82 CO 0.00 0.17 -0.04 -0.13 0.41 0.00 0.00 173.24 173.65 2f9b s ARG 83 N -0.26 0.33 0.75 12.44 1.81 -0.67 -4.95 118.95 128.39 2f9b s ARG 83 Ca 0.04 -0.47 -0.11 0.00 -1.72 0.00 0.00 55.73 53.47 2f9b s ARG 83 Cb -0.07 -0.11 0.04 0.00 -0.45 0.00 0.00 34.95 34.37 2f9b s ARG 83 CO -0.00 0.01 1.08 1.03 -0.68 0.00 0.00 175.30 176.74 2f9b s ARG 84 N -1.00 2.44 -0.35 3.54 3.00 -1.26 -0.79 118.95 124.54 2f9b s ARG 84 Ca -0.08 0.81 -0.11 0.00 0.00 0.00 0.00 55.73 56.35 2f9b s ARG 84 Cb -0.07 -1.95 0.01 0.00 0.00 0.00 0.00 34.95 32.94 2f9b s ARG 84 CO -0.00 -1.41 0.20 0.08 0.00 0.00 0.00 175.30 174.17 2f9b s VAL 85 N -3.09 4.75 0.06 3.52 1.01 -0.70 -2.29 120.40 123.67 2f9b s VAL 85 Ca 0.60 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 2f9b s VAL 85 Cb -0.14 -3.53 -0.16 0.00 0.00 0.00 0.00 36.38 32.55 2f9b s VAL 85 CO 0.55 -0.09 1.28 0.00 0.00 0.00 0.00 175.10 176.84 2f9b h ALA 86 N 8.43 0.26 -2.67 5.51 0.00 0.08 -3.47 119.26 127.40 2f9b h ALA 86 Ca -0.29 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 53.98 2f9b h ALA 86 Cb 1.13 -0.03 -0.19 0.00 0.00 0.00 0.00 17.79 18.71 2f9b h ALA 86 CO 0.65 0.44 -0.59 -1.14 0.00 0.00 0.00 179.25 178.61 2f9b s GLN 87 N -3.83 0.51 -0.16 0.00 0.74 -0.18 -4.63 119.66 112.11 2f9b s GLN 87 Ca -0.12 -0.74 -0.01 0.00 0.05 0.00 0.00 55.36 54.55 2f9b s GLN 87 Cb 0.07 0.19 0.04 0.00 1.10 0.00 0.00 33.01 34.41 2f9b s GLN 87 CO 0.84 -0.11 -0.05 0.08 -0.55 0.00 0.00 175.29 175.50 2f9b s VAL 88 N -2.33 1.07 -0.13 1.34 1.01 0.12 -0.23 120.40 121.24 2f9b s VAL 88 Ca -0.07 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2f9b s VAL 88 Cb -0.03 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 2f9b s VAL 88 CO -0.04 0.14 -0.14 -0.63 0.00 0.00 0.00 175.10 174.43 2f9b s ILE 89 N 1.65 2.91 0.14 2.22 1.01 0.55 0.29 121.20 129.97 2f9b s ILE 89 Ca 0.01 -0.71 0.09 0.00 0.00 0.00 0.00 60.65 60.04 2f9b s ILE 89 Cb -0.15 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2f9b s ILE 89 CO -0.08 0.52 -0.21 0.27 0.00 0.00 0.00 174.94 175.44 2f9b s ILE 90 N 0.44 1.90 0.43 2.92 -4.36 -0.02 -0.62 121.20 121.88 2f9b s ILE 90 Ca -0.11 -1.75 -0.23 0.00 -0.26 0.00 0.00 60.65 58.31 2f9b s ILE 90 Cb -0.16 -1.77 -0.11 0.00 1.25 0.00 0.00 42.46 41.67 2f9b s ILE 90 CO 0.05 -0.12 0.78 -2.65 0.24 0.00 0.00 174.94 173.24 2f9b n PRO 91 N 0.72 0.93 0.00 0.37 -0.02 -1.26 -1.34 135.00 134.40 2f9b n PRO 91 Ca -0.17 0.34 0.12 0.00 -2.02 0.00 0.00 63.50 61.78 2f9b n PRO 91 Cb 0.55 -1.78 0.74 0.00 -0.02 0.00 0.00 33.50 32.99 2f9b n PRO 91 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2f9b n SER 92 N 0.82 0.00 -0.55 2.55 3.41 0.70 -2.74 113.62 117.80 2f9b n SER 92 Ca 0.11 -1.20 0.10 0.00 -0.26 0.00 0.00 58.87 57.62 2f9b n SER 92 Cb 0.39 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.37 2f9b n SER 92 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2f9b n THR 93 N -0.89 0.00 -2.50 6.66 -2.24 -1.26 -4.96 114.28 109.09 2f9b n THR 93 Ca 0.19 -0.35 -0.34 0.00 -2.27 0.00 0.00 64.05 61.28 2f9b n THR 93 Cb 0.09 1.29 -0.03 0.00 -2.10 0.00 0.00 70.33 69.57 2f9b n THR 93 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2f9b s TYR 94 N -2.11 2.99 -0.15 4.78 5.04 -1.11 -4.85 117.35 121.95 2f9b s TYR 94 Ca 0.19 1.57 0.02 0.00 -2.44 0.00 0.00 57.07 56.41 2f9b s TYR 94 Cb 0.16 -3.07 0.01 0.00 0.35 0.00 0.00 41.96 39.42 2f9b s TYR 94 CO 0.44 -0.87 -0.21 0.08 -1.34 0.00 0.00 175.55 173.64 2f9b s VAL 95 N -2.01 2.03 -0.77 3.14 1.01 -1.26 -5.03 120.40 117.51 2f9b s VAL 95 Ca 0.67 -0.95 -0.32 0.00 0.00 0.00 0.00 61.98 61.38 2f9b s VAL 95 Cb -0.16 -1.80 -0.17 0.00 0.00 0.00 0.00 36.38 34.24 2f9b s VAL 95 CO 0.21 0.54 2.53 -2.65 0.00 0.00 0.00 175.10 175.73 2f9b n PRO 96 N 4.20 0.35 0.00 2.72 -0.02 -1.26 -0.74 135.00 140.25 2f9b n PRO 96 Ca -0.20 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2f9b n PRO 96 Cb 0.51 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 2f9b n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f9b n GLY 97 N 6.49 1.01 0.80 -1.23 0.00 -1.26 -5.11 105.19 105.89 2f9b n GLY 97 Ca 0.56 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.53 2f9b n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f9b n THR 98 N -0.34 0.00 0.12 2.61 -2.24 0.08 -5.04 114.28 109.48 2f9b n THR 98 Ca 0.00 -0.44 0.01 0.00 -2.27 0.00 0.00 64.05 61.35 2f9b n THR 98 Cb 0.00 -0.53 -0.00 0.00 -2.10 0.00 0.00 70.33 67.69 2f9b n THR 98 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2f9b n THR 99 N -0.90 0.00 -3.39 4.28 -2.24 -1.26 -4.82 114.28 105.95 2f9b n THR 99 Ca 0.01 -0.47 -0.37 0.00 -2.27 0.00 0.00 64.05 60.94 2f9b n THR 99 Cb 0.13 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.33 2f9b n THR 99 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2f9b s ASN 100 N -0.72 6.60 -0.62 3.42 3.04 -1.26 -3.68 114.94 121.72 2f9b s ASN 100 Ca 0.02 0.71 -0.03 0.00 0.04 0.00 0.00 52.86 53.60 2f9b s ASN 100 Cb 0.02 -2.25 0.00 0.00 -1.54 0.00 0.00 41.25 37.48 2f9b s ASN 100 CO 0.07 0.03 0.54 1.41 -3.04 0.00 0.00 177.10 176.10 2f9b n HIS 101 N 3.68 -1.28 -2.63 0.43 8.25 -1.26 -4.19 115.22 118.22 2f9b n HIS 101 Ca -0.09 0.47 -0.43 0.00 -0.26 0.00 0.00 57.72 57.41 2f9b n HIS 101 Cb 0.52 -3.04 0.00 0.00 1.12 0.00 0.00 29.99 28.59 2f9b n HIS 101 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2f9b n ASP 102 N -0.97 5.16 -3.86 0.41 2.03 -1.24 -4.56 116.55 113.53 2f9b n ASP 102 Ca -0.03 -3.05 -0.12 0.00 0.52 0.00 0.00 54.79 52.12 2f9b n ASP 102 Cb 0.54 -1.52 -0.11 0.00 -0.72 0.00 0.00 41.12 39.31 2f9b n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2f9b s ILE 103 N 0.95 0.05 -0.02 5.18 2.07 -1.26 -4.14 121.20 124.02 2f9b s ILE 103 Ca 0.41 -0.41 -0.04 0.00 -1.41 0.00 0.00 60.65 59.20 2f9b s ILE 103 Cb 0.04 -0.32 0.00 0.00 0.13 0.00 0.00 42.46 42.31 2f9b s ILE 103 CO 0.00 -0.22 0.10 0.00 -1.91 0.00 0.00 174.94 172.91 2f9b s ALA 104 N -0.76 -0.24 -0.15 1.50 0.00 0.92 -3.81 121.76 119.23 2f9b s ALA 104 Ca -0.08 0.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.95 2f9b s ALA 104 Cb -0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 2f9b s ALA 104 CO 0.01 -0.11 -0.12 -1.17 0.00 0.00 0.00 175.76 174.38 2f9b s LEU 105 N -0.51 2.74 -0.12 0.00 2.96 0.21 -0.57 118.68 123.39 2f9b s LEU 105 Ca -0.06 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.52 2f9b s LEU 105 Cb -0.04 -1.63 -0.01 0.00 0.50 0.00 0.00 46.19 45.01 2f9b s LEU 105 CO 0.00 0.13 -0.15 -0.76 -1.32 0.00 0.00 176.35 174.26 2f9b s LEU 106 N 0.56 2.64 -0.29 -0.68 1.02 0.68 -0.33 118.68 122.27 2f9b s LEU 106 Ca -0.07 -0.34 -0.10 0.00 0.02 0.00 0.00 54.13 53.63 2f9b s LEU 106 Cb -0.15 -1.58 -0.03 0.00 0.02 0.00 0.00 46.19 44.44 2f9b s LEU 106 CO 0.03 0.18 0.17 -0.60 0.02 0.00 0.00 176.35 176.16 2f9b s ARG 107 N 0.23 3.73 0.89 1.70 3.52 0.68 -1.63 118.95 128.09 2f9b s ARG 107 Ca -0.10 -0.46 -0.15 0.00 -0.13 0.00 0.00 55.73 54.90 2f9b s ARG 107 Cb -0.16 -3.60 0.22 0.00 -1.56 0.00 0.00 34.95 29.86 2f9b s ARG 107 CO 0.06 -0.26 0.82 1.28 -0.81 0.00 0.00 175.30 176.39 2f9b n LEU 108 N 5.03 0.00 -0.09 -0.88 4.77 0.45 0.63 117.00 126.91 2f9b n LEU 108 Ca -0.14 -0.88 -0.22 0.00 -0.03 0.00 0.00 56.01 54.74 2f9b n LEU 108 Cb 0.51 -0.74 -0.12 0.00 -2.33 0.00 0.00 43.42 40.74 2f9b n LEU 108 CO 0.33 -1.81 -1.09 1.57 -1.33 0.00 0.00 177.39 175.06 2f9b n HIS 109 N -4.17 0.52 -4.12 -1.77 -0.00 -0.97 -3.90 115.22 100.81 2f9b n HIS 109 Ca 0.11 0.15 -0.15 0.00 -0.00 0.00 0.00 57.72 57.83 2f9b n HIS 109 Cb 0.43 -1.06 -0.12 0.00 -0.00 0.00 0.00 29.99 29.24 2f9b n HIS 109 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 2f9b s GLN 110 N -2.50 0.60 1.21 1.57 -1.52 -1.26 -5.02 119.66 112.73 2f9b s GLN 110 Ca -0.31 -0.72 -0.15 0.00 -1.95 0.00 0.00 55.36 52.22 2f9b s GLN 110 Cb 0.09 -0.45 0.27 0.00 -0.22 0.00 0.00 33.01 32.70 2f9b s GLN 110 CO 0.62 0.09 0.75 -0.35 -0.25 0.00 0.00 175.29 176.16 2f9b n PRO 111 N 1.65 -2.65 -3.79 2.91 -0.04 -1.26 -4.86 135.00 126.95 2f9b n PRO 111 Ca -0.21 -0.75 -0.23 0.00 -0.04 0.00 0.00 63.50 62.27 2f9b n PRO 111 Cb 0.55 -2.01 -0.04 0.00 -0.04 0.00 0.00 33.50 31.96 2f9b n PRO 111 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2f9b s VAL 112 N -2.32 2.32 -0.21 0.52 -7.23 -0.79 -4.99 120.40 107.71 2f9b s VAL 112 Ca 0.65 -1.47 -0.04 0.00 -1.81 0.00 0.00 61.98 59.31 2f9b s VAL 112 Cb -0.21 -2.79 -0.01 0.00 0.56 0.00 0.00 36.38 33.93 2f9b s VAL 112 CO 0.65 0.00 -0.04 -0.69 -0.31 0.00 0.00 175.10 174.70 2f9b s VAL 113 N -2.58 3.47 0.58 1.32 1.01 -1.26 -4.88 120.40 118.06 2f9b s VAL 113 Ca 0.43 -0.47 -0.18 0.00 0.00 0.00 0.00 61.98 61.76 2f9b s VAL 113 Cb -0.01 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 2f9b s VAL 113 CO 0.25 0.43 1.11 -0.76 0.00 0.00 0.00 175.10 176.13 2f9b s LEU 114 N 1.27 3.61 0.34 3.92 1.43 -1.26 -4.81 118.68 123.18 2f9b s LEU 114 Ca 0.03 2.08 -0.17 0.00 -1.03 0.00 0.00 54.13 55.04 2f9b s LEU 114 Cb -0.14 -4.57 0.05 0.00 0.03 0.00 0.00 46.19 41.56 2f9b s LEU 114 CO -0.01 -1.33 0.80 0.42 0.23 0.00 0.00 176.35 176.46 2f9b s THR 115 N -2.02 0.00 0.25 5.49 -4.23 0.48 -4.93 115.64 110.67 2f9b s THR 115 Ca 0.70 -0.95 0.28 0.00 -1.18 0.00 0.00 61.69 60.53 2f9b s THR 115 Cb -0.22 -2.71 0.28 0.00 1.34 0.00 0.00 72.50 71.19 2f9b s THR 115 CO 0.32 0.00 1.84 0.44 -0.54 0.00 0.00 174.62 176.68 2f9b h ASP 116 N 2.00 0.00 -0.32 3.99 5.19 -2.00 0.82 116.42 126.10 2f9b h ASP 116 Ca -0.29 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.12 2f9b h ASP 116 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 2f9b h ASP 116 CO 0.37 0.00 0.00 1.41 -3.12 0.00 0.00 179.24 177.90 2f9b n HIS 117 N -2.56 0.54 -3.35 4.55 8.25 -1.26 -4.86 115.22 116.52 2f9b n HIS 117 Ca -0.02 -0.57 -0.06 0.00 -0.26 0.00 0.00 57.72 56.81 2f9b n HIS 117 Cb 0.16 -0.08 -0.07 0.00 1.12 0.00 0.00 29.99 31.13 2f9b n HIS 117 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2f9b s VAL 118 N -1.35 -0.71 0.03 1.59 1.01 0.28 -3.66 120.40 117.59 2f9b s VAL 118 Ca 0.26 -0.02 -0.06 0.00 0.00 0.00 0.00 61.98 62.16 2f9b s VAL 118 Cb 0.16 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.69 2f9b s VAL 118 CO 0.14 -0.07 0.12 -0.69 0.00 0.00 0.00 175.10 174.60 2f9b s VAL 119 N 2.63 0.11 0.61 2.92 1.01 -1.21 -0.39 120.40 126.09 2f9b s VAL 119 Ca 0.12 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 2f9b s VAL 119 Cb -0.15 -0.71 0.04 0.00 0.00 0.00 0.00 36.38 35.56 2f9b s VAL 119 CO -0.17 -0.51 0.89 -2.16 0.00 0.00 0.00 175.10 173.16 2f9b s PRO 120 N -2.14 2.53 -0.13 2.72 0.05 -1.26 -3.36 135.00 133.41 2f9b s PRO 120 Ca -0.09 -0.36 -0.06 0.00 0.05 0.00 0.00 61.00 60.54 2f9b s PRO 120 Cb -0.04 -2.31 -0.04 0.00 0.05 0.00 0.00 34.50 32.16 2f9b s PRO 120 CO -0.02 -0.89 0.09 -1.17 0.05 0.00 0.00 177.00 175.05 2f9b s LEU 121 N -5.00 4.04 0.20 -3.56 2.96 0.37 -4.88 118.68 112.82 2f9b s LEU 121 Ca 0.57 0.29 -0.30 0.00 -0.22 0.00 0.00 54.13 54.47 2f9b s LEU 121 Cb -0.11 -1.98 -0.08 0.00 0.50 0.00 0.00 46.19 44.52 2f9b s LEU 121 CO 0.42 0.34 1.24 0.00 -1.32 0.00 0.00 176.35 177.03 2f9b s LEU 123 N -0.34 4.35 0.91 0.00 2.96 -1.26 -1.32 118.68 123.98 2f9b s LEU 123 Ca 0.53 -0.02 -0.13 0.00 -0.22 0.00 0.00 54.13 54.30 2f9b s LEU 123 Cb -0.34 -2.65 0.14 0.00 0.50 0.00 0.00 46.19 43.83 2f9b s LEU 123 CO 0.38 -0.54 1.18 -2.16 -1.32 0.00 0.00 176.35 173.89 2f9b s PRO 124 N 2.52 1.15 -0.06 0.98 0.04 -1.26 -4.97 135.00 133.39 2f9b s PRO 124 Ca 0.21 0.07 -0.23 0.00 0.04 0.00 0.00 61.00 61.09 2f9b s PRO 124 Cb -0.15 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 2f9b s PRO 124 CO 0.14 -2.15 0.68 -2.00 0.04 0.00 0.00 177.00 173.71 2f9b s GLU 125 N -5.50 4.43 0.07 4.56 2.12 -1.26 -4.91 118.70 118.20 2f9b s GLU 125 Ca 0.66 0.85 -0.13 0.00 0.36 0.00 0.00 54.97 56.71 2f9b s GLU 125 Cb -0.11 -3.43 -0.03 0.00 0.26 0.00 0.00 34.13 30.82 2f9b s GLU 125 CO 0.52 0.10 0.92 -2.13 -0.54 0.00 0.00 175.26 174.13 2f9b n ARG 126 N 3.65 -0.18 -0.22 4.30 0.63 -1.26 -0.51 116.66 123.07 2f9b n ARG 126 Ca -0.02 0.91 0.00 0.00 -0.92 0.00 0.00 57.85 57.82 2f9b n ARG 126 Cb 0.51 -1.34 0.08 0.00 0.45 0.00 0.00 32.46 32.17 2f9b n ARG 126 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 2f9b h THR 127 N 0.00 0.38 -0.22 5.15 1.35 -1.94 0.29 112.91 117.92 2f9b h THR 127 Ca 0.07 -0.01 -0.03 0.00 -0.55 0.00 0.00 66.41 65.89 2f9b h THR 127 Cb 0.17 0.35 -0.01 0.00 -1.73 0.00 0.00 68.15 66.92 2f9b h THR 127 CO -0.39 0.01 0.01 0.15 -0.25 0.00 0.00 175.52 175.05 2f9b h PHE 128 N 0.03 0.32 0.21 4.73 3.57 -1.19 0.10 116.94 124.71 2f9b h PHE 128 Ca 0.32 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.79 2f9b h PHE 128 Cb 0.51 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.15 2f9b h PHE 128 CO -0.48 0.33 -0.10 1.03 -2.23 0.00 0.00 178.31 176.86 2f9b h SER 129 N 0.32 -0.23 -0.92 0.41 0.87 0.90 0.79 113.55 115.69 2f9b h SER 129 Ca 0.07 0.01 0.18 0.00 -1.23 0.00 0.00 61.79 60.82 2f9b h SER 129 Cb 0.20 0.06 -0.10 0.00 -0.44 0.00 0.00 62.40 62.12 2f9b h SER 129 CO 0.00 -0.12 0.49 -0.33 -0.53 0.00 0.00 176.83 176.35 2f9b h GLU 129 N -0.37 0.61 0.00 2.24 5.08 -0.80 -0.60 114.58 120.73 2f9b h GLU 129 Ca -0.03 -0.04 -0.21 0.00 -1.00 0.00 0.00 59.36 58.08 2f9b h GLU 129 Cb 0.21 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 2f9b h GLU 129 CO 0.05 0.41 -1.86 -2.13 -1.00 0.00 0.00 179.01 174.47 2f9b n ARG 129 N -4.87 0.65 0.00 2.33 0.63 0.34 -4.59 116.66 111.16 2f9b n ARG 129 Ca 0.20 0.08 0.00 0.00 -0.92 0.00 0.00 57.85 57.21 2f9b n ARG 129 Cb 0.53 -1.66 0.00 0.00 0.45 0.00 0.00 32.46 31.78 2f9b n ARG 129 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 2f9b n THR 129 N -2.74 0.00 -0.20 5.15 -1.04 0.07 -4.80 114.28 110.72 2f9b n THR 129 Ca -0.17 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.78 2f9b n THR 129 Cb 0.91 -1.43 0.10 0.00 -1.82 0.00 0.00 70.33 68.10 2f9b n THR 129 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2f9b h LEU 129 N 0.00 0.95 -0.08 -4.42 3.38 -0.38 -2.95 115.31 111.82 2f9b h LEU 129 Ca 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2f9b h LEU 129 Cb 0.98 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2f9b h LEU 129 CO 0.00 0.94 0.00 0.00 0.09 0.00 0.00 178.44 179.47 2f9b n ALA 129 N -2.46 1.00 -1.64 1.53 0.00 -0.29 -1.82 120.51 116.83 2f9b n ALA 129 Ca 0.04 0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.55 2f9b n ALA 129 Cb 0.27 -1.02 0.19 0.00 0.00 0.00 0.00 19.45 18.89 2f9b n ALA 129 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2f9b n PHE 129 N -1.54 0.00 -3.72 0.00 3.72 -1.11 -4.88 117.46 109.93 2f9b n PHE 129 Ca -0.00 -1.37 -0.37 0.00 -0.05 0.00 0.00 57.45 55.66 2f9b n PHE 129 Cb 0.00 -0.23 -0.11 0.00 -0.94 0.00 0.00 39.48 38.20 2f9b n PHE 129 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2f9b s VAL 129 N -2.92 5.05 0.02 -4.37 1.01 -0.76 -5.01 120.40 113.42 2f9b s VAL 129 Ca 0.37 0.07 -0.25 0.00 0.00 0.00 0.00 61.98 62.17 2f9b s VAL 129 Cb 0.36 -3.36 -0.18 0.00 0.00 0.00 0.00 36.38 33.20 2f9b s VAL 129 CO -0.07 0.34 1.42 -0.09 0.00 0.00 0.00 175.10 176.70 2f9b h ARG 134 N 7.76 -0.02 -5.74 2.72 2.43 -1.90 -3.45 114.38 116.18 2f9b h ARG 134 Ca -0.37 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.13 2f9b h ARG 134 Cb 1.18 0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 30.62 2f9b h ARG 134 CO 0.62 0.29 -0.54 -0.06 -1.51 0.00 0.00 179.97 178.77 2f9b s PHE 135 N -4.91 3.40 0.21 2.20 0.08 -1.26 -1.78 117.98 115.92 2f9b s PHE 135 Ca -0.15 0.37 0.01 0.00 0.12 0.00 0.00 56.93 57.28 2f9b s PHE 135 Cb 0.03 -1.89 -0.05 0.00 -0.57 0.00 0.00 43.02 40.54 2f9b s PHE 135 CO 0.66 0.59 0.06 -1.12 -0.10 0.00 0.00 175.22 175.31 2f9b s SER 136 N -0.85 1.09 0.00 1.36 0.01 -0.84 -4.60 113.70 109.87 2f9b s SER 136 Ca 0.13 -1.29 0.04 0.00 1.31 0.00 0.00 55.95 56.15 2f9b s SER 136 Cb -0.12 0.16 -0.03 0.00 0.21 0.00 0.00 66.02 66.24 2f9b s SER 136 CO 0.03 -0.67 -0.11 -0.76 0.41 0.00 0.00 173.24 172.14 2f9b s LEU 137 N -3.23 2.93 0.07 2.44 1.43 -0.67 -0.92 118.68 120.72 2f9b s LEU 137 Ca 0.31 -0.23 0.08 0.00 -1.03 0.00 0.00 54.13 53.27 2f9b s LEU 137 Cb 0.07 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 2f9b s LEU 137 CO 0.09 0.29 -0.22 0.68 0.23 0.00 0.00 176.35 177.42 2f9b s VAL 138 N -0.92 1.76 0.12 -1.59 -7.23 -0.13 -1.01 120.40 111.41 2f9b s VAL 138 Ca 0.15 -1.35 -0.05 0.00 -1.81 0.00 0.00 61.98 58.92 2f9b s VAL 138 Cb -0.11 -1.55 -0.02 0.00 0.56 0.00 0.00 36.38 35.26 2f9b s VAL 138 CO 0.05 0.14 0.13 -0.94 -0.31 0.00 0.00 175.10 174.17 2f9b s SER 139 N -1.44 0.23 0.00 4.85 1.04 -1.24 -0.18 113.70 116.95 2f9b s SER 139 Ca 0.08 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.54 2f9b s SER 139 Cb -0.09 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.35 2f9b s SER 139 CO 0.03 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.10 2f9b n GLY 140 N -0.09 -0.71 2.61 7.32 0.00 0.50 -4.57 105.19 110.24 2f9b n GLY 140 Ca -0.09 -1.19 -0.24 0.00 0.00 0.00 0.00 46.02 44.50 2f9b n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2f9b n TRP 141 N -0.64 3.06 -3.71 1.61 8.01 -1.26 -1.20 117.44 123.31 2f9b n TRP 141 Ca 0.00 -3.36 -0.25 0.00 -1.31 0.00 0.00 57.50 52.59 2f9b n TRP 141 Cb 0.00 -0.25 0.02 0.00 -2.01 0.00 0.00 31.31 29.06 2f9b n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2f9b n GLY 142 N -0.31 2.58 3.58 6.99 0.00 -1.26 -3.65 105.19 113.12 2f9b n GLY 142 Ca 0.32 -2.28 -0.45 0.00 0.00 0.00 0.00 46.02 43.61 2f9b n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2f9b n GLN 143 N -1.89 1.25 0.00 1.61 6.02 0.70 -2.94 117.38 122.14 2f9b n GLN 143 Ca 0.02 0.44 0.13 0.00 -0.01 0.00 0.00 57.00 57.58 2f9b n GLN 143 Cb 0.62 -1.78 0.42 0.00 1.02 0.00 0.00 30.24 30.52 2f9b n GLN 143 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2f9b n LEU 144 N 1.28 1.32 -3.62 1.08 4.77 0.08 -0.63 117.00 121.28 2f9b n LEU 144 Ca 0.10 -0.40 -0.16 0.00 -0.03 0.00 0.00 56.01 55.52 2f9b n LEU 144 Cb 0.31 -0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.27 2f9b n LEU 144 CO 0.60 0.23 0.28 -0.76 -1.33 0.00 0.00 177.39 176.40 2f9b s LEU 145 N -2.28 -0.09 0.05 2.23 1.43 -1.26 -4.44 118.68 114.32 2f9b s LEU 145 Ca 0.30 0.59 0.01 0.00 -1.03 0.00 0.00 54.13 53.99 2f9b s LEU 145 Cb 0.20 2.03 0.14 0.00 0.03 0.00 0.00 46.19 48.59 2f9b s LEU 145 CO 0.44 -0.49 0.27 -0.67 0.23 0.00 0.00 176.35 176.13 2f9b n ASP 146 N 1.34 -0.01 -2.59 2.29 -0.08 -1.26 -0.30 116.55 115.93 2f9b n ASP 146 Ca -0.19 0.29 -0.00 0.00 -1.51 0.00 0.00 54.79 53.38 2f9b n ASP 146 Cb 0.56 -0.11 0.05 0.00 2.34 0.00 0.00 41.12 43.96 2f9b n ASP 146 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2f9b n ARG 147 N -3.93 1.51 -0.61 -0.67 1.74 -1.26 -4.86 116.66 108.57 2f9b n ARG 147 Ca 0.04 -3.28 0.00 0.00 -0.77 0.00 0.00 57.85 53.84 2f9b n ARG 147 Cb 0.14 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.21 2f9b n ARG 147 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f9b n GLY 149 N -0.43 1.78 3.76 -0.13 0.00 0.58 -5.06 105.19 105.69 2f9b n GLY 149 Ca 0.08 -2.08 -0.37 0.00 0.00 0.00 0.00 46.02 43.65 2f9b n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f9b s ALA 150 N -2.10 2.80 0.88 4.61 0.00 -1.26 -4.51 121.76 122.18 2f9b s ALA 150 Ca 0.00 1.13 -0.13 0.00 0.00 0.00 0.00 51.96 52.96 2f9b s ALA 150 Cb 0.00 -3.48 0.14 0.00 0.00 0.00 0.00 23.12 19.78 2f9b s ALA 150 CO 0.00 -1.10 1.24 0.95 0.00 0.00 0.00 175.76 176.85 2f9b s THR 151 N -1.45 2.02 0.48 0.00 -4.23 -1.26 -0.74 115.64 110.46 2f9b s THR 151 Ca 0.71 -0.04 0.08 0.00 -1.18 0.00 0.00 61.69 61.25 2f9b s THR 151 Cb -0.34 -2.98 0.03 0.00 1.34 0.00 0.00 72.50 70.54 2f9b s THR 151 CO 0.40 0.00 0.55 0.00 -0.54 0.00 0.00 174.62 175.03 2f9b s ALA 152 N -3.71 4.43 -0.05 3.99 0.00 -1.15 -4.76 121.76 120.51 2f9b s ALA 152 Ca 0.68 -1.80 -0.01 0.00 0.00 0.00 0.00 51.96 50.83 2f9b s ALA 152 Cb -0.07 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.75 2f9b s ALA 152 CO 0.51 -0.44 -0.06 1.28 0.00 0.00 0.00 175.76 177.04 2f9b n LEU 153 N -1.86 1.53 -4.91 0.00 4.77 -1.26 -4.78 117.00 110.50 2f9b n LEU 153 Ca 0.07 0.02 -0.27 0.00 -0.03 0.00 0.00 56.01 55.81 2f9b n LEU 153 Cb 0.61 -0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 2f9b n LEU 153 CO 0.40 0.32 0.34 -1.61 -1.33 0.00 0.00 177.39 175.51 2f9b s GLU 154 N -2.10 3.59 0.24 3.23 2.02 -1.26 -0.23 118.70 124.19 2f9b s GLU 154 Ca -0.07 0.09 -0.30 0.00 0.02 0.00 0.00 54.97 54.72 2f9b s GLU 154 Cb 0.02 -2.50 -0.09 0.00 0.10 0.00 0.00 34.13 31.67 2f9b s GLU 154 CO 0.10 -0.01 1.07 -1.17 0.02 0.00 0.00 175.26 175.27 2f9b s LEU 155 N -4.24 4.55 -0.05 1.80 2.96 -0.94 -4.76 118.68 118.00 2f9b s LEU 155 Ca 0.46 2.15 0.05 0.00 -0.22 0.00 0.00 54.13 56.56 2f9b s LEU 155 Cb -0.10 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 42.95 2f9b s LEU 155 CO 0.37 -0.11 -0.18 -0.04 -1.32 0.00 0.00 176.35 175.08 2f9b s MET 156 N -1.06 2.43 -0.00 1.98 -1.94 -0.34 -0.05 119.30 120.33 2f9b s MET 156 Ca 0.45 -0.78 0.06 0.00 -1.71 0.00 0.00 55.69 53.71 2f9b s MET 156 Cb -0.30 -2.28 -0.02 0.00 2.01 0.00 0.00 34.83 34.25 2f9b s MET 156 CO 0.37 0.57 -0.18 0.54 -0.01 0.00 0.00 175.02 176.31 2f9b s VAL 157 N -0.61 1.43 -0.04 -6.03 0.11 -0.04 -0.37 120.40 114.84 2f9b s VAL 157 Ca 0.09 -0.83 0.06 0.00 -2.93 0.00 0.00 61.98 58.37 2f9b s VAL 157 Cb -0.11 -1.20 -0.01 0.00 -1.53 0.00 0.00 36.38 33.53 2f9b s VAL 157 CO 0.00 0.35 -0.23 -0.22 -3.33 0.00 0.00 175.10 171.68 2f9b s LEU 158 N -0.55 2.04 -0.32 2.54 2.96 0.75 -2.20 118.68 123.89 2f9b s LEU 158 Ca 0.07 -0.46 -0.12 0.00 -0.22 0.00 0.00 54.13 53.39 2f9b s LEU 158 Cb -0.07 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.33 2f9b s LEU 158 CO -0.00 0.24 0.22 0.21 -1.32 0.00 0.00 176.35 175.70 2f9b s ASN 159 N -0.24 6.04 0.20 3.68 3.04 -1.26 -0.95 114.94 125.45 2f9b s ASN 159 Ca 0.00 -0.27 0.10 0.00 0.04 0.00 0.00 52.86 52.74 2f9b s ASN 159 Cb -0.12 -2.13 -0.04 0.00 -1.54 0.00 0.00 41.25 37.41 2f9b s ASN 159 CO 0.02 -0.17 -0.17 0.68 -3.04 0.00 0.00 177.10 174.42 2f9b s VAL 160 N 1.74 2.73 0.19 -5.21 -7.23 -0.10 -4.92 120.40 107.59 2f9b s VAL 160 Ca 0.06 -1.93 -0.17 0.00 -1.81 0.00 0.00 61.98 58.13 2f9b s VAL 160 Cb -0.17 -2.35 -0.08 0.00 0.56 0.00 0.00 36.38 34.35 2f9b s VAL 160 CO 0.11 -0.16 0.64 -2.16 -0.31 0.00 0.00 175.10 173.22 2f9b s PRO 161 N -2.87 4.11 0.18 4.82 0.04 -1.26 -1.99 135.00 138.04 2f9b s PRO 161 Ca 0.24 0.68 0.04 0.00 0.04 0.00 0.00 61.00 61.99 2f9b s PRO 161 Cb -0.08 -2.90 -0.03 0.00 0.04 0.00 0.00 34.50 31.53 2f9b s PRO 161 CO 0.13 0.43 0.31 0.50 0.04 0.00 0.00 177.00 178.41 2f9b s ARG 162 N -1.98 3.42 0.17 4.56 3.52 -0.74 -1.57 118.95 126.33 2f9b s ARG 162 Ca 0.41 -0.67 0.04 0.00 -0.13 0.00 0.00 55.73 55.37 2f9b s ARG 162 Cb -0.16 -2.92 -0.05 0.00 -1.56 0.00 0.00 34.95 30.26 2f9b s ARG 162 CO 0.20 0.48 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.60 2f9b s LEU 163 N -3.52 2.41 0.14 -0.88 1.02 -0.14 -4.96 118.68 112.77 2f9b s LEU 163 Ca 0.34 -1.08 -0.03 0.00 0.02 0.00 0.00 54.13 53.39 2f9b s LEU 163 Cb -0.10 -0.30 -0.05 0.00 0.02 0.00 0.00 46.19 45.76 2f9b s LEU 163 CO 0.28 -0.40 0.35 -0.04 0.02 0.00 0.00 176.35 176.57 2f9b s MET 164 N -3.79 3.56 0.28 1.70 -1.94 -1.26 -4.10 119.30 113.75 2f9b s MET 164 Ca 0.20 -0.21 -0.05 0.00 -1.71 0.00 0.00 55.69 53.92 2f9b s MET 164 Cb 0.04 -2.88 0.52 0.00 2.01 0.00 0.00 34.83 34.52 2f9b s MET 164 CO 0.03 0.47 1.58 1.15 -0.01 0.00 0.00 175.02 178.24 2f9b h THR 165 N 1.92 0.10 -0.53 2.05 2.02 -1.94 0.13 112.91 116.66 2f9b h THR 165 Ca -0.46 -0.01 0.11 0.00 0.77 0.00 0.00 66.41 66.82 2f9b h THR 165 Cb 1.17 0.08 -0.10 0.00 -1.74 0.00 0.00 68.15 67.56 2f9b h THR 165 CO 0.72 0.00 -0.13 1.56 0.37 0.00 0.00 175.52 178.04 2f9b h GLN 166 N 0.02 -0.00 0.00 6.66 4.20 -1.99 0.21 115.11 124.21 2f9b h GLN 166 Ca 0.49 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.16 2f9b h GLN 166 Cb 0.85 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.63 2f9b h GLN 166 CO -0.90 -0.00 -0.16 -0.44 -0.67 0.00 0.00 178.83 176.66 2f9b h ASP 167 N -0.00 0.00 0.17 1.46 3.32 -1.39 -3.28 116.42 116.70 2f9b h ASP 167 Ca 0.25 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 2f9b h ASP 167 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2f9b h ASP 167 CO -0.55 0.16 -0.08 0.00 -1.72 0.00 0.00 179.24 177.06 2f9b n LEU 169 N -3.24 0.00 0.00 0.00 4.77 0.57 -1.03 117.00 118.07 2f9b n LEU 169 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2f9b n LEU 169 Cb 0.09 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2f9b n LEU 169 CO 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.13 2f9b n GLN 170 N 0.29 0.00 -1.58 3.23 6.02 -0.62 -4.85 117.38 119.86 2f9b n GLN 170 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.68 2f9b n GLN 170 Cb 0.00 0.00 0.05 0.00 1.02 0.00 0.00 30.24 31.31 2f9b n GLN 170 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2f9b s SER 170 N -0.05 5.35 0.88 1.08 0.01 -0.20 -4.81 113.70 115.96 2f9b s SER 170 Ca 0.00 1.64 -0.12 0.00 1.31 0.00 0.00 55.95 58.79 2f9b s SER 170 Cb 0.00 -2.50 0.12 0.00 0.21 0.00 0.00 66.02 63.85 2f9b s SER 170 CO 0.00 -1.46 1.11 -0.60 0.41 0.00 0.00 173.24 172.70 2f9b s ARG 170 N -4.97 1.42 -0.02 12.44 3.52 -0.06 -5.00 118.95 126.27 2f9b s ARG 170 Ca 0.59 0.48 -0.12 0.00 -0.13 0.00 0.00 55.73 56.54 2f9b s ARG 170 Cb -0.14 -1.86 -0.07 0.00 -1.56 0.00 0.00 34.95 31.32 2f9b s ARG 170 CO 0.54 -2.04 0.60 -0.22 -0.81 0.00 0.00 175.30 173.37 2f9b h LYS 170 N -1.39 -0.42 0.00 5.12 3.64 -1.95 -3.49 116.57 118.08 2f9b h LYS 170 Ca -0.50 0.03 -0.47 0.00 -1.27 0.00 0.00 60.65 58.44 2f9b h LYS 170 Cb 1.31 0.10 -0.10 0.00 -0.41 0.00 0.00 32.23 33.12 2f9b h LYS 170 CO 0.60 -0.28 -0.38 1.33 -2.27 0.00 0.00 179.45 178.45 2f9b n VAL 170 N -4.38 0.00 -0.18 2.00 0.24 -1.26 -5.03 118.33 109.72 2f9b n VAL 170 Ca -0.05 -1.91 0.00 0.00 -2.04 0.00 0.00 64.34 60.33 2f9b n VAL 170 Cb 0.17 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.13 2f9b n VAL 170 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2f9b n GLY 170 N -0.08 -2.14 3.41 7.63 0.00 -1.26 -4.98 105.19 107.77 2f9b n GLY 170 Ca -0.08 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.31 2f9b n GLY 170 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2f9b n ASP 170 N 1.76 5.02 -4.84 1.61 5.75 -1.26 -4.90 116.55 119.69 2f9b n ASP 170 Ca 0.00 -2.96 -0.37 0.00 -0.01 0.00 0.00 54.79 51.45 2f9b n ASP 170 Cb 0.00 -1.64 -0.06 0.00 -1.03 0.00 0.00 41.12 38.39 2f9b n ASP 170 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2f9b s SER 170 N 3.19 6.45 1.14 -1.12 0.01 -1.26 -5.10 113.70 117.01 2f9b s SER 170 Ca 0.47 0.53 -0.12 0.00 1.31 0.00 0.00 55.95 58.14 2f9b s SER 170 Cb 0.02 -2.12 0.27 0.00 0.21 0.00 0.00 66.02 64.40 2f9b s SER 170 CO 0.03 0.33 1.03 -2.65 0.41 0.00 0.00 173.24 172.38 2f9b n PRO 170 N 2.31 -2.18 -2.88 12.44 -0.02 -1.26 -5.07 135.00 138.34 2f9b n PRO 170 Ca -0.18 -0.60 -0.24 0.00 -2.02 0.00 0.00 63.50 60.46 2f9b n PRO 170 Cb 0.54 -2.20 0.01 0.00 -0.02 0.00 0.00 33.50 31.84 2f9b n PRO 170 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 2f9b s ASN 175 N -2.43 5.85 -0.60 2.55 0.01 -1.26 -5.01 114.94 114.05 2f9b s ASN 175 Ca 0.68 0.41 -0.22 0.00 -0.71 0.00 0.00 52.86 53.03 2f9b s ASN 175 Cb -0.25 -1.64 0.06 0.00 0.41 0.00 0.00 41.25 39.83 2f9b s ASN 175 CO 0.64 -0.73 0.89 -0.63 -1.51 0.00 0.00 177.10 175.77 2f9b s ILE 176 N -2.63 4.45 0.17 0.60 -1.09 -1.26 -5.00 121.20 116.45 2f9b s ILE 176 Ca 0.49 -0.24 -0.02 0.00 -2.23 0.00 0.00 60.65 58.64 2f9b s ILE 176 Cb -0.10 -4.57 0.04 0.00 -1.58 0.00 0.00 42.46 36.24 2f9b s ILE 176 CO 0.39 -1.24 0.23 0.35 -1.23 0.00 0.00 174.94 173.44 2f9b n THR 177 N 5.93 0.00 1.78 2.92 -2.24 -1.26 -4.89 114.28 116.51 2f9b n THR 177 Ca -0.03 -0.21 0.13 0.00 -2.27 0.00 0.00 64.05 61.67 2f9b n THR 177 Cb 0.46 -1.74 0.78 0.00 -2.10 0.00 0.00 70.33 67.72 2f9b n THR 177 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2f9b n GLU 178 N -1.48 0.89 -0.33 -0.78 0.00 -1.26 -2.40 120.64 115.28 2f9b n GLU 178 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.28 2f9b n GLU 178 Cb 0.11 -1.46 0.26 0.00 0.00 0.00 0.00 31.44 30.35 2f9b n GLU 178 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2f9b n TYR 179 N -0.96 0.85 -4.24 -1.84 4.01 -1.26 -4.89 117.16 108.83 2f9b n TYR 179 Ca 0.20 -0.53 -0.14 0.00 -0.16 0.00 0.00 57.90 57.26 2f9b n TYR 179 Cb 0.09 -0.06 -0.10 0.00 -0.31 0.00 0.00 39.34 38.96 2f9b n TYR 179 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 2f9b s MET 180 N -1.20 1.33 0.35 -0.72 -1.94 -1.01 -1.21 119.30 114.90 2f9b s MET 180 Ca 0.39 -1.72 -0.12 0.00 -1.71 0.00 0.00 55.69 52.53 2f9b s MET 180 Cb 0.22 0.13 0.03 0.00 2.01 0.00 0.00 34.83 37.22 2f9b s MET 180 CO 0.24 -0.40 0.66 -0.59 -0.01 0.00 0.00 175.02 174.92 2f9b s PHE 181 N -3.96 0.40 0.06 -0.03 -0.12 -1.03 -4.70 117.98 108.61 2f9b s PHE 181 Ca 0.39 -0.89 0.05 0.00 -0.05 0.00 0.00 56.93 56.42 2f9b s PHE 181 Cb 0.07 0.48 -0.03 0.00 -0.63 0.00 0.00 43.02 42.91 2f9b s PHE 181 CO 0.14 -1.35 -0.13 0.00 -0.05 0.00 0.00 175.22 173.84 2f9b s ALA 183 N -1.27 -1.11 0.00 0.00 0.00 0.24 -0.97 121.76 118.65 2f9b s ALA 183 Ca -0.03 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.35 2f9b s ALA 183 Cb -0.10 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.36 2f9b s ALA 183 CO 0.02 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.73 2f9b n GLY 184 N 0.52 0.75 3.36 0.00 0.00 -0.61 -0.54 105.19 108.67 2f9b n GLY 184 Ca -0.19 -2.05 -0.21 0.00 0.00 0.00 0.00 46.02 43.57 2f9b n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2f9b s TYR 184 N -1.52 1.86 -0.86 1.61 1.51 -1.26 -4.42 117.35 114.27 2f9b s TYR 184 Ca 0.00 -0.48 0.12 0.00 -1.01 0.00 0.00 57.07 55.69 2f9b s TYR 184 Cb 0.00 -0.88 -0.05 0.00 -0.11 0.00 0.00 41.96 40.91 2f9b s TYR 184 CO 0.00 0.40 0.61 -1.13 -1.11 0.00 0.00 175.55 174.33 2f9b n SER 185 N -0.10 1.01 -2.77 2.29 3.41 -1.25 -4.49 113.62 111.72 2f9b n SER 185 Ca -0.10 -1.00 -0.29 0.00 -0.26 0.00 0.00 58.87 57.22 2f9b n SER 185 Cb 0.59 0.69 -0.06 0.00 -0.26 0.00 0.00 64.21 65.16 2f9b n SER 185 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2f9b n ASP 186 N -0.66 6.96 -1.65 4.04 5.75 -1.26 -0.31 116.55 129.42 2f9b n ASP 186 Ca 0.04 -2.93 0.00 0.00 -0.01 0.00 0.00 54.79 51.89 2f9b n ASP 186 Cb 0.22 -1.36 0.00 0.00 -1.03 0.00 0.00 41.12 38.95 2f9b n ASP 186 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2f9b n GLY 187 N 1.87 0.00 0.35 6.12 0.00 -1.08 -4.65 105.19 107.80 2f9b n GLY 187 Ca 0.56 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.45 2f9b n GLY 187 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2f9b n SER 188 N 0.27 1.83 -4.16 1.61 3.41 -1.26 -4.87 113.62 110.45 2f9b n SER 188 Ca 0.00 0.07 -0.25 0.00 -0.26 0.00 0.00 58.87 58.43 2f9b n SER 188 Cb 0.00 -0.33 -0.15 0.00 -0.26 0.00 0.00 64.21 63.47 2f9b n SER 188 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2f9b s LYS 188 N -2.26 1.41 -0.02 4.33 1.02 -1.26 -3.80 119.74 119.16 2f9b s LYS 188 Ca -0.19 -0.62 -0.30 0.00 0.02 0.00 0.00 55.97 54.88 2f9b s LYS 188 Cb 0.06 -1.36 0.12 0.00 -0.52 0.00 0.00 37.83 36.13 2f9b s LYS 188 CO 0.27 0.37 1.30 0.34 -0.92 0.00 0.00 175.35 176.71 2f9b s ASP 189 N -0.39 -0.04 0.91 2.83 2.15 -0.04 -4.10 116.67 117.99 2f9b s ASP 189 Ca 0.06 -0.13 -0.12 0.00 0.43 0.00 0.00 52.55 52.79 2f9b s ASP 189 Cb -0.07 0.14 0.19 0.00 -0.30 0.00 0.00 42.92 42.89 2f9b s ASP 189 CO -0.01 -0.27 1.25 -0.94 -0.17 0.00 0.00 175.17 175.03 2f9b s SER 190 N -3.07 3.31 0.29 -0.34 1.04 -1.26 -0.10 113.70 113.57 2f9b s SER 190 Ca 0.16 0.02 -0.20 0.00 0.48 0.00 0.00 55.95 56.41 2f9b s SER 190 Cb 0.05 -0.10 0.05 0.00 0.10 0.00 0.00 66.02 66.12 2f9b s SER 190 CO -0.04 -2.58 0.84 0.00 0.98 0.00 0.00 173.24 172.44 2f9b n LYS 192 N -0.53 2.43 0.00 0.00 4.81 -1.26 -0.63 118.16 122.98 2f9b n LYS 192 Ca -0.06 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 2f9b n LYS 192 Cb 0.60 -2.59 0.00 0.00 0.02 0.00 0.00 35.03 33.06 2f9b n LYS 192 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2f9b n GLY 193 N 1.95 3.15 0.02 3.14 0.00 -1.26 -0.21 105.19 111.97 2f9b n GLY 193 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2f9b n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f9b n ASP 194 N 0.00 0.65 -3.40 1.61 8.00 0.20 -4.13 116.55 119.48 2f9b n ASP 194 Ca 0.00 -0.37 -0.40 0.00 0.71 0.00 0.00 54.79 54.73 2f9b n ASP 194 Cb 0.00 0.73 -0.04 0.00 -0.02 0.00 0.00 41.12 41.79 2f9b n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2f9b n SER 195 N -1.77 -0.63 0.00 -2.24 7.64 -1.26 -1.60 113.62 113.77 2f9b n SER 195 Ca 0.03 0.87 0.00 0.00 1.01 0.00 0.00 58.87 60.78 2f9b n SER 195 Cb 0.39 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 2f9b n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2f9b n GLY 196 N 1.40 2.35 3.32 0.23 0.00 0.08 -1.06 105.19 111.50 2f9b n GLY 196 Ca 0.14 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2f9b n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2f9b s GLY 197 N -0.82 1.43 0.49 -0.02 0.00 -0.63 -3.84 107.32 103.94 2f9b s GLY 197 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 44.72 44.11 2f9b s GLY 197 CO 0.00 0.34 0.72 2.56 0.00 0.00 0.00 173.10 176.72 2f9b s PRO 198 N -4.85 2.89 -0.13 2.90 0.04 -1.26 -0.67 135.00 133.91 2f9b s PRO 198 Ca 0.68 -0.53 -0.04 0.00 0.04 0.00 0.00 61.00 61.15 2f9b s PRO 198 Cb -0.17 -2.51 0.05 0.00 0.04 0.00 0.00 34.50 31.91 2f9b s PRO 198 CO 0.60 -0.45 0.07 -1.58 0.04 0.00 0.00 177.00 175.68 2f9b s HIS 199 N -2.66 0.32 -0.11 0.56 2.46 0.71 -3.71 115.29 112.86 2f9b s HIS 199 Ca 0.52 -0.24 0.03 0.00 0.47 0.00 0.00 55.06 55.84 2f9b s HIS 199 Cb -0.10 -0.70 0.01 0.00 -0.13 0.00 0.00 32.58 31.66 2f9b s HIS 199 CO 0.39 -0.43 -0.20 0.00 -2.47 0.00 0.00 174.74 172.03 2f9b s ALA 200 N 2.09 1.97 -0.12 1.58 0.00 -0.18 -1.28 121.76 125.82 2f9b s ALA 200 Ca 0.03 -0.88 -0.06 0.00 0.00 0.00 0.00 51.96 51.05 2f9b s ALA 200 Cb -0.15 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 22.10 2f9b s ALA 200 CO -0.07 0.11 0.11 0.99 0.00 0.00 0.00 175.76 176.90 2f9b s THR 201 N 0.64 5.23 -0.36 0.00 2.01 -0.65 -1.67 115.64 120.84 2f9b s THR 201 Ca -0.13 0.10 -0.12 0.00 0.31 0.00 0.00 61.69 61.85 2f9b s THR 201 Cb -0.16 -3.27 0.01 0.00 0.01 0.00 0.00 72.50 69.08 2f9b s THR 201 CO 0.03 0.60 0.23 -2.28 -0.69 0.00 0.00 174.62 172.51 2f9b s HIS 202 N -0.83 3.23 -0.16 4.92 2.46 -1.26 -0.89 115.29 122.75 2f9b s HIS 202 Ca 0.14 -0.58 0.01 0.00 0.47 0.00 0.00 55.06 55.10 2f9b s HIS 202 Cb -0.12 -2.48 0.02 0.00 -0.13 0.00 0.00 32.58 29.87 2f9b s HIS 202 CO 0.03 -0.52 -0.17 -0.47 -2.47 0.00 0.00 174.74 171.14 2f9b s TYR 203 N 1.65 2.44 -1.70 3.88 5.04 0.38 -4.82 117.35 124.22 2f9b s TYR 203 Ca 0.04 -1.37 -0.11 0.00 -2.44 0.00 0.00 57.07 53.20 2f9b s TYR 203 Cb -0.18 -1.73 0.11 0.00 0.35 0.00 0.00 41.96 40.51 2f9b s TYR 203 CO 0.09 -0.70 0.27 0.54 -1.34 0.00 0.00 175.55 174.41 2f9b n ARG 204 N 4.57 -0.85 0.00 4.97 1.74 -1.26 -2.02 116.66 123.81 2f9b n ARG 204 Ca -0.19 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2f9b n ARG 204 Cb 0.50 -4.09 0.00 0.00 -1.02 0.00 0.00 32.46 27.85 2f9b n ARG 204 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f9b n GLY 205 N -1.91 0.23 3.22 -0.13 0.00 -1.26 -5.07 105.19 100.27 2f9b n GLY 205 Ca -0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 2f9b n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2f9b s THR 206 N -2.00 1.03 -0.04 2.61 2.01 -0.86 -5.14 115.64 113.26 2f9b s THR 206 Ca 0.00 -1.98 0.05 0.00 0.31 0.00 0.00 61.69 60.07 2f9b s THR 206 Cb 0.00 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 2f9b s THR 206 CO 0.00 -0.76 -0.18 0.26 -0.69 0.00 0.00 174.62 173.26 2f9b s TRP 207 N -3.29 2.60 0.27 4.92 0.52 -1.26 -0.47 118.94 122.22 2f9b s TRP 207 Ca 0.14 -0.24 0.06 0.00 0.02 0.00 0.00 56.10 56.09 2f9b s TRP 207 Cb 0.03 -1.59 -0.06 0.00 -1.15 0.00 0.00 33.47 30.70 2f9b s TRP 207 CO -0.01 0.12 -0.06 0.71 0.02 0.00 0.00 176.95 177.73 2f9b s TYR 208 N -0.70 1.90 -0.48 -1.98 1.51 -0.07 -2.99 117.35 114.55 2f9b s TYR 208 Ca 0.11 -0.70 -0.20 0.00 -1.01 0.00 0.00 57.07 55.26 2f9b s TYR 208 Cb -0.10 -1.07 0.04 0.00 -0.11 0.00 0.00 41.96 40.71 2f9b s TYR 208 CO 0.00 0.26 0.65 -1.17 -1.11 0.00 0.00 175.55 174.19 2f9b s LEU 209 N -3.42 4.66 -0.10 -1.29 2.96 -0.43 -1.63 118.68 119.43 2f9b s LEU 209 Ca 0.29 -0.59 0.19 0.00 -0.22 0.00 0.00 54.13 53.80 2f9b s LEU 209 Cb 0.03 -2.61 -0.27 0.00 0.50 0.00 0.00 46.19 43.85 2f9b s LEU 209 CO 0.11 -0.86 0.32 0.35 -1.32 0.00 0.00 176.35 174.95 2f9b n THR 210 N 5.77 0.88 -3.87 3.68 -2.24 -0.40 -4.52 114.28 113.57 2f9b n THR 210 Ca -0.04 -0.71 -0.09 0.00 -2.27 0.00 0.00 64.05 60.94 2f9b n THR 210 Cb 0.47 -0.34 -0.05 0.00 -2.10 0.00 0.00 70.33 68.31 2f9b n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2f9b s GLY 211 N -5.06 0.22 -0.13 3.38 0.00 -0.53 -2.83 107.32 102.38 2f9b s GLY 211 Ca -0.08 -0.57 0.02 0.00 0.00 0.00 0.00 44.72 44.08 2f9b s GLY 211 CO 0.86 -0.49 -0.18 -0.42 0.00 0.00 0.00 173.10 172.87 2f9b s ILE 212 N -3.94 1.77 -0.28 0.90 1.01 -1.14 -0.21 121.20 119.31 2f9b s ILE 212 Ca 0.15 -0.79 -0.32 0.00 0.00 0.00 0.00 60.65 59.69 2f9b s ILE 212 Cb -0.00 -1.60 -0.08 0.00 0.01 0.00 0.00 42.46 40.78 2f9b s ILE 212 CO 0.02 0.49 2.20 0.52 0.00 0.00 0.00 174.94 178.17 2f9b n VAL 213 N 4.30 0.28 -3.13 2.92 0.31 0.16 -1.07 118.33 122.09 2f9b n VAL 213 Ca -0.19 -0.35 -0.02 0.00 -0.01 0.00 0.00 64.34 63.76 2f9b n VAL 213 Cb 0.51 -2.10 0.01 0.00 -0.91 0.00 0.00 33.84 31.34 2f9b n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2f9b n SER 214 N 10.66 0.46 -4.04 4.52 2.88 -1.16 -0.74 113.62 126.20 2f9b n SER 214 Ca 0.35 -1.18 -0.34 0.00 -1.33 0.00 0.00 58.87 56.38 2f9b n SER 214 Cb 0.34 -0.04 -0.12 0.00 -0.75 0.00 0.00 64.21 63.64 2f9b n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2f9b s TRP 215 N 0.40 3.39 -0.07 0.66 1.48 -1.26 -4.82 118.94 118.72 2f9b s TRP 215 Ca 0.06 -2.86 -0.01 0.00 -1.06 0.00 0.00 56.10 52.23 2f9b s TRP 215 Cb -0.00 -3.06 0.03 0.00 -1.16 0.00 0.00 33.47 29.28 2f9b s TRP 215 CO 0.04 -0.83 -0.00 0.20 -4.06 0.00 0.00 176.95 172.29 2f9b s GLY 216 N 0.51 0.46 0.00 3.67 0.00 -1.26 -4.85 107.32 105.85 2f9b s GLY 216 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.77 2f9b s GLY 216 CO -0.03 1.09 0.00 -0.18 0.00 0.00 0.00 173.10 173.98 2f9b n GLN 217 N 5.05 0.00 -0.24 2.90 7.27 -1.26 -3.86 117.38 127.24 2f9b n GLN 217 Ca -0.09 0.20 0.13 0.00 0.07 0.00 0.00 57.00 57.31 2f9b n GLN 217 Cb 0.50 -0.11 0.25 0.00 2.41 0.00 0.00 30.24 33.29 2f9b n GLN 217 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2f9b n GLY 219 N 1.81 -0.88 0.00 1.69 0.00 -1.26 -4.75 105.19 101.80 2f9b n GLY 219 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.69 2f9b n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f9b n ALA 221 N -1.17 -0.50 -2.57 0.00 0.00 -1.26 -4.81 120.51 110.20 2f9b n ALA 221 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 2f9b n ALA 221 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 2f9b n ALA 221 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2f9b n THR 221 N -0.31 0.00 -4.84 0.00 -1.04 -1.26 -4.73 114.28 102.10 2f9b n THR 221 Ca 0.00 -1.32 -0.33 0.00 -2.04 0.00 0.00 64.05 60.36 2f9b n THR 221 Cb 0.00 -0.96 -0.14 0.00 -1.82 0.00 0.00 70.33 67.41 2f9b n THR 221 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2f9b s VAL 222 N -2.51 3.05 0.00 12.58 1.01 -1.26 -2.64 120.40 130.63 2f9b s VAL 222 Ca 0.55 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2f9b s VAL 222 Cb -0.03 -2.23 0.00 0.00 0.00 0.00 0.00 36.38 34.12 2f9b s VAL 222 CO 0.36 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.63 2f9b n GLY 223 N 2.89 0.54 3.20 4.51 0.00 0.57 -4.83 105.19 112.06 2f9b n GLY 223 Ca -0.18 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 2f9b n GLY 223 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2f9b s HIS 224 N -2.00 1.01 0.25 1.61 4.02 -1.26 -0.88 115.29 118.05 2f9b s HIS 224 Ca 0.00 -1.00 0.06 0.00 1.02 0.00 0.00 55.06 55.14 2f9b s HIS 224 Cb 0.00 -0.58 -0.05 0.00 -1.02 0.00 0.00 32.58 30.92 2f9b s HIS 224 CO 0.00 -0.23 -0.07 -0.06 1.02 0.00 0.00 174.74 175.41 2f9b s PHE 225 N -3.70 1.83 0.11 1.40 0.08 -1.26 -3.96 117.98 112.48 2f9b s PHE 225 Ca 0.18 -0.71 -0.14 0.00 0.12 0.00 0.00 56.93 56.38 2f9b s PHE 225 Cb 0.06 -1.01 -0.06 0.00 -0.57 0.00 0.00 43.02 41.43 2f9b s PHE 225 CO -0.00 0.24 0.50 0.20 -0.10 0.00 0.00 175.22 176.05 2f9b s GLY 226 N -3.39 2.45 -0.12 4.36 0.00 0.30 -4.70 107.32 106.22 2f9b s GLY 226 Ca 0.28 -0.19 -0.05 0.00 0.00 0.00 0.00 44.72 44.76 2f9b s GLY 226 CO 0.10 0.10 0.06 0.14 0.00 0.00 0.00 173.10 173.50 2f9b s VAL 227 N -1.38 4.79 0.27 1.40 1.01 -1.25 -0.59 120.40 124.65 2f9b s VAL 227 Ca 0.34 -0.05 0.09 0.00 0.00 0.00 0.00 61.98 62.36 2f9b s VAL 227 Cb -0.15 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 2f9b s VAL 227 CO 0.18 0.57 -0.13 -0.31 0.00 0.00 0.00 175.10 175.41 2f9b s TYR 228 N -0.54 2.07 0.13 5.22 1.51 -0.82 -2.97 117.35 121.94 2f9b s TYR 228 Ca 0.10 -0.52 -0.21 0.00 -1.01 0.00 0.00 57.07 55.44 2f9b s TYR 228 Cb -0.12 -1.04 -0.07 0.00 -0.11 0.00 0.00 41.96 40.62 2f9b s TYR 228 CO 0.02 0.49 0.66 0.99 -1.11 0.00 0.00 175.55 176.60 2f9b s THR 229 N -2.78 4.59 -0.42 -0.71 2.01 -0.23 -2.45 115.64 115.65 2f9b s THR 229 Ca 0.28 1.38 -0.24 0.00 0.31 0.00 0.00 61.69 63.42 2f9b s THR 229 Cb -0.00 -3.97 0.02 0.00 0.01 0.00 0.00 72.50 68.56 2f9b s THR 229 CO 0.12 0.49 0.82 -0.60 -0.69 0.00 0.00 174.62 174.76 2f9b s ARG 230 N -1.27 3.55 0.13 4.92 3.52 -0.35 -2.89 118.95 126.56 2f9b s ARG 230 Ca 0.33 0.10 -0.14 0.00 -0.13 0.00 0.00 55.73 55.89 2f9b s ARG 230 Cb -0.20 -3.89 -0.03 0.00 -1.56 0.00 0.00 34.95 29.26 2f9b s ARG 230 CO 0.22 -1.05 1.52 0.28 -0.81 0.00 0.00 175.30 175.46 2f9b h VAL 231 N 5.92 1.28 -0.75 7.11 2.07 -1.85 -3.22 116.25 126.82 2f9b h VAL 231 Ca -0.25 -1.25 0.26 0.00 0.82 0.00 0.00 66.70 66.28 2f9b h VAL 231 Cb 1.09 1.27 -0.14 0.00 -1.52 0.00 0.00 31.29 31.99 2f9b h VAL 231 CO 0.96 0.42 0.20 -1.54 0.02 0.00 0.00 177.57 177.62 2f9b n SER 232 N -4.30 0.08 0.12 0.57 3.41 -1.26 0.79 113.62 113.02 2f9b n SER 232 Ca -0.01 1.25 0.10 0.00 -0.26 0.00 0.00 58.87 59.94 2f9b n SER 232 Cb 0.39 -0.53 0.46 0.00 -0.26 0.00 0.00 64.21 64.26 2f9b n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2f9b n GLN 233 N -4.87 0.13 0.00 4.33 1.13 -1.21 -3.46 117.38 113.42 2f9b n GLN 233 Ca 0.23 0.52 0.01 0.00 -1.94 0.00 0.00 57.00 55.81 2f9b n GLN 233 Cb 0.76 -1.83 0.00 0.00 0.11 0.00 0.00 30.24 29.28 2f9b n GLN 233 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2f9b n TYR 234 N -2.09 0.00 -0.02 1.08 4.01 0.24 -4.81 117.16 115.57 2f9b n TYR 234 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 2f9b n TYR 234 Cb 0.10 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.07 2f9b n TYR 234 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2f9b h ILE 235 N 0.20 0.13 -0.86 -0.72 2.04 -1.57 -0.76 117.51 115.98 2f9b h ILE 235 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 2f9b h ILE 235 Cb 0.05 0.13 -0.10 0.00 -0.74 0.00 0.00 36.82 36.16 2f9b h ILE 235 CO 0.00 0.00 -0.50 -0.62 0.00 0.00 0.00 178.15 177.03 2f9b n GLU 236 N -5.43 -0.38 -0.03 2.37 4.71 -1.26 -1.11 120.64 119.50 2f9b n GLU 236 Ca -0.04 1.38 -0.08 0.00 -0.01 0.00 0.00 57.16 58.41 2f9b n GLU 236 Cb 0.36 -2.02 -0.02 0.00 -1.01 0.00 0.00 31.44 28.75 2f9b n GLU 236 CO 0.00 0.00 0.00 2.35 0.09 0.00 0.00 177.13 179.57 2f9b h TRP 237 N 0.00 -0.53 0.82 -0.32 7.01 -1.66 -0.24 115.95 121.04 2f9b h TRP 237 Ca 0.14 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.13 2f9b h TRP 237 Cb 0.35 0.27 -0.00 0.00 -2.10 0.00 0.00 29.16 27.68 2f9b h TRP 237 CO -0.96 -0.28 -0.49 -0.07 -2.79 0.00 0.00 178.44 173.85 2f9b h LEU 238 N -0.22 -1.22 -0.78 0.65 3.38 -0.35 -1.10 115.31 115.67 2f9b h LEU 238 Ca 0.13 0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.31 2f9b h LEU 238 Cb 0.41 0.35 -0.15 0.00 0.09 0.00 0.00 40.66 41.37 2f9b h LEU 238 CO -0.34 -0.76 -0.25 1.56 0.09 0.00 0.00 178.44 178.75 2f9b h GLN 239 N -1.22 -0.03 -0.46 1.13 4.20 -0.91 0.34 115.11 118.16 2f9b h GLN 239 Ca -0.11 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.64 2f9b h GLN 239 Cb 0.97 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.72 2f9b h GLN 239 CO 0.12 -0.02 0.23 -0.22 -0.67 0.00 0.00 178.83 178.27 2f9b h LYS 240 N -0.03 0.44 -0.44 1.46 3.64 -0.84 -2.45 116.57 118.35 2f9b h LYS 240 Ca 0.35 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.67 2f9b h LYS 240 Cb 0.58 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 2f9b h LYS 240 CO -0.81 0.29 0.16 -0.07 -2.27 0.00 0.00 179.45 176.75 2f9b h LEU 241 N 0.45 0.63 0.00 5.20 3.38 0.81 -2.52 115.31 123.26 2f9b h LEU 241 Ca 0.20 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2f9b h LEU 241 Cb 0.11 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2f9b h LEU 241 CO -0.14 0.65 0.00 0.23 0.09 0.00 0.00 178.44 179.26 2f9b n MET 242 N -4.58 0.00 -0.04 1.13 2.81 0.81 -1.86 117.12 115.40 2f9b n MET 242 Ca 0.01 0.44 0.02 0.00 -1.81 0.00 0.00 57.70 56.35 2f9b n MET 242 Cb 0.17 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.22 2f9b n MET 242 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2f9b n ARG 243 N -1.50 1.99 -2.39 0.03 1.74 -0.96 -5.04 116.66 110.53 2f9b n ARG 243 Ca 0.01 -1.41 -0.24 0.00 -0.77 0.00 0.00 57.85 55.44 2f9b n ARG 243 Cb 0.04 -1.08 0.06 0.00 -1.02 0.00 0.00 32.46 30.46 2f9b n ARG 243 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2f9b s SER 244 N -0.80 4.94 0.48 0.55 0.01 -0.77 -5.03 113.70 113.08 2f9b s SER 244 Ca 0.06 0.22 -0.21 0.00 1.31 0.00 0.00 55.95 57.33 2f9b s SER 244 Cb 0.04 -0.94 -0.08 0.00 0.21 0.00 0.00 66.02 65.26 2f9b s SER 244 CO 0.05 -1.45 1.10 -1.61 0.41 0.00 0.00 173.24 171.74 2f9b s GLU 245 N -5.06 3.73 0.15 12.44 8.01 -1.26 -4.93 118.70 131.77 2f9b s GLU 245 Ca 0.60 1.56 -0.32 0.00 0.01 0.00 0.00 54.97 56.82 2f9b s GLU 245 Cb -0.10 -2.22 -0.17 0.00 -4.31 0.00 0.00 34.13 27.32 2f9b s GLU 245 CO 0.42 -0.53 0.79 -2.30 0.01 0.00 0.00 175.26 173.66 2f9b n PRO 246 N -0.78 0.25 -4.54 0.39 -0.02 -1.26 -4.98 135.00 124.06 2f9b n PRO 246 Ca 0.09 0.09 -0.25 0.00 -2.02 0.00 0.00 63.50 61.40 2f9b n PRO 246 Cb 0.50 -1.32 -0.11 0.00 -0.02 0.00 0.00 33.50 32.56 2f9b n PRO 246 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2f9b s ARG 247 N -0.67 1.82 -1.18 -0.52 3.00 -1.26 -5.07 118.95 115.07 2f9b s ARG 247 Ca 0.72 -2.02 -0.11 0.00 0.00 0.00 0.00 55.73 54.32 2f9b s ARG 247 Cb -1.00 -1.26 0.22 0.00 0.00 0.00 0.00 34.95 32.91 2f9b s ARG 247 CO 0.56 -0.12 1.36 -0.35 0.00 0.00 0.00 175.30 176.75 2f9b n PRO 248 N -0.84 3.52 -3.62 3.54 -0.04 -1.26 -4.90 135.00 131.40 2f9b n PRO 248 Ca -0.04 -4.08 -0.04 0.00 -0.04 0.00 0.00 63.50 59.30 2f9b n PRO 248 Cb 0.67 -2.83 -0.04 0.00 -0.04 0.00 0.00 33.50 31.26 2f9b n PRO 248 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2f9b s GLY 249 N 1.87 -0.12 -0.14 0.55 0.00 -1.26 -5.03 107.32 103.20 2f9b s GLY 249 Ca 0.38 2.24 -0.08 0.00 0.00 0.00 0.00 44.72 47.25 2f9b s GLY 249 CO -0.02 0.88 -0.16 -2.08 0.00 0.00 0.00 173.10 171.72 2f9b h VAL 250 N 2.13 0.00 -3.50 1.40 2.07 -1.90 -3.44 116.25 113.00 2f9b h VAL 250 Ca -0.10 -0.99 -0.53 0.00 0.82 0.00 0.00 66.70 65.90 2f9b h VAL 250 Cb 1.17 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2f9b h VAL 250 CO 0.24 0.00 0.13 -0.22 0.02 0.00 0.00 177.57 177.74 2f9b s LEU 251 N -8.22 4.51 -0.00 2.57 2.96 -1.26 0.11 118.68 119.35 2f9b s LEU 251 Ca -0.13 1.53 0.00 0.00 -0.22 0.00 0.00 54.13 55.31 2f9b s LEU 251 Cb 0.02 -3.34 -0.00 0.00 0.50 0.00 0.00 46.19 43.37 2f9b s LEU 251 CO 0.20 0.16 -0.01 -0.22 -1.32 0.00 0.00 176.35 175.16 2f9b s LEU 252 N -1.40 2.00 -0.38 -0.68 2.96 0.15 -4.90 118.68 116.43 2f9b s LEU 252 Ca 0.37 -0.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.28 2f9b s LEU 252 Cb -0.21 -0.06 0.11 0.00 0.50 0.00 0.00 46.19 46.53 2f9b s LEU 252 CO 0.24 0.01 0.11 -0.13 -1.32 0.00 0.00 176.35 175.26 2f9b s ARG 253 N -0.04 1.65 0.08 1.98 0.52 -1.26 -0.84 118.95 121.04 2f9b s ARG 253 Ca 0.00 -2.00 -0.29 0.00 -0.52 0.00 0.00 55.73 52.93 2f9b s ARG 253 Cb -0.01 -3.29 -0.05 0.00 0.52 0.00 0.00 34.95 32.12 2f9b s ARG 253 CO -0.00 -0.99 0.91 0.00 0.02 0.00 0.00 175.30 175.24 2f9b s ALA 254 N 0.73 3.27 0.08 2.13 0.00 -0.45 -4.61 121.76 122.90 2f9b s ALA 254 Ca 0.12 0.50 -0.18 0.00 0.00 0.00 0.00 51.96 52.39 2f9b s ALA 254 Cb -0.21 -3.21 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 2f9b s ALA 254 CO -0.06 -0.02 0.41 -2.30 0.00 0.00 0.00 175.76 173.78 2f9b n PRO 255 N 2.90 0.00 -3.75 0.00 -0.02 -1.26 -0.22 135.00 132.65 2f9b n PRO 255 Ca 0.01 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.35 2f9b n PRO 255 Cb 0.50 -0.67 -0.15 0.00 -0.02 0.00 0.00 33.50 33.15 2f9b n PRO 255 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2f9b s PHE 256 N -0.39 -0.07 -2.00 6.00 5.36 -1.26 -4.65 117.98 120.97 2f9b s PHE 256 Ca 0.42 0.32 0.19 0.00 -0.96 0.00 0.00 56.93 56.91 2f9b s PHE 256 Cb -0.60 -0.17 1.14 0.00 -0.34 0.00 0.00 43.02 43.04 2f9b s PHE 256 CO 0.33 -0.14 1.53 -2.30 -1.46 0.00 0.00 175.22 173.18