#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajo s GLY 2 N 0.00 0.83 0.00 2.92 0.00 -1.26 -0.70 107.32 109.11 1ajo s GLY 2 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.49 1ajo s GLY 2 CO 0.00 -1.10 0.00 0.61 0.00 0.00 0.00 173.10 172.61 1ajo n GLY 3 N -0.20 0.43 2.08 0.20 0.00 -1.24 -5.04 105.19 101.43 1ajo n GLY 3 Ca -0.04 -0.55 -0.24 0.00 0.00 0.00 0.00 46.02 45.18 1ajo n GLY 3 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ajo n HIS 4 N -0.31 2.83 -1.83 1.61 -0.00 -1.25 -5.03 115.22 111.23 1ajo n HIS 4 Ca 0.00 -2.33 -0.41 0.00 -0.00 0.00 0.00 57.72 54.98 1ajo n HIS 4 Cb 0.15 -0.31 -0.02 0.00 -0.00 0.00 0.00 29.99 29.81 1ajo n HIS 4 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1ajo s GLU 5 N -3.59 4.15 -0.06 -0.41 8.01 -1.26 -4.51 118.70 121.03 1ajo s GLU 5 Ca 0.51 2.52 -0.00 0.00 0.01 0.00 0.00 54.97 58.00 1ajo s GLU 5 Cb 0.41 -3.04 0.03 0.00 -4.31 0.00 0.00 34.13 27.22 1ajo s GLU 5 CO 0.01 -0.58 -0.01 0.21 0.01 0.00 0.00 175.26 174.90 1ajo s LYS 6 N -0.57 0.67 -0.21 1.61 2.47 -0.21 -5.01 119.74 118.49 1ajo s LYS 6 Ca 0.62 0.03 -0.07 0.00 -1.56 0.00 0.00 55.97 54.99 1ajo s LYS 6 Cb -0.46 -0.91 -0.04 0.00 -1.46 0.00 0.00 37.83 34.96 1ajo s LYS 6 CO 0.48 -0.22 0.07 0.08 0.16 0.00 0.00 175.35 175.91 1ajo s VAL 7 N 1.57 4.58 -0.06 4.02 1.01 -1.26 -0.71 120.40 129.55 1ajo s VAL 7 Ca -0.01 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 61.91 1ajo s VAL 7 Cb -0.13 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 1ajo s VAL 7 CO -0.03 0.40 -0.16 -0.63 0.00 0.00 0.00 175.10 174.67 1ajo s ILE 8 N 0.97 2.86 -0.16 2.22 -1.09 -0.39 -4.96 121.20 120.64 1ajo s ILE 8 Ca 0.04 -0.78 -0.29 0.00 -2.23 0.00 0.00 60.65 57.38 1ajo s ILE 8 Cb -0.14 -2.12 -0.01 0.00 -1.58 0.00 0.00 42.46 38.61 1ajo s ILE 8 CO 0.03 0.58 1.20 -0.55 -1.23 0.00 0.00 174.94 174.97 1ajo s SER 9 N -0.45 7.00 0.23 3.58 0.15 -1.26 -1.87 113.70 121.08 1ajo s SER 9 Ca 0.05 1.65 0.11 0.00 0.70 0.00 0.00 55.95 58.47 1ajo s SER 9 Cb -0.12 -2.54 0.11 0.00 -1.71 0.00 0.00 66.02 61.76 1ajo s SER 9 CO 0.02 -0.70 1.46 -0.07 1.20 0.00 0.00 173.24 175.14 1ajo h LEU 10 N 9.34 0.00 0.00 3.45 3.38 -1.44 -3.48 115.31 126.56 1ajo h LEU 10 Ca -0.27 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1ajo h LEU 10 Cb 1.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1ajo h LEU 10 CO 0.95 0.71 -0.00 0.61 0.09 0.00 0.00 178.44 180.80 1ajo n GLY 11 N 0.92 0.41 3.53 0.83 0.00 -1.26 -4.98 105.19 104.64 1ajo n GLY 11 Ca 0.00 -0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1ajo n GLY 11 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ajo s PHE 12 N -1.81 0.09 -0.51 1.61 -0.12 -1.26 -5.12 117.98 110.86 1ajo s PHE 12 Ca 0.00 -0.45 -0.21 0.00 -0.05 0.00 0.00 56.93 56.21 1ajo s PHE 12 Cb 0.00 0.28 0.05 0.00 -0.63 0.00 0.00 43.02 42.71 1ajo s PHE 12 CO 0.00 -0.92 0.73 0.34 -0.05 0.00 0.00 175.22 175.32 1ajo s ASP 13 N -2.93 6.29 0.58 1.98 -1.08 -1.26 -4.21 116.67 116.03 1ajo s ASP 13 Ca 0.14 -0.60 0.27 0.00 -0.52 0.00 0.00 52.55 51.84 1ajo s ASP 13 Cb -0.00 -2.34 1.63 0.00 -1.46 0.00 0.00 42.92 40.74 1ajo s ASP 13 CO 0.01 -0.98 2.13 0.00 0.52 0.00 0.00 175.17 176.86 1ajo h ALA 14 N 9.07 1.83 0.00 3.66 0.00 -1.23 -2.62 119.26 129.97 1ajo h ALA 14 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1ajo h ALA 14 Cb 1.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ajo h ALA 14 CO 0.99 -0.22 0.00 -1.13 0.00 0.00 0.00 179.25 178.89 1ajo n SER 15 N -3.95 0.00 0.03 0.00 3.41 -1.26 -3.52 113.62 108.33 1ajo n SER 15 Ca 0.01 -0.24 0.13 0.00 -0.26 0.00 0.00 58.87 58.51 1ajo n SER 15 Cb 0.27 -0.24 0.38 0.00 -0.26 0.00 0.00 64.21 64.36 1ajo n SER 15 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ajo n LYS 16 N -1.24 0.09 -3.05 4.33 5.02 -0.99 -4.87 118.16 117.46 1ajo n LYS 16 Ca 0.14 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 1ajo n LYS 16 Cb 0.20 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 1ajo n LYS 16 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ajo n GLY 17 N 1.44 -1.17 3.73 0.72 0.00 -1.23 -5.15 105.19 103.53 1ajo n GLY 17 Ca 0.06 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 1ajo n GLY 17 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ajo s PHE 18 N -2.00 3.72 0.13 1.61 0.40 -1.26 -4.60 117.98 115.98 1ajo s PHE 18 Ca 0.00 1.59 0.04 0.00 -0.60 0.00 0.00 56.93 57.96 1ajo s PHE 18 Cb 0.00 -2.96 -0.04 0.00 0.51 0.00 0.00 43.02 40.53 1ajo s PHE 18 CO 0.00 0.16 -0.10 -1.01 0.70 0.00 0.00 175.22 174.97 1ajo s HIS 19 N 0.34 1.17 -0.23 0.36 3.76 -1.20 -4.96 115.29 114.53 1ajo s HIS 19 Ca 0.44 -0.77 -0.10 0.00 -0.15 0.00 0.00 55.06 54.49 1ajo s HIS 19 Cb -0.21 -0.61 -0.05 0.00 1.11 0.00 0.00 32.58 32.82 1ajo s HIS 19 CO 0.25 0.03 0.13 0.99 -0.85 0.00 0.00 174.74 175.30 1ajo s THR 20 N -3.22 5.18 0.08 1.30 2.01 -1.26 -2.35 115.64 117.37 1ajo s THR 20 Ca 0.14 0.12 0.07 0.00 0.31 0.00 0.00 61.69 62.33 1ajo s THR 20 Cb 0.02 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 1ajo s THR 20 CO -0.00 0.37 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.83 1ajo s TYR 21 N 0.95 2.63 0.04 4.92 2.02 0.85 -0.20 117.35 128.55 1ajo s TYR 21 Ca 0.07 -0.21 -0.27 0.00 -0.37 0.00 0.00 57.07 56.29 1ajo s TYR 21 Cb -0.13 -1.43 0.07 0.00 -0.40 0.00 0.00 41.96 40.06 1ajo s TYR 21 CO 0.03 0.35 0.62 0.00 -1.57 0.00 0.00 175.55 174.98 1ajo s ALA 22 N -1.08 -1.62 -0.03 3.71 0.00 -0.63 -0.54 121.76 121.58 1ajo s ALA 22 Ca 0.18 0.90 0.01 0.00 0.00 0.00 0.00 51.96 53.04 1ajo s ALA 22 Cb -0.11 0.36 0.02 0.00 0.00 0.00 0.00 23.12 23.40 1ajo s ALA 22 CO 0.09 -0.52 -0.00 -0.59 0.00 0.00 0.00 175.76 174.73 1ajo s PHE 23 N -2.26 0.31 -0.34 0.00 -0.12 -0.73 -0.36 117.98 114.48 1ajo s PHE 23 Ca -0.06 -0.01 -0.15 0.00 -0.05 0.00 0.00 56.93 56.66 1ajo s PHE 23 Cb -0.01 -0.38 -0.01 0.00 -0.63 0.00 0.00 43.02 42.00 1ajo s PHE 23 CO 0.00 -0.11 0.37 0.34 -0.05 0.00 0.00 175.22 175.77 1ajo s ASP 24 N 0.86 6.19 -0.34 1.98 2.15 0.29 -1.19 116.67 126.61 1ajo s ASP 24 Ca -0.09 -0.21 -0.07 0.00 0.43 0.00 0.00 52.55 52.61 1ajo s ASP 24 Cb -0.12 -2.20 0.03 0.00 -0.30 0.00 0.00 42.92 40.33 1ajo s ASP 24 CO -0.01 -0.34 0.11 0.86 -0.17 0.00 0.00 175.17 175.62 1ajo s TRP 25 N 2.03 3.24 0.23 -5.34 -0.00 0.20 -1.93 118.94 117.37 1ajo s TRP 25 Ca 0.12 -1.32 0.07 0.00 -0.00 0.00 0.00 56.10 54.97 1ajo s TRP 25 Cb -0.16 -2.29 -0.05 0.00 -0.00 0.00 0.00 33.47 30.97 1ajo s TRP 25 CO 0.12 -0.70 -0.09 -0.65 -0.00 0.00 0.00 176.95 175.62 1ajo s GLN 26 N 1.43 1.39 0.32 5.86 -1.52 -0.94 0.22 119.66 126.42 1ajo s GLN 26 Ca -0.01 -1.66 0.07 0.00 -1.95 0.00 0.00 55.36 51.82 1ajo s GLN 26 Cb -0.19 -1.03 0.78 0.00 -0.22 0.00 0.00 33.01 32.35 1ajo s GLN 26 CO 0.03 0.09 1.79 -1.35 -0.25 0.00 0.00 175.29 175.60 1ajo h PRO 27 N 2.46 0.71 -0.27 2.91 0.11 -1.97 -2.74 132.00 133.21 1ajo h PRO 27 Ca -0.39 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ajo h PRO 27 Cb 1.22 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ajo h PRO 27 CO 0.64 0.47 0.00 0.41 -0.21 0.00 0.00 178.00 179.31 1ajo n GLY 28 N -1.36 1.68 3.80 -0.55 0.00 -1.26 -4.78 105.19 102.72 1ajo n GLY 28 Ca 0.23 -0.43 -0.05 0.00 0.00 0.00 0.00 46.02 45.77 1ajo n GLY 28 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ajo s TYR 29 N -1.04 -0.17 -0.07 1.61 -0.85 -1.03 -4.62 117.35 111.18 1ajo s TYR 29 Ca 0.23 -0.21 -0.01 0.00 -0.52 0.00 0.00 57.07 56.56 1ajo s TYR 29 Cb 0.13 0.67 0.03 0.00 0.38 0.00 0.00 41.96 43.17 1ajo s TYR 29 CO 0.18 -1.04 -0.00 0.42 -1.52 0.00 0.00 175.55 173.59 1ajo s ILE 30 N -3.62 0.38 -0.11 -3.49 1.01 -0.39 -2.21 121.20 112.77 1ajo s ILE 30 Ca 0.11 0.09 0.02 0.00 0.00 0.00 0.00 60.65 60.88 1ajo s ILE 30 Cb -0.04 -0.52 -0.00 0.00 0.01 0.00 0.00 42.46 41.91 1ajo s ILE 30 CO 0.04 0.25 -0.20 -0.54 0.00 0.00 0.00 174.94 174.49 1ajo s LYS 31 N 1.80 3.16 -0.08 2.79 1.02 -0.81 -0.46 119.74 127.16 1ajo s LYS 31 Ca 0.02 -0.81 0.01 0.00 0.02 0.00 0.00 55.97 55.21 1ajo s LYS 31 Cb -0.13 -2.43 -0.03 0.00 -0.52 0.00 0.00 37.83 34.73 1ajo s LYS 31 CO -0.04 0.17 -0.10 -1.58 -0.92 0.00 0.00 175.35 172.88 1ajo s TRP 32 N 0.40 2.85 0.10 3.18 0.51 -0.55 0.10 118.94 125.54 1ajo s TRP 32 Ca -0.15 -0.18 0.07 0.00 -2.12 0.00 0.00 56.10 53.72 1ajo s TRP 32 Cb -0.17 -1.74 -0.03 0.00 -0.81 0.00 0.00 33.47 30.72 1ajo s TRP 32 CO 0.07 0.15 -0.18 0.71 -0.51 0.00 0.00 176.95 177.19 1ajo s TYR 33 N -0.45 1.57 -0.17 -1.98 1.51 0.52 -0.90 117.35 117.44 1ajo s TYR 33 Ca 0.06 -0.45 0.00 0.00 -1.01 0.00 0.00 57.07 55.67 1ajo s TYR 33 Cb -0.12 -0.85 0.04 0.00 -0.11 0.00 0.00 41.96 40.92 1ajo s TYR 33 CO 0.02 0.16 -0.09 0.08 -1.11 0.00 0.00 175.55 174.61 1ajo s VAL 34 N -1.41 1.40 -1.45 0.71 1.01 -0.69 -1.60 120.40 118.38 1ajo s VAL 34 Ca 0.05 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 1ajo s VAL 34 Cb -0.09 -1.48 0.05 0.00 0.00 0.00 0.00 36.38 34.86 1ajo s VAL 34 CO 0.04 0.22 0.85 0.47 0.00 0.00 0.00 175.10 176.67 1ajo n ASP 35 N 4.78 -3.19 0.00 3.32 8.00 0.72 -2.34 116.55 127.84 1ajo n ASP 35 Ca -0.14 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.55 1ajo n ASP 35 Cb 0.48 -3.89 0.00 0.00 -0.02 0.00 0.00 41.12 37.69 1ajo n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ajo n GLY 36 N -1.66 1.52 3.75 0.44 0.00 -1.26 -5.02 105.19 102.95 1ajo n GLY 36 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1ajo n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ajo s VAL 37 N -3.63 5.26 0.03 1.61 1.01 -0.99 -5.05 120.40 118.64 1ajo s VAL 37 Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 1ajo s VAL 37 Cb 0.00 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 1ajo s VAL 37 CO 0.00 0.50 1.18 -0.22 0.00 0.00 0.00 175.10 176.56 1ajo s LEU 38 N -0.09 4.35 -0.02 3.92 1.98 -1.26 -1.70 118.68 125.86 1ajo s LEU 38 Ca 0.09 1.94 0.03 0.00 -2.89 0.00 0.00 54.13 53.30 1ajo s LEU 38 Cb -0.12 -3.57 -0.04 0.00 0.66 0.00 0.00 46.19 43.12 1ajo s LEU 38 CO 0.00 -0.47 0.04 0.29 -1.89 0.00 0.00 176.35 174.32 1ajo n LYS 39 N 4.19 2.02 -3.61 1.98 4.76 -0.08 -4.95 118.16 122.48 1ajo n LYS 39 Ca 0.09 -0.01 -0.14 0.00 -2.87 0.00 0.00 58.31 55.38 1ajo n LYS 39 Cb 0.47 -1.08 -0.07 0.00 -1.84 0.00 0.00 35.03 32.51 1ajo n LYS 39 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1ajo s HIS 40 N -2.14 -0.70 -0.04 2.13 2.46 -1.14 -5.01 115.29 110.84 1ajo s HIS 40 Ca -0.01 1.62 0.03 0.00 0.47 0.00 0.00 55.06 57.17 1ajo s HIS 40 Cb 0.01 0.32 0.00 0.00 -0.13 0.00 0.00 32.58 32.78 1ajo s HIS 40 CO 0.13 -0.40 -0.14 0.99 -2.47 0.00 0.00 174.74 172.85 1ajo s THR 41 N 0.01 1.19 -0.04 0.89 2.01 -1.26 -1.48 115.64 116.95 1ajo s THR 41 Ca -0.02 -0.57 0.06 0.00 0.31 0.00 0.00 61.69 61.48 1ajo s THR 41 Cb -0.04 -1.04 -0.01 0.00 0.01 0.00 0.00 72.50 71.42 1ajo s THR 41 CO 0.02 0.35 -0.24 0.00 -0.69 0.00 0.00 174.62 174.06 1ajo s ALA 42 N 0.20 2.04 0.00 7.40 0.00 0.40 -4.98 121.76 126.81 1ajo s ALA 42 Ca -0.06 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.90 1ajo s ALA 42 Cb -0.11 -0.60 0.00 0.00 0.00 0.00 0.00 23.12 22.40 1ajo s ALA 42 CO 0.02 0.42 0.10 0.25 0.00 0.00 0.00 175.76 176.55 1ajo n THR 43 N 2.84 0.00 -3.18 0.00 -2.24 -1.26 -1.26 114.28 109.18 1ajo n THR 43 Ca -0.17 -0.31 -0.39 0.00 -2.27 0.00 0.00 64.05 60.91 1ajo n THR 43 Cb 0.52 1.12 -0.06 0.00 -2.10 0.00 0.00 70.33 69.82 1ajo n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajo s ALA 44 N -0.42 3.46 -1.10 6.98 0.00 -1.26 -4.55 121.76 124.87 1ajo s ALA 44 Ca 0.00 0.04 -0.25 0.00 0.00 0.00 0.00 51.96 51.75 1ajo s ALA 44 Cb 0.00 -2.77 0.03 0.00 0.00 0.00 0.00 23.12 20.38 1ajo s ALA 44 CO 0.00 0.12 0.66 0.09 0.00 0.00 0.00 175.76 176.63 1ajo n ASN 45 N 2.90 -4.33 -4.73 0.00 3.02 -1.26 -4.89 115.26 105.97 1ajo n ASN 45 Ca -0.06 -1.21 -0.42 0.00 -0.03 0.00 0.00 54.58 52.86 1ajo n ASN 45 Cb 0.51 -1.63 -0.03 0.00 -0.61 0.00 0.00 39.78 38.01 1ajo n ASN 45 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ajo s ILE 46 N -3.37 3.83 0.78 2.41 -1.09 -1.26 -4.65 121.20 117.84 1ajo s ILE 46 Ca 0.35 1.44 -0.15 0.00 -2.23 0.00 0.00 60.65 60.06 1ajo s ILE 46 Cb -0.20 -3.92 0.02 0.00 -1.58 0.00 0.00 42.46 36.78 1ajo s ILE 46 CO 0.95 0.18 0.85 -2.65 -1.23 0.00 0.00 174.94 173.04 1ajo n PRO 47 N 3.12 0.26 0.00 2.79 -0.02 -1.26 -4.97 135.00 134.92 1ajo n PRO 47 Ca 0.06 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1ajo n PRO 47 Cb 0.46 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1ajo n PRO 47 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ajo n SER 48 N -1.71 0.11 -4.68 2.55 3.41 -1.26 -4.94 113.62 107.10 1ajo n SER 48 Ca 0.12 -1.02 -0.38 0.00 -0.26 0.00 0.00 58.87 57.32 1ajo n SER 48 Cb 0.50 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.38 1ajo n SER 48 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ajo s THR 49 N -0.02 5.17 0.34 6.66 2.01 -1.26 -5.00 115.64 123.54 1ajo s THR 49 Ca 0.00 0.82 -0.27 0.00 0.31 0.00 0.00 61.69 62.55 1ajo s THR 49 Cb 0.00 -3.77 -0.12 0.00 0.01 0.00 0.00 72.50 68.61 1ajo s THR 49 CO 0.00 0.25 1.18 -0.81 -0.69 0.00 0.00 174.62 174.55 1ajo n PRO 50 N 4.36 1.81 -4.36 4.92 -0.04 -1.26 -4.90 135.00 135.53 1ajo n PRO 50 Ca -0.07 0.64 -0.21 0.00 -0.04 0.00 0.00 63.50 63.81 1ajo n PRO 50 Cb 0.51 -2.16 -0.08 0.00 -0.04 0.00 0.00 33.50 31.72 1ajo n PRO 50 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1ajo s GLY 51 N -0.44 2.40 0.34 0.55 0.00 -0.66 -4.73 107.32 104.78 1ajo s GLY 51 Ca 0.57 -1.76 -0.15 0.00 0.00 0.00 0.00 44.72 43.39 1ajo s GLY 51 CO 0.61 -1.59 0.75 0.54 0.00 0.00 0.00 173.10 173.40 1ajo s LYS 52 N -3.57 4.00 -0.13 2.90 1.02 0.79 -0.67 119.74 124.08 1ajo s LYS 52 Ca 0.35 0.68 -0.23 0.00 0.02 0.00 0.00 55.97 56.79 1ajo s LYS 52 Cb 0.02 -2.41 -0.03 0.00 -0.52 0.00 0.00 37.83 34.89 1ajo s LYS 52 CO 0.22 0.13 0.68 0.42 -0.92 0.00 0.00 175.35 175.89 1ajo s ILE 53 N -2.03 5.02 0.13 2.17 1.01 -1.26 -0.95 121.20 125.29 1ajo s ILE 53 Ca 0.54 1.36 0.06 0.00 0.00 0.00 0.00 60.65 62.61 1ajo s ILE 53 Cb -0.10 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.32 1ajo s ILE 53 CO 0.18 0.18 -0.13 -0.04 0.00 0.00 0.00 174.94 175.12 1ajo s MET 54 N 1.35 1.04 -0.11 2.79 -1.94 0.13 -0.68 119.30 121.88 1ajo s MET 54 Ca 0.34 -1.28 -0.08 0.00 -1.71 0.00 0.00 55.69 52.96 1ajo s MET 54 Cb -0.17 -0.86 0.04 0.00 2.01 0.00 0.00 34.83 35.85 1ajo s MET 54 CO 0.14 0.16 0.27 -1.64 -0.01 0.00 0.00 175.02 173.94 1ajo s MET 55 N -2.86 0.28 0.30 2.03 -1.94 -0.61 -1.08 119.30 115.41 1ajo s MET 55 Ca 0.10 0.48 -0.14 0.00 -1.71 0.00 0.00 55.69 54.43 1ajo s MET 55 Cb -0.04 0.02 0.02 0.00 2.01 0.00 0.00 34.83 36.84 1ajo s MET 55 CO 0.03 -0.10 0.61 0.54 -0.01 0.00 0.00 175.02 176.08 1ajo s ASN 56 N 0.75 0.02 -0.11 3.03 2.20 -1.22 -0.50 114.94 119.12 1ajo s ASN 56 Ca -0.05 -0.96 -0.05 0.00 -0.94 0.00 0.00 52.86 50.86 1ajo s ASN 56 Cb -0.06 0.69 0.05 0.00 -2.00 0.00 0.00 41.25 39.93 1ajo s ASN 56 CO -0.05 -1.34 0.24 -0.22 -2.94 0.00 0.00 177.10 172.80 1ajo s LEU 57 N -3.03 0.09 0.16 3.54 2.96 -0.76 -1.74 118.68 119.89 1ajo s LEU 57 Ca 0.19 0.53 -0.17 0.00 -0.22 0.00 0.00 54.13 54.45 1ajo s LEU 57 Cb -0.03 0.66 0.03 0.00 0.50 0.00 0.00 46.19 47.36 1ajo s LEU 57 CO 0.11 -0.20 0.47 -1.66 -1.32 0.00 0.00 176.35 173.74 1ajo s TRP 58 N 1.82 -0.18 -0.05 5.38 1.48 -0.73 -3.13 118.94 123.53 1ajo s TRP 58 Ca -0.04 -0.14 -0.02 0.00 -1.06 0.00 0.00 56.10 54.84 1ajo s TRP 58 Cb -0.11 0.33 -0.04 0.00 -1.16 0.00 0.00 33.47 32.49 1ajo s TRP 58 CO -0.08 -0.80 0.08 0.54 -4.06 0.00 0.00 176.95 172.63 1ajo s ASN 59 N -2.83 5.77 0.34 -2.66 4.22 -1.26 -1.56 114.94 116.96 1ajo s ASN 59 Ca 0.06 0.23 0.07 0.00 -2.14 0.00 0.00 52.86 51.08 1ajo s ASN 59 Cb 0.00 -1.71 -0.01 0.00 1.28 0.00 0.00 41.25 40.81 1ajo s ASN 59 CO -0.08 0.33 0.44 -0.83 -2.04 0.00 0.00 177.10 174.92 1ajo s GLY 60 N -1.36 1.66 -0.03 0.45 0.00 -0.86 -1.46 107.32 105.72 1ajo s GLY 60 Ca 0.19 -1.51 -0.05 0.00 0.00 0.00 0.00 44.72 43.35 1ajo s GLY 60 CO 0.09 -1.43 0.12 -1.08 0.00 0.00 0.00 173.10 170.80 1ajo s THR 61 N -2.21 0.03 0.00 0.90 -1.32 0.31 -4.64 115.64 108.70 1ajo s THR 61 Ca 0.45 -0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.67 1ajo s THR 61 Cb -0.09 -0.25 0.00 0.00 -1.51 0.00 0.00 72.50 70.65 1ajo s THR 61 CO 0.30 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 173.18 1ajo n GLY 62 N 2.49 0.51 2.46 6.08 0.00 -1.26 -4.50 105.19 110.97 1ajo n GLY 62 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 1ajo n GLY 62 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ajo n VAL 63 N -2.76 1.86 -0.29 1.61 0.24 -1.26 -4.91 118.33 112.82 1ajo n VAL 63 Ca 0.00 -3.69 0.05 0.00 -2.04 0.00 0.00 64.34 58.66 1ajo n VAL 63 Cb 0.05 -0.04 0.26 0.00 -1.47 0.00 0.00 33.84 32.64 1ajo n VAL 63 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1ajo h ASP 64 N 2.49 0.86 -0.66 -1.34 5.19 -1.90 0.12 116.42 121.18 1ajo h ASP 64 Ca 0.12 0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.50 1ajo h ASP 64 Cb 1.32 -0.17 -0.03 0.00 0.18 0.00 0.00 39.33 40.63 1ajo h ASP 64 CO 0.53 0.54 0.25 0.44 -3.12 0.00 0.00 179.24 177.88 1ajo h ASP 65 N 0.97 0.92 0.29 6.45 3.32 -1.90 0.60 116.42 127.06 1ajo h ASP 65 Ca 0.39 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 1ajo h ASP 65 Cb 0.27 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1ajo h ASP 65 CO -0.15 0.85 -0.14 -0.25 -1.72 0.00 0.00 179.24 177.83 1ajo h TRP 66 N 0.94 -0.36 -0.00 4.55 7.01 -1.69 -3.40 115.95 123.00 1ajo h TRP 66 Ca 0.22 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.21 1ajo h TRP 66 Cb 0.23 0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.41 1ajo h TRP 66 CO 0.02 -0.16 -0.74 1.28 -2.79 0.00 0.00 178.44 176.05 1ajo n LEU 67 N -5.04 0.78 -0.40 0.65 4.77 0.30 -5.03 117.00 113.03 1ajo n LEU 67 Ca -0.06 -0.26 0.05 0.00 -0.03 0.00 0.00 56.01 55.71 1ajo n LEU 67 Cb 0.19 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1ajo n LEU 67 CO 0.15 0.19 -0.18 0.61 -1.33 0.00 0.00 177.39 176.84 1ajo n GLY 68 N 1.50 -2.85 3.76 -0.72 0.00 0.20 -1.50 105.19 105.58 1ajo n GLY 68 Ca 0.05 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 1ajo n GLY 68 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ajo s SER 69 N -4.84 6.78 -0.03 1.61 0.15 -1.26 -3.44 113.70 112.67 1ajo s SER 69 Ca 0.00 2.66 -0.23 0.00 0.70 0.00 0.00 55.95 59.08 1ajo s SER 69 Cb 0.00 -2.64 -0.04 0.00 -1.71 0.00 0.00 66.02 61.62 1ajo s SER 69 CO 0.00 -0.55 0.69 -0.47 1.20 0.00 0.00 173.24 174.12 1ajo s TYR 70 N -0.95 3.64 -0.33 3.44 5.04 -1.26 -3.44 117.35 123.49 1ajo s TYR 70 Ca 0.50 1.29 0.15 0.00 -2.44 0.00 0.00 57.07 56.57 1ajo s TYR 70 Cb -0.40 -2.76 0.67 0.00 0.35 0.00 0.00 41.96 39.82 1ajo s TYR 70 CO 0.51 0.19 1.58 0.27 -1.34 0.00 0.00 175.55 176.76 1ajo n ASN 71 N 3.33 4.76 0.00 4.32 6.94 -1.26 -4.97 115.26 128.37 1ajo n ASN 71 Ca -0.03 -2.89 0.00 0.00 -0.02 0.00 0.00 54.58 51.64 1ajo n ASN 71 Cb 0.51 -0.60 0.00 0.00 -2.36 0.00 0.00 39.78 37.33 1ajo n ASN 71 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ajo n GLY 72 N 0.18 1.28 3.63 4.83 0.00 -1.26 -4.99 105.19 108.85 1ajo n GLY 72 Ca 0.24 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.78 1ajo n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajo n ALA 73 N 0.74 0.15 -3.52 4.61 0.00 -1.26 -4.97 120.51 116.26 1ajo n ALA 73 Ca 0.00 0.46 -0.12 0.00 0.00 0.00 0.00 53.44 53.79 1ajo n ALA 73 Cb 0.00 -2.18 -0.04 0.00 0.00 0.00 0.00 19.45 17.23 1ajo n ALA 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ajo s ASN 74 N 0.43 -0.46 0.49 0.00 2.20 -1.26 -4.67 114.94 111.67 1ajo s ASN 74 Ca 0.77 0.28 -0.19 0.00 -0.94 0.00 0.00 52.86 52.78 1ajo s ASN 74 Cb -0.79 0.42 -0.09 0.00 -2.00 0.00 0.00 41.25 38.80 1ajo s ASN 74 CO 0.46 -0.58 1.00 -2.16 -2.94 0.00 0.00 177.10 172.89 1ajo s PRO 75 N -2.15 3.92 0.05 3.55 0.04 -1.26 -5.01 135.00 134.15 1ajo s PRO 75 Ca -0.01 1.17 0.06 0.00 0.04 0.00 0.00 61.00 62.25 1ajo s PRO 75 Cb -0.01 -2.13 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 1ajo s PRO 75 CO -0.02 -0.30 -0.16 -0.51 0.04 0.00 0.00 177.00 176.04 1ajo s LEU 76 N -3.64 2.21 0.01 -3.56 1.43 -0.58 -4.97 118.68 109.59 1ajo s LEU 76 Ca 0.63 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 1ajo s LEU 76 Cb -0.12 -0.71 -0.01 0.00 0.03 0.00 0.00 46.19 45.38 1ajo s LEU 76 CO 0.22 0.04 -0.05 -0.31 0.23 0.00 0.00 176.35 176.49 1ajo s TYR 77 N -0.95 0.40 -0.09 0.29 2.02 -1.26 -1.26 117.35 116.50 1ajo s TYR 77 Ca 0.03 -0.26 0.04 0.00 -0.37 0.00 0.00 57.07 56.51 1ajo s TYR 77 Cb -0.09 -0.25 0.00 0.00 -0.40 0.00 0.00 41.96 41.22 1ajo s TYR 77 CO 0.02 -0.06 -0.23 0.00 -1.57 0.00 0.00 175.55 173.72 1ajo s ALA 78 N -0.66 2.07 0.13 3.71 0.00 -0.75 -3.54 121.76 122.72 1ajo s ALA 78 Ca -0.05 -0.92 0.11 0.00 0.00 0.00 0.00 51.96 51.11 1ajo s ALA 78 Cb -0.05 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.26 1ajo s ALA 78 CO -0.00 0.28 -0.25 -1.21 0.00 0.00 0.00 175.76 174.58 1ajo s GLU 79 N 0.32 1.47 -0.09 0.00 2.02 -0.25 -1.03 118.70 121.14 1ajo s GLU 79 Ca -0.17 -1.34 -0.02 0.00 0.02 0.00 0.00 54.97 53.47 1ajo s GLU 79 Cb -0.17 -1.93 0.03 0.00 0.10 0.00 0.00 34.13 32.16 1ajo s GLU 79 CO 0.08 0.45 0.01 0.71 0.02 0.00 0.00 175.26 176.53 1ajo s TYR 80 N -1.12 0.64 -0.05 1.61 1.51 -0.27 -0.27 117.35 119.41 1ajo s TYR 80 Ca 0.15 -0.21 0.02 0.00 -1.01 0.00 0.00 57.07 56.01 1ajo s TYR 80 Cb -0.10 -0.80 -0.25 0.00 -0.11 0.00 0.00 41.96 40.70 1ajo s TYR 80 CO 0.07 -0.36 0.65 0.22 -1.11 0.00 0.00 175.55 175.03 1ajo h ASP 81 N 8.33 0.25 -4.79 2.29 3.58 -1.33 0.18 116.42 124.93 1ajo h ASP 81 Ca -0.18 -0.46 0.08 0.00 0.42 0.00 0.00 57.03 56.89 1ajo h ASP 81 Cb 1.12 -0.08 -0.14 0.00 1.72 0.00 0.00 39.33 41.96 1ajo h ASP 81 CO 0.26 1.40 0.42 -1.66 -2.88 0.00 0.00 179.24 176.78 1ajo s TRP 82 N -2.60 -0.37 -0.04 0.28 1.48 -1.24 -4.43 118.94 112.02 1ajo s TRP 82 Ca -0.11 0.20 0.02 0.00 -1.06 0.00 0.00 56.10 55.15 1ajo s TRP 82 Cb 0.07 0.56 0.01 0.00 -1.16 0.00 0.00 33.47 32.94 1ajo s TRP 82 CO 0.82 -0.65 -0.10 0.08 -4.06 0.00 0.00 176.95 173.03 1ajo s VAL 83 N -3.30 0.90 -0.06 -0.66 1.01 -0.56 -1.94 120.40 115.80 1ajo s VAL 83 Ca 0.05 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1ajo s VAL 83 Cb -0.01 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.56 1ajo s VAL 83 CO -0.09 0.29 -0.15 -0.75 0.00 0.00 0.00 175.10 174.40 1ajo s LYS 84 N 0.38 1.82 -0.15 2.72 2.20 0.45 -0.97 119.74 126.19 1ajo s LYS 84 Ca -0.07 -0.51 0.02 0.00 -0.36 0.00 0.00 55.97 55.05 1ajo s LYS 84 Cb -0.11 -1.50 0.01 0.00 -1.51 0.00 0.00 37.83 34.72 1ajo s LYS 84 CO 0.01 0.11 -0.21 -0.47 -0.36 0.00 0.00 175.35 174.43 1ajo s TYR 85 N 0.43 2.69 -0.36 4.03 5.04 -0.67 0.07 117.35 128.58 1ajo s TYR 85 Ca -0.12 -1.43 -0.05 0.00 -2.44 0.00 0.00 57.07 53.03 1ajo s TYR 85 Cb -0.14 -1.84 0.07 0.00 0.35 0.00 0.00 41.96 40.39 1ajo s TYR 85 CO 0.04 -0.67 0.14 0.99 -1.34 0.00 0.00 175.55 174.70 1ajo s THR 86 N 0.97 3.61 0.67 4.34 2.01 0.12 -2.13 115.64 125.24 1ajo s THR 86 Ca -0.03 -1.44 -0.16 0.00 0.31 0.00 0.00 61.69 60.37 1ajo s THR 86 Cb -0.15 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.19 1ajo s THR 86 CO -0.05 -0.34 1.15 -0.55 -0.69 0.00 0.00 174.62 174.13 1ajo s SER 87 N 1.62 4.87 0.41 3.53 0.15 -1.26 -1.36 113.70 121.67 1ajo s SER 87 Ca 0.01 2.17 0.22 0.00 0.70 0.00 0.00 55.95 59.04 1ajo s SER 87 Cb -0.21 -2.57 0.77 0.00 -1.71 0.00 0.00 66.02 62.30 1ajo s SER 87 CO 0.00 -1.79 1.77 0.78 1.20 0.00 0.00 173.24 175.19 1ajo h ASN 88 N 0.11 0.00 -4.61 5.45 4.21 -1.94 -3.47 115.58 115.34 1ajo h ASN 88 Ca -0.48 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.03 1ajo h ASN 88 Cb 1.27 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.47 1ajo h ASN 88 CO 0.53 0.28 0.00 0.00 -1.29 0.00 0.00 177.43 176.95 1ajo n GLN 89 N -3.41 0.00 -0.07 0.81 1.13 -1.26 -5.06 117.38 109.51 1ajo n GLN 89 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1ajo n GLN 89 Cb 0.48 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.83 1ajo n GLN 89 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ajo n GLY 91 N -1.39 -0.21 0.00 1.08 0.00 -1.26 -5.00 105.19 98.42 1ajo n GLY 91 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1ajo n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajo n GLY 92 N 5.00 -0.44 3.60 -0.02 0.00 -1.26 -5.08 105.19 106.98 1ajo n GLY 92 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1ajo n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ajo s SER 93 N -0.05 2.01 -0.12 1.61 0.01 -1.26 -4.70 113.70 111.19 1ajo s SER 93 Ca 0.00 1.49 -0.30 0.00 1.31 0.00 0.00 55.95 58.45 1ajo s SER 93 Cb 0.00 -2.19 0.12 0.00 0.21 0.00 0.00 66.02 64.16 1ajo s SER 93 CO 0.00 -3.55 0.96 0.72 0.41 0.00 0.00 173.24 171.78 1ajo s PHE 94 N -2.70 -0.38 -0.10 2.43 -0.12 -0.91 -4.99 117.98 111.21 1ajo s PHE 94 Ca 0.67 0.56 0.02 0.00 -0.05 0.00 0.00 56.93 58.12 1ajo s PHE 94 Cb -0.22 0.47 0.01 0.00 -0.63 0.00 0.00 43.02 42.65 1ajo s PHE 94 CO 0.61 -0.40 -0.16 0.12 -0.05 0.00 0.00 175.22 175.34 1ajo s PHE 95 N -1.58 1.97 -0.26 3.49 5.36 -1.26 -1.67 117.98 124.03 1ajo s PHE 95 Ca -0.01 -0.90 0.02 0.00 -0.96 0.00 0.00 56.93 55.08 1ajo s PHE 95 Cb -0.01 -1.41 0.06 0.00 -0.34 0.00 0.00 43.02 41.32 1ajo s PHE 95 CO -0.00 -0.46 -0.08 -2.00 -1.46 0.00 0.00 175.22 171.22 1ajo s GLU 96 N 0.91 2.00 0.03 10.12 2.56 -0.14 -5.00 118.70 129.19 1ajo s GLU 96 Ca -0.08 -1.27 0.27 0.00 0.00 0.00 0.00 54.97 53.89 1ajo s GLU 96 Cb -0.15 -2.81 0.93 0.00 2.00 0.00 0.00 34.13 34.10 1ajo s GLU 96 CO -0.00 -0.60 1.74 -0.35 -0.56 0.00 0.00 175.26 175.48 1ajo n PRO 97 N 4.50 0.05 -3.32 4.30 -0.04 -1.26 -1.49 135.00 137.74 1ajo n PRO 97 Ca -0.12 0.03 -0.17 0.00 -0.04 0.00 0.00 63.50 63.20 1ajo n PRO 97 Cb 0.43 -1.55 0.07 0.00 -0.04 0.00 0.00 33.50 32.41 1ajo n PRO 97 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1ajo n PHE 98 N -1.63 -2.14 0.11 0.54 3.72 -1.26 -4.64 117.46 112.16 1ajo n PHE 98 Ca 0.06 0.84 -0.21 0.00 -0.05 0.00 0.00 57.45 58.09 1ajo n PHE 98 Cb 0.36 -4.58 -0.13 0.00 -0.94 0.00 0.00 39.48 34.19 1ajo n PHE 98 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1ajo h ASN 99 N -1.93 0.73 -5.05 4.37 2.35 -1.93 -3.28 115.58 110.84 1ajo h ASN 99 Ca -0.50 -0.71 0.05 0.00 -0.55 0.00 0.00 56.30 54.59 1ajo h ASN 99 Cb 1.30 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.41 1ajo h ASN 99 CO 0.45 1.54 0.29 -0.94 -1.65 0.00 0.00 177.43 177.11 1ajo s SER 100 N -7.37 -0.15 0.02 5.81 1.04 -1.26 -4.79 113.70 107.00 1ajo s SER 100 Ca -0.08 -0.79 -0.30 0.00 0.48 0.00 0.00 55.95 55.26 1ajo s SER 100 Cb 0.06 0.74 -0.06 0.00 0.10 0.00 0.00 66.02 66.85 1ajo s SER 100 CO 0.92 -1.41 1.50 -0.47 0.98 0.00 0.00 173.24 174.76 1ajo s TYR 101 N -3.20 2.66 -0.39 5.02 5.04 -1.26 -4.99 117.35 120.22 1ajo s TYR 101 Ca 0.13 0.61 0.01 0.00 -2.44 0.00 0.00 57.07 55.38 1ajo s TYR 101 Cb -0.05 -3.78 0.11 0.00 0.35 0.00 0.00 41.96 38.58 1ajo s TYR 101 CO 0.08 -3.02 0.14 1.21 -1.34 0.00 0.00 175.55 172.61 1ajo s ASN 102 N 2.13 4.98 0.43 4.32 3.84 -1.26 -4.97 114.94 124.41 1ajo s ASN 102 Ca 0.68 -2.16 0.30 0.00 0.21 0.00 0.00 52.86 51.89 1ajo s ASN 102 Cb -0.34 -1.72 1.25 0.00 -0.55 0.00 0.00 41.25 39.88 1ajo s ASN 102 CO 0.29 -0.45 1.88 0.77 -2.79 0.00 0.00 177.10 176.80 1ajo h SER 103 N 7.74 0.00 0.22 -4.21 4.64 -1.95 -1.10 113.55 118.89 1ajo h SER 103 Ca -0.08 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.13 1ajo h SER 103 Cb 1.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.10 1ajo h SER 103 CO 0.61 0.00 -0.41 1.23 -0.87 0.00 0.00 176.83 177.39 1ajo h GLY 104 N 1.98 0.27 0.00 -0.77 0.00 -2.04 -3.36 103.07 99.15 1ajo h GLY 104 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1ajo h GLY 104 CO 0.00 0.23 -1.25 -1.30 0.00 0.00 0.00 176.54 174.23 1ajo n THR 105 N -4.03 0.00 -4.32 4.70 -2.24 -1.00 -4.82 114.28 102.57 1ajo n THR 105 Ca -0.01 -0.24 -0.17 0.00 -2.27 0.00 0.00 64.05 61.36 1ajo n THR 105 Cb 0.48 0.43 -0.10 0.00 -2.10 0.00 0.00 70.33 69.03 1ajo n THR 105 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1ajo s TRP 106 N -2.54 1.53 0.01 4.78 0.52 -0.45 -0.79 118.94 122.01 1ajo s TRP 106 Ca -0.02 -0.90 -0.07 0.00 0.02 0.00 0.00 56.10 55.13 1ajo s TRP 106 Cb 0.07 -0.88 -0.00 0.00 -1.15 0.00 0.00 33.47 31.51 1ajo s TRP 106 CO 0.42 -0.02 0.13 -1.83 0.02 0.00 0.00 176.95 175.66 1ajo s GLU 107 N -3.85 0.51 -0.13 4.98 -1.05 0.60 -4.41 118.70 115.35 1ajo s GLU 107 Ca 0.27 -0.49 -0.10 0.00 -0.15 0.00 0.00 54.97 54.51 1ajo s GLU 107 Cb 0.05 0.21 -0.05 0.00 -0.44 0.00 0.00 34.13 33.91 1ajo s GLU 107 CO 0.08 -0.12 0.19 0.15 0.95 0.00 0.00 175.26 176.51 1ajo s LYS 108 N -1.68 3.84 0.33 -4.83 1.02 -1.26 -1.19 119.74 115.96 1ajo s LYS 108 Ca -0.13 -0.05 -0.28 0.00 0.02 0.00 0.00 55.97 55.53 1ajo s LYS 108 Cb -0.06 -3.30 -0.10 0.00 -0.52 0.00 0.00 37.83 33.85 1ajo s LYS 108 CO 0.00 0.55 1.23 0.00 -0.92 0.00 0.00 175.35 176.21 1ajo s ALA 109 N -0.41 3.43 -0.20 5.17 0.00 -0.67 -4.85 121.76 124.23 1ajo s ALA 109 Ca 0.14 1.13 -0.10 0.00 0.00 0.00 0.00 51.96 53.13 1ajo s ALA 109 Cb -0.12 -3.43 0.08 0.00 0.00 0.00 0.00 23.12 19.65 1ajo s ALA 109 CO 0.03 -0.50 0.47 0.34 0.00 0.00 0.00 175.76 176.11 1ajo s ASP 110 N -0.68 -0.56 0.00 0.00 2.15 -1.26 -3.05 116.67 113.28 1ajo s ASP 110 Ca 0.49 1.07 0.00 0.00 0.43 0.00 0.00 52.55 54.53 1ajo s ASP 110 Cb -0.37 1.13 0.00 0.00 -0.30 0.00 0.00 42.92 43.38 1ajo s ASP 110 CO 0.48 -0.21 0.00 0.61 -0.17 0.00 0.00 175.17 175.88 1ajo n GLY 111 N 4.66 0.71 3.30 2.66 0.00 0.61 -4.95 105.19 112.17 1ajo n GLY 111 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1ajo n GLY 111 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ajo s TYR 112 N -2.21 0.98 0.13 1.61 1.13 -1.26 -4.94 117.35 112.79 1ajo s TYR 112 Ca 0.00 -1.23 0.09 0.00 -1.41 0.00 0.00 57.07 54.52 1ajo s TYR 112 Cb 0.00 -0.38 -0.04 0.00 -1.10 0.00 0.00 41.96 40.44 1ajo s TYR 112 CO 0.00 -0.73 -0.17 0.45 -2.51 0.00 0.00 175.55 172.59 1ajo s SER 113 N -3.13 3.92 0.50 -0.18 0.15 -1.26 -1.71 113.70 111.99 1ajo s SER 113 Ca 0.35 -0.58 0.29 0.00 0.70 0.00 0.00 55.95 56.72 1ajo s SER 113 Cb 0.05 -0.56 0.94 0.00 -1.71 0.00 0.00 66.02 64.74 1ajo s SER 113 CO 0.12 0.16 1.83 0.78 1.20 0.00 0.00 173.24 177.33 1ajo h ASN 114 N 3.58 0.00 -2.78 5.45 4.21 -1.85 -3.49 115.58 120.70 1ajo h ASN 114 Ca -0.49 0.00 0.09 0.00 1.21 0.00 0.00 56.30 57.11 1ajo h ASN 114 Cb 1.18 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.35 1ajo h ASN 114 CO 0.47 0.01 -0.12 0.61 -1.29 0.00 0.00 177.43 177.11 1ajo n GLY 115 N 0.47 -1.67 7.00 2.83 0.00 -1.25 -4.91 105.19 107.66 1ajo n GLY 115 Ca 0.02 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1ajo n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajo n GLY 116 N -1.15 2.71 0.10 -0.02 0.00 -1.26 -2.76 105.19 102.82 1ajo n GLY 116 Ca 0.00 -0.32 0.12 0.00 0.00 0.00 0.00 46.02 45.83 1ajo n GLY 116 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1ajo h VAL 117 N 0.00 0.00 -3.33 1.61 -1.51 -1.91 -3.45 116.25 107.65 1ajo h VAL 117 Ca 0.00 -0.58 -0.57 0.00 -1.23 0.00 0.00 66.70 64.33 1ajo h VAL 117 Cb 0.00 1.37 -0.06 0.00 -2.13 0.00 0.00 31.29 30.47 1ajo h VAL 117 CO 0.00 0.00 0.98 -0.36 -1.23 0.00 0.00 177.57 176.96 1ajo s PHE 118 N -3.16 2.67 -0.68 5.19 0.40 -1.11 -0.53 117.98 120.75 1ajo s PHE 118 Ca 0.08 0.80 0.01 0.00 -0.60 0.00 0.00 56.93 57.22 1ajo s PHE 118 Cb 0.12 -4.14 0.38 0.00 0.51 0.00 0.00 43.02 39.89 1ajo s PHE 118 CO 0.67 -1.61 1.66 -1.71 0.70 0.00 0.00 175.22 174.93 1ajo n ASN 119 N 7.98 6.41 -3.55 1.36 5.15 -0.54 -3.93 115.26 128.15 1ajo n ASN 119 Ca 0.14 -3.79 -0.11 0.00 -0.60 0.00 0.00 54.58 50.22 1ajo n ASN 119 Cb 0.48 -0.82 -0.03 0.00 -0.53 0.00 0.00 39.78 38.88 1ajo n ASN 119 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ajo s THR 121 N -3.80 4.74 0.26 0.00 2.01 -0.40 -4.47 115.64 113.99 1ajo s THR 121 Ca 0.04 -0.06 -0.29 0.00 0.31 0.00 0.00 61.69 61.68 1ajo s THR 121 Cb -0.01 -3.09 -0.09 0.00 0.01 0.00 0.00 72.50 69.32 1ajo s THR 121 CO -0.09 0.53 1.19 0.26 -0.69 0.00 0.00 174.62 175.81 1ajo s TRP 122 N -0.19 3.40 -0.03 4.92 0.52 -0.70 0.53 118.94 127.40 1ajo s TRP 122 Ca 0.07 1.54 0.03 0.00 0.02 0.00 0.00 56.10 57.76 1ajo s TRP 122 Cb -0.12 -3.43 -0.00 0.00 -1.15 0.00 0.00 33.47 28.77 1ajo s TRP 122 CO 0.01 -1.10 -0.11 1.03 0.02 0.00 0.00 176.95 176.81 1ajo s ARG 123 N -1.14 1.09 0.50 4.98 1.81 -0.64 -0.29 118.95 125.26 1ajo s ARG 123 Ca 0.48 -0.38 0.22 0.00 -1.72 0.00 0.00 55.73 54.33 1ajo s ARG 123 Cb -0.34 -1.01 1.29 0.00 -0.45 0.00 0.00 34.95 34.43 1ajo s ARG 123 CO 0.43 0.16 2.06 0.00 -0.68 0.00 0.00 175.30 177.27 1ajo h ALA 124 N 6.25 1.50 0.00 2.13 0.00 -1.86 -2.06 119.26 125.23 1ajo h ALA 124 Ca -0.33 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1ajo h ALA 124 Cb 1.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1ajo h ALA 124 CO 0.49 0.17 0.00 -0.91 0.00 0.00 0.00 179.25 179.00 1ajo h ASN 125 N 0.00 0.00 -0.24 0.00 2.35 -1.95 -2.96 115.58 112.78 1ajo h ASN 125 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ajo h ASN 125 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1ajo h ASN 125 CO 0.02 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.39 1ajo n ASN 126 N -2.82 1.56 -4.20 5.81 4.13 -0.77 -4.68 115.26 114.29 1ajo n ASN 126 Ca 0.01 -1.87 -0.37 0.00 1.68 0.00 0.00 54.58 54.04 1ajo n ASN 126 Cb 0.30 -0.16 -0.12 0.00 -1.54 0.00 0.00 39.78 38.25 1ajo n ASN 126 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1ajo s VAL 127 N -1.68 3.44 0.28 2.41 1.01 -1.12 -0.57 120.40 124.17 1ajo s VAL 127 Ca 0.25 -1.48 0.05 0.00 0.00 0.00 0.00 61.98 60.80 1ajo s VAL 127 Cb 0.13 -3.08 -0.06 0.00 0.00 0.00 0.00 36.38 33.38 1ajo s VAL 127 CO 0.18 -0.32 -0.02 0.20 0.00 0.00 0.00 175.10 175.14 1ajo s ASN 128 N 1.54 2.54 -0.19 3.32 0.01 -0.72 -5.00 114.94 116.44 1ajo s ASN 128 Ca 0.00 -1.24 -0.01 0.00 -0.71 0.00 0.00 52.86 50.90 1ajo s ASN 128 Cb -0.21 -0.12 0.01 0.00 0.41 0.00 0.00 41.25 41.33 1ajo s ASN 128 CO -0.00 -0.43 -0.13 -0.36 -1.51 0.00 0.00 177.10 174.66 1ajo s PHE 129 N -3.14 2.85 0.97 2.20 0.40 -1.26 -0.74 117.98 119.26 1ajo s PHE 129 Ca 0.31 -1.31 -0.12 0.00 -0.60 0.00 0.00 56.93 55.21 1ajo s PHE 129 Cb 0.05 -1.99 0.17 0.00 0.51 0.00 0.00 43.02 41.76 1ajo s PHE 129 CO 0.12 -0.67 1.09 0.95 0.70 0.00 0.00 175.22 177.41 1ajo s THR 130 N 1.33 2.24 -0.09 0.64 -4.23 -0.36 -4.90 115.64 110.26 1ajo s THR 130 Ca 0.04 0.08 0.14 0.00 -1.18 0.00 0.00 61.69 60.77 1ajo s THR 130 Cb -0.14 -2.58 0.03 0.00 1.34 0.00 0.00 72.50 71.15 1ajo s THR 130 CO -0.08 -0.10 1.44 0.78 -0.54 0.00 0.00 174.62 176.12 1ajo h ASN 131 N -1.79 0.00 -0.34 3.99 2.35 -1.95 -2.90 115.58 114.95 1ajo h ASN 131 Ca -0.53 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.14 1ajo h ASN 131 Cb 1.32 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.64 1ajo h ASN 131 CO 0.57 0.57 0.11 -0.90 -1.65 0.00 0.00 177.43 176.12 1ajo n ASP 132 N -3.26 3.29 -1.52 5.81 5.75 -1.26 -4.91 116.55 120.45 1ajo n ASP 132 Ca 0.02 -2.55 -0.04 0.00 -0.01 0.00 0.00 54.79 52.21 1ajo n ASP 132 Cb 0.75 -0.61 0.02 0.00 -1.03 0.00 0.00 41.12 40.25 1ajo n ASP 132 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ajo n GLY 133 N 0.10 0.28 3.35 6.12 0.00 -1.09 -5.07 105.19 108.88 1ajo n GLY 133 Ca 0.18 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1ajo n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ajo s LYS 134 N -4.35 1.76 0.08 1.61 1.02 -1.24 -4.60 119.74 114.02 1ajo s LYS 134 Ca 0.01 -1.14 -0.30 0.00 0.02 0.00 0.00 55.97 54.56 1ajo s LYS 134 Cb -0.00 -1.97 -0.05 0.00 -0.52 0.00 0.00 37.83 35.28 1ajo s LYS 134 CO 0.16 0.51 1.03 -1.17 -0.92 0.00 0.00 175.35 174.96 1ajo s LEU 135 N -1.34 4.43 -0.19 3.17 0.20 0.62 -1.23 118.68 124.35 1ajo s LEU 135 Ca 0.12 1.84 -0.01 0.00 0.69 0.00 0.00 54.13 56.77 1ajo s LEU 135 Cb -0.10 -3.58 0.05 0.00 -0.43 0.00 0.00 46.19 42.13 1ajo s LEU 135 CO 0.03 -0.23 -0.01 -0.75 -0.29 0.00 0.00 176.35 175.10 1ajo s LYS 136 N 0.44 1.07 -0.07 1.98 2.20 0.08 -1.11 119.74 124.33 1ajo s LYS 136 Ca 0.51 -0.56 -0.13 0.00 -0.36 0.00 0.00 55.97 55.44 1ajo s LYS 136 Cb -0.25 -2.15 -0.05 0.00 -1.51 0.00 0.00 37.83 33.88 1ajo s LYS 136 CO 0.30 -0.57 0.31 -0.51 -0.36 0.00 0.00 175.35 174.53 1ajo s LEU 137 N 1.70 4.40 0.09 5.43 1.43 -0.20 -1.76 118.68 129.78 1ajo s LEU 137 Ca -0.01 0.74 0.07 0.00 -1.03 0.00 0.00 54.13 53.89 1ajo s LEU 137 Cb -0.17 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 1ajo s LEU 137 CO -0.07 0.30 -0.18 -0.83 0.23 0.00 0.00 176.35 175.79 1ajo s GLY 138 N -0.72 1.10 -0.45 -3.19 0.00 0.26 -1.81 107.32 102.52 1ajo s GLY 138 Ca 0.20 -1.16 -0.03 0.00 0.00 0.00 0.00 44.72 43.73 1ajo s GLY 138 CO 0.09 -1.18 0.25 -2.27 0.00 0.00 0.00 173.10 169.99 1ajo s LEU 139 N -1.88 5.24 0.00 0.66 2.96 -0.39 -3.82 118.68 121.45 1ajo s LEU 139 Ca 0.04 -2.20 0.04 0.00 -0.22 0.00 0.00 54.13 51.78 1ajo s LEU 139 Cb -0.10 -1.83 0.04 0.00 0.50 0.00 0.00 46.19 44.80 1ajo s LEU 139 CO 0.04 -0.51 0.31 0.35 -1.32 0.00 0.00 176.35 175.22 1ajo n THR 140 N 4.37 0.00 -4.44 3.68 -2.24 -0.64 -1.52 114.28 113.49 1ajo n THR 140 Ca -0.00 -2.15 -0.22 0.00 -2.27 0.00 0.00 64.05 59.41 1ajo n THR 140 Cb 0.41 0.07 -0.16 0.00 -2.10 0.00 0.00 70.33 68.54 1ajo n THR 140 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ajo s SER 141 N -4.03 1.40 -0.00 3.42 0.15 -1.26 -1.14 113.70 112.24 1ajo s SER 141 Ca 0.24 -0.22 0.21 0.00 0.70 0.00 0.00 55.95 56.87 1ajo s SER 141 Cb -0.02 -0.56 -0.24 0.00 -1.71 0.00 0.00 66.02 63.50 1ajo s SER 141 CO 0.15 0.03 0.87 -1.54 1.20 0.00 0.00 173.24 173.95 1ajo n SER 142 N 3.66 0.93 -3.60 5.45 3.41 -1.15 -4.99 113.62 117.33 1ajo n SER 142 Ca -0.22 -0.93 -0.05 0.00 -0.26 0.00 0.00 58.87 57.42 1ajo n SER 142 Cb 0.52 1.07 -0.02 0.00 -0.26 0.00 0.00 64.21 65.53 1ajo n SER 142 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ajo s ALA 143 N -3.03 -1.90 0.15 7.33 0.00 -1.26 -5.04 121.76 118.01 1ajo s ALA 143 Ca 0.07 0.89 -0.34 0.00 0.00 0.00 0.00 51.96 52.58 1ajo s ALA 143 Cb 0.16 0.34 -0.16 0.00 0.00 0.00 0.00 23.12 23.46 1ajo s ALA 143 CO 0.87 -0.81 1.30 0.98 0.00 0.00 0.00 175.76 178.11 1ajo n TYR 144 N -0.30 1.58 -3.62 0.00 9.36 -1.26 -1.84 117.16 121.09 1ajo n TYR 144 Ca -0.06 0.59 -0.26 0.00 3.32 0.00 0.00 57.90 61.50 1ajo n TYR 144 Cb 0.61 -2.35 -0.03 0.00 -0.63 0.00 0.00 39.34 36.94 1ajo n TYR 144 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1ajo n ASN 145 N 2.37 -2.56 -4.00 2.98 5.03 -1.26 -4.96 115.26 112.86 1ajo n ASN 145 Ca 0.16 -0.52 -0.30 0.00 0.87 0.00 0.00 54.58 54.79 1ajo n ASN 145 Cb 0.24 -2.17 -0.16 0.00 -1.02 0.00 0.00 39.78 36.66 1ajo n ASN 145 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1ajo s LYS 146 N -6.25 2.12 0.02 3.52 2.20 -0.77 -5.12 119.74 115.46 1ajo s LYS 146 Ca 0.48 -0.71 0.07 0.00 -0.36 0.00 0.00 55.97 55.45 1ajo s LYS 146 Cb -0.27 -2.27 -0.03 0.00 -1.51 0.00 0.00 37.83 33.75 1ajo s LYS 146 CO 0.59 -0.35 -0.19 -0.06 -0.36 0.00 0.00 175.35 174.98 1ajo s PHE 147 N 1.44 2.54 -0.06 4.03 0.08 -1.26 -2.91 117.98 121.83 1ajo s PHE 147 Ca 0.01 -0.27 0.05 0.00 0.12 0.00 0.00 56.93 56.84 1ajo s PHE 147 Cb -0.15 -1.49 -0.02 0.00 -0.57 0.00 0.00 43.02 40.79 1ajo s PHE 147 CO -0.09 0.19 -0.20 -0.51 -0.10 0.00 0.00 175.22 174.50 1ajo s ASP 148 N -1.17 3.47 0.00 1.36 1.01 -0.29 -1.27 116.67 119.77 1ajo s ASP 148 Ca 0.13 -0.40 0.00 0.00 0.71 0.00 0.00 52.55 52.99 1ajo s ASP 148 Cb -0.10 -0.94 0.00 0.00 1.01 0.00 0.00 42.92 42.89 1ajo s ASP 148 CO 0.03 0.26 0.00 0.00 0.21 0.00 0.00 175.17 175.67 1ajo s ALA 150 N -2.00 -0.39 -0.13 0.00 0.00 -1.18 -1.62 121.76 116.43 1ajo s ALA 150 Ca 0.00 0.23 -0.05 0.00 0.00 0.00 0.00 51.96 52.14 1ajo s ALA 150 Cb 0.00 -0.12 0.06 0.00 0.00 0.00 0.00 23.12 23.06 1ajo s ALA 150 CO 0.00 -0.13 0.27 -2.00 0.00 0.00 0.00 175.76 173.90 1ajo s GLU 151 N -0.51 0.17 -0.10 0.00 2.12 -1.26 -1.83 118.70 117.29 1ajo s GLU 151 Ca -0.06 0.72 0.02 0.00 0.36 0.00 0.00 54.97 56.01 1ajo s GLU 151 Cb -0.04 -0.03 -0.02 0.00 0.26 0.00 0.00 34.13 34.30 1ajo s GLU 151 CO 0.01 -0.26 -0.15 -0.47 -0.54 0.00 0.00 175.26 173.85 1ajo s TYR 152 N 2.20 2.73 -0.02 5.30 5.04 0.35 -1.67 117.35 131.28 1ajo s TYR 152 Ca -0.01 -0.53 -0.10 0.00 -2.44 0.00 0.00 57.07 54.00 1ajo s TYR 152 Cb -0.12 -1.75 0.01 0.00 0.35 0.00 0.00 41.96 40.46 1ajo s TYR 152 CO -0.09 -0.10 0.21 -0.98 -1.34 0.00 0.00 175.55 173.25 1ajo s ARG 153 N -0.02 0.49 0.62 4.97 1.70 -0.33 -1.58 118.95 124.80 1ajo s ARG 153 Ca -0.04 -0.16 -0.17 0.00 -0.47 0.00 0.00 55.73 54.89 1ajo s ARG 153 Cb -0.14 0.21 -0.02 0.00 -0.57 0.00 0.00 34.95 34.43 1ajo s ARG 153 CO 0.04 -0.12 1.15 -1.54 -1.08 0.00 0.00 175.30 173.76 1ajo s SER 154 N -1.00 5.15 0.06 -2.89 1.04 0.15 -0.29 113.70 115.91 1ajo s SER 154 Ca -0.11 2.20 0.07 0.00 0.48 0.00 0.00 55.95 58.59 1ajo s SER 154 Cb -0.05 -2.58 -0.23 0.00 0.10 0.00 0.00 66.02 63.26 1ajo s SER 154 CO 0.02 -1.61 1.07 0.71 0.98 0.00 0.00 173.24 174.41 1ajo h THR 155 N 0.49 1.42 -2.54 2.02 1.35 -1.27 -3.44 112.91 110.95 1ajo h THR 155 Ca -0.49 -3.16 -0.45 0.00 -0.55 0.00 0.00 66.41 61.77 1ajo h THR 155 Cb 1.27 2.73 0.04 0.00 -1.73 0.00 0.00 68.15 70.46 1ajo h THR 155 CO 0.54 0.83 -0.08 0.20 -0.25 0.00 0.00 175.52 176.76 1ajo s ASN 156 N -6.60 5.57 0.12 5.36 0.02 -1.26 -5.08 114.94 113.08 1ajo s ASN 156 Ca -0.02 0.10 0.07 0.00 -1.02 0.00 0.00 52.86 51.99 1ajo s ASN 156 Cb 0.09 -1.18 -0.04 0.00 0.02 0.00 0.00 41.25 40.14 1ajo s ASN 156 CO 0.83 -0.90 -0.04 0.27 0.02 0.00 0.00 177.10 177.28 1ajo s ILE 157 N -2.63 3.65 0.03 0.60 -4.36 -1.26 -4.51 121.20 112.73 1ajo s ILE 157 Ca 0.53 -1.24 0.02 0.00 -0.26 0.00 0.00 60.65 59.69 1ajo s ILE 157 Cb -0.10 -2.76 -0.02 0.00 1.25 0.00 0.00 42.46 40.83 1ajo s ILE 157 CO 0.38 0.04 -0.07 -0.31 0.24 0.00 0.00 174.94 175.22 1ajo s TYR 158 N -1.40 0.62 0.00 1.37 2.02 0.15 -4.87 117.35 115.24 1ajo s TYR 158 Ca 0.24 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.55 1ajo s TYR 158 Cb -0.11 -0.38 0.00 0.00 -0.40 0.00 0.00 41.96 41.07 1ajo s TYR 158 CO 0.16 -0.06 0.00 0.41 -1.57 0.00 0.00 175.55 174.49 1ajo n GLY 159 N 1.85 2.93 3.61 0.71 0.00 -1.26 -1.65 105.19 111.37 1ajo n GLY 159 Ca -0.20 -1.87 -0.39 0.00 0.00 0.00 0.00 46.02 43.56 1ajo n GLY 159 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ajo n TYR 160 N 0.00 0.83 -0.27 1.61 4.01 -1.26 -4.88 117.16 117.20 1ajo n TYR 160 Ca 0.00 0.46 0.00 0.00 -0.16 0.00 0.00 57.90 58.20 1ajo n TYR 160 Cb 0.00 -2.15 0.00 0.00 -0.31 0.00 0.00 39.34 36.88 1ajo n TYR 160 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ajo n GLY 161 N 1.28 0.28 3.63 2.72 0.00 0.13 -3.57 105.19 109.66 1ajo n GLY 161 Ca 0.12 -1.80 -0.37 0.00 0.00 0.00 0.00 46.02 43.97 1ajo n GLY 161 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ajo s LEU 162 N 0.00 4.07 -0.22 0.99 2.96 -0.46 -0.63 118.68 125.39 1ajo s LEU 162 Ca 0.00 0.06 -0.05 0.00 -0.22 0.00 0.00 54.13 53.92 1ajo s LEU 162 Cb 0.00 -2.12 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 1ajo s LEU 162 CO 0.00 0.01 -0.00 -0.31 -1.32 0.00 0.00 176.35 174.73 1ajo s TYR 163 N 1.39 3.01 0.07 5.38 1.51 -0.33 0.16 117.35 128.54 1ajo s TYR 163 Ca 0.07 -0.69 0.06 0.00 -1.01 0.00 0.00 57.07 55.51 1ajo s TYR 163 Cb -0.15 -2.13 -0.03 0.00 -0.11 0.00 0.00 41.96 39.54 1ajo s TYR 163 CO 0.08 -0.42 -0.17 -1.21 -1.11 0.00 0.00 175.55 172.72 1ajo s GLU 164 N 1.39 0.97 -0.09 -0.62 2.02 0.11 -1.78 118.70 120.71 1ajo s GLU 164 Ca 0.05 -0.98 -0.06 0.00 0.02 0.00 0.00 54.97 53.99 1ajo s GLU 164 Cb -0.15 -1.06 0.03 0.00 0.10 0.00 0.00 34.13 33.05 1ajo s GLU 164 CO -0.00 0.25 0.22 0.54 0.02 0.00 0.00 175.26 176.29 1ajo s VAL 165 N -1.13 -0.02 -0.37 2.63 0.11 0.29 -0.41 120.40 121.50 1ajo s VAL 165 Ca 0.02 0.07 -0.12 0.00 -2.93 0.00 0.00 61.98 59.01 1ajo s VAL 165 Cb -0.10 -0.33 0.02 0.00 -1.53 0.00 0.00 36.38 34.45 1ajo s VAL 165 CO 0.03 0.03 0.22 -0.55 -3.33 0.00 0.00 175.10 171.50 1ajo s SER 166 N 0.59 5.82 0.26 3.54 0.15 -0.82 -0.11 113.70 123.13 1ajo s SER 166 Ca -0.04 -0.87 -0.09 0.00 0.70 0.00 0.00 55.95 55.64 1ajo s SER 166 Cb -0.05 -2.06 -0.01 0.00 -1.71 0.00 0.00 66.02 62.19 1ajo s SER 166 CO -0.03 -0.37 0.42 0.00 1.20 0.00 0.00 173.24 174.46 1ajo s MET 167 N 1.60 1.55 -0.22 5.44 0.23 -0.99 -0.92 119.30 125.99 1ajo s MET 167 Ca 0.03 -1.40 -0.04 0.00 -1.03 0.00 0.00 55.69 53.25 1ajo s MET 167 Cb -0.19 0.43 0.09 0.00 -1.53 0.00 0.00 34.83 33.64 1ajo s MET 167 CO 0.08 -0.63 0.18 0.21 -2.03 0.00 0.00 175.02 172.83 1ajo s LYS 168 N -3.87 0.17 0.86 3.16 2.20 0.63 -3.23 119.74 119.66 1ajo s LYS 168 Ca 0.27 -0.06 -0.11 0.00 -0.36 0.00 0.00 55.97 55.70 1ajo s LYS 168 Cb 0.01 -1.30 0.11 0.00 -1.51 0.00 0.00 37.83 35.13 1ajo s LYS 168 CO 0.11 -0.78 1.09 -1.25 -0.36 0.00 0.00 175.35 174.17 1ajo s PRO 169 N 2.23 1.56 0.32 4.03 0.04 -1.26 -1.09 135.00 140.83 1ajo s PRO 169 Ca 0.06 0.79 -0.25 0.00 0.04 0.00 0.00 61.00 61.65 1ajo s PRO 169 Cb -0.16 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 1ajo s PRO 169 CO -0.19 -2.03 0.91 0.00 0.04 0.00 0.00 177.00 175.74 1ajo s ALA 170 N -2.99 3.22 -0.21 8.56 0.00 -1.23 -4.42 121.76 124.68 1ajo s ALA 170 Ca 0.62 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.99 1ajo s ALA 170 Cb -0.17 -3.13 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 1ajo s ALA 170 CO 0.56 0.19 0.01 0.21 0.00 0.00 0.00 175.76 176.74 1ajo s LYS 171 N -2.15 3.61 0.00 0.00 2.20 -1.26 -4.41 119.74 117.73 1ajo s LYS 171 Ca 0.50 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 55.60 1ajo s LYS 171 Cb -0.17 -3.13 0.00 0.00 -1.51 0.00 0.00 37.83 33.01 1ajo s LYS 171 CO 0.22 -0.06 0.00 -1.71 -0.36 0.00 0.00 175.35 173.45 1ajo n ASN 172 N 4.46 0.00 -4.66 1.43 5.15 -0.59 -5.03 115.26 116.01 1ajo n ASN 172 Ca -0.17 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.46 1ajo n ASN 172 Cb 0.52 0.00 0.10 0.00 -0.53 0.00 0.00 39.78 39.86 1ajo n ASN 172 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1ajo n THR 173 N -0.23 3.01 -0.99 -0.44 5.66 -1.26 -3.08 114.28 116.96 1ajo n THR 173 Ca 0.00 -0.35 0.00 0.00 -3.05 0.00 0.00 64.05 60.65 1ajo n THR 173 Cb 0.00 -1.21 0.00 0.00 -1.55 0.00 0.00 70.33 67.57 1ajo n THR 173 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ajo n GLY 174 N 0.90 0.39 3.38 1.09 0.00 -0.56 -4.48 105.19 105.89 1ajo n GLY 174 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 1ajo n GLY 174 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ajo s ILE 175 N -1.84 0.97 0.01 -0.61 -4.36 -1.24 -2.03 121.20 112.09 1ajo s ILE 175 Ca 0.00 -2.01 0.02 0.00 -0.26 0.00 0.00 60.65 58.40 1ajo s ILE 175 Cb 0.00 -2.61 -0.01 0.00 1.25 0.00 0.00 42.46 41.09 1ajo s ILE 175 CO 0.00 -0.10 -0.06 -0.69 0.24 0.00 0.00 174.94 174.33 1ajo s VAL 176 N -3.46 0.44 -0.10 8.37 1.01 -0.60 -0.88 120.40 125.18 1ajo s VAL 176 Ca 0.34 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.96 1ajo s VAL 176 Cb 0.08 -0.40 0.01 0.00 0.00 0.00 0.00 36.38 36.06 1ajo s VAL 176 CO 0.13 0.02 -0.19 -0.44 0.00 0.00 0.00 175.10 174.61 1ajo s SER 177 N -0.41 2.65 0.17 3.32 0.01 -0.77 -1.76 113.70 116.91 1ajo s SER 177 Ca -0.00 -0.48 -0.00 0.00 1.31 0.00 0.00 55.95 56.78 1ajo s SER 177 Cb -0.04 -1.21 -0.04 0.00 0.21 0.00 0.00 66.02 64.94 1ajo s SER 177 CO -0.00 0.09 0.06 -0.94 0.41 0.00 0.00 173.24 172.87 1ajo s SER 178 N 0.60 0.61 -0.04 2.44 1.04 -0.71 -0.49 113.70 117.14 1ajo s SER 178 Ca -0.14 -1.26 -0.00 0.00 0.48 0.00 0.00 55.95 55.03 1ajo s SER 178 Cb -0.17 0.25 0.03 0.00 0.10 0.00 0.00 66.02 66.23 1ajo s SER 178 CO 0.04 -0.71 0.00 0.12 0.98 0.00 0.00 173.24 173.67 1ajo s PHE 179 N -3.94 0.42 0.21 5.02 5.36 -0.26 -3.37 117.98 121.42 1ajo s PHE 179 Ca 0.29 -0.03 -0.23 0.00 -0.96 0.00 0.00 56.93 56.00 1ajo s PHE 179 Cb 0.07 -0.53 0.05 0.00 -0.34 0.00 0.00 43.02 42.26 1ajo s PHE 179 CO 0.06 -0.19 0.72 -0.59 -1.46 0.00 0.00 175.22 173.76 1ajo s PHE 180 N 1.33 -0.30 0.04 10.12 -0.71 -0.24 -0.97 117.98 127.25 1ajo s PHE 180 Ca -0.05 -0.04 0.04 0.00 -1.04 0.00 0.00 56.93 55.84 1ajo s PHE 180 Cb -0.13 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.29 1ajo s PHE 180 CO -0.02 -1.03 -0.05 0.95 -1.34 0.00 0.00 175.22 173.72 1ajo s THR 181 N -3.75 3.73 -0.10 -4.49 -4.23 -0.66 0.20 115.64 106.33 1ajo s THR 181 Ca 0.08 -0.89 -0.20 0.00 -1.18 0.00 0.00 61.69 59.50 1ajo s THR 181 Cb -0.04 -2.68 0.05 0.00 1.34 0.00 0.00 72.50 71.17 1ajo s THR 181 CO -0.01 0.28 0.49 -0.47 -0.54 0.00 0.00 174.62 174.37 1ajo s TYR 182 N -1.11 -0.46 -0.08 3.99 6.14 -0.13 -2.66 117.35 123.04 1ajo s TYR 182 Ca 0.20 0.97 -0.20 0.00 0.64 0.00 0.00 57.07 58.68 1ajo s TYR 182 Cb -0.11 0.21 0.04 0.00 0.42 0.00 0.00 41.96 42.52 1ajo s TYR 182 CO 0.11 -0.38 0.46 -0.08 0.64 0.00 0.00 175.55 176.30 1ajo s THR 183 N -0.56 0.02 0.02 4.34 -1.32 -0.77 -0.15 115.64 117.22 1ajo s THR 183 Ca -0.07 -0.20 -0.06 0.00 -1.21 0.00 0.00 61.69 60.15 1ajo s THR 183 Cb -0.03 -0.74 0.02 0.00 -1.51 0.00 0.00 72.50 70.24 1ajo s THR 183 CO 0.04 -0.11 0.30 0.61 -2.21 0.00 0.00 174.62 173.25 1ajo n GLY 184 N 1.69 0.85 0.41 6.08 0.00 -1.24 -2.32 105.19 110.67 1ajo n GLY 184 Ca -0.18 -0.94 0.22 0.00 0.00 0.00 0.00 46.02 45.11 1ajo n GLY 184 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ajo h PRO 185 N 0.00 0.37 0.00 1.61 0.10 -1.77 0.99 132.00 133.29 1ajo h PRO 185 Ca -0.06 -0.02 -0.00 0.00 0.10 0.00 0.00 66.00 66.01 1ajo h PRO 185 Cb 0.31 -0.08 -0.00 0.00 0.10 0.00 0.00 31.00 31.33 1ajo h PRO 185 CO 0.09 0.24 -0.01 0.00 0.10 0.00 0.00 178.00 178.42 1ajo h ALA 186 N 1.60 1.02 -0.49 -0.75 0.00 -1.96 -2.50 119.26 116.18 1ajo h ALA 186 Ca 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1ajo h ALA 186 Cb 1.37 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1ajo h ALA 186 CO -0.21 0.01 0.00 0.72 0.00 0.00 0.00 179.25 179.77 1ajo n HIS 187 N -3.12 0.65 -0.93 0.00 8.25 0.33 -4.97 115.22 115.43 1ajo n HIS 187 Ca -0.01 -0.42 0.00 0.00 -0.26 0.00 0.00 57.72 57.03 1ajo n HIS 187 Cb 0.20 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.30 1ajo n HIS 187 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ajo n GLY 188 N 1.18 0.48 2.89 -1.41 0.00 -0.94 -4.94 105.19 102.46 1ajo n GLY 188 Ca 0.18 -0.92 -0.20 0.00 0.00 0.00 0.00 46.02 45.08 1ajo n GLY 188 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ajo n THR 189 N -2.92 0.00 -1.63 2.61 -2.24 -1.15 -5.01 114.28 103.94 1ajo n THR 189 Ca 0.00 -2.11 -0.30 0.00 -2.27 0.00 0.00 64.05 59.37 1ajo n THR 189 Cb 0.04 0.89 0.09 0.00 -2.10 0.00 0.00 70.33 69.24 1ajo n THR 189 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajo s GLN 190 N -3.29 2.16 -0.53 -0.78 -2.07 -1.26 -2.73 119.66 111.15 1ajo s GLN 190 Ca 0.26 0.56 -0.24 0.00 -1.82 0.00 0.00 55.36 54.11 1ajo s GLN 190 Cb 0.01 -1.93 0.04 0.00 -1.09 0.00 0.00 33.01 30.04 1ajo s GLN 190 CO 0.18 -1.55 0.94 -0.46 -1.32 0.00 0.00 175.29 173.08 1ajo s TRP 191 N -3.22 2.82 -0.13 9.60 -0.00 -1.26 -3.59 118.94 123.16 1ajo s TRP 191 Ca 0.61 0.08 0.01 0.00 -0.00 0.00 0.00 56.10 56.80 1ajo s TRP 191 Cb -0.14 -4.05 0.02 0.00 -0.00 0.00 0.00 33.47 29.30 1ajo s TRP 191 CO 0.53 -1.30 -0.16 -0.51 -0.00 0.00 0.00 176.95 175.52 1ajo s ASP 192 N 2.71 2.62 -0.02 5.86 1.01 -0.98 -1.30 116.67 126.58 1ajo s ASP 192 Ca 0.32 -0.47 -0.11 0.00 0.71 0.00 0.00 52.55 53.00 1ajo s ASP 192 Cb -0.12 -1.17 0.01 0.00 1.01 0.00 0.00 42.92 42.65 1ajo s ASP 192 CO 0.21 0.01 0.23 -0.70 0.21 0.00 0.00 175.17 175.12 1ajo s GLU 193 N 1.10 0.54 -0.07 8.23 2.12 -0.38 -1.85 118.70 128.39 1ajo s GLU 193 Ca -0.03 -0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.11 1ajo s GLU 193 Cb -0.14 0.24 0.02 0.00 0.26 0.00 0.00 34.13 34.50 1ajo s GLU 193 CO -0.04 -0.13 -0.11 0.42 -0.54 0.00 0.00 175.26 174.86 1ajo s ILE 194 N -1.16 1.04 0.17 -3.70 1.01 -1.09 -0.39 121.20 117.09 1ajo s ILE 194 Ca -0.12 -0.41 0.10 0.00 0.00 0.00 0.00 60.65 60.22 1ajo s ILE 194 Cb -0.06 -0.98 -0.04 0.00 0.01 0.00 0.00 42.46 41.39 1ajo s ILE 194 CO 0.03 0.34 -0.22 -1.81 0.00 0.00 0.00 174.94 173.27 1ajo s ASP 195 N 0.82 3.10 -0.21 3.58 1.01 0.64 -1.66 116.67 123.95 1ajo s ASP 195 Ca -0.12 -0.84 0.01 0.00 0.71 0.00 0.00 52.55 52.31 1ajo s ASP 195 Cb -0.15 -0.21 0.05 0.00 1.01 0.00 0.00 42.92 43.62 1ajo s ASP 195 CO 0.02 0.07 -0.09 -0.63 0.21 0.00 0.00 175.17 174.76 1ajo s ILE 196 N -1.68 1.60 -0.07 0.77 1.01 -0.14 -2.92 121.20 119.77 1ajo s ILE 196 Ca 0.17 -1.07 0.01 0.00 0.00 0.00 0.00 60.65 59.76 1ajo s ILE 196 Cb -0.08 -1.74 0.02 0.00 0.01 0.00 0.00 42.46 40.67 1ajo s ILE 196 CO 0.08 0.08 -0.09 -1.61 0.00 0.00 0.00 174.94 173.39 1ajo s GLU 197 N 1.40 1.47 -0.31 2.79 2.02 -0.50 -1.10 118.70 124.46 1ajo s GLU 197 Ca -0.03 -0.31 -0.11 0.00 0.02 0.00 0.00 54.97 54.55 1ajo s GLU 197 Cb -0.17 -1.32 -0.02 0.00 0.10 0.00 0.00 34.13 32.72 1ajo s GLU 197 CO -0.07 -0.07 0.19 -0.06 0.02 0.00 0.00 175.26 175.27 1ajo s PHE 198 N 0.97 3.20 -0.24 1.61 0.08 0.36 -0.81 117.98 123.15 1ajo s PHE 198 Ca -0.09 -0.33 -0.25 0.00 0.12 0.00 0.00 56.93 56.38 1ajo s PHE 198 Cb -0.15 -2.40 -0.01 0.00 -0.57 0.00 0.00 43.02 39.90 1ajo s PHE 198 CO 0.00 -0.37 0.83 -0.51 -0.10 0.00 0.00 175.22 175.07 1ajo s LEU 199 N 1.67 4.09 0.62 -0.37 1.43 -1.26 -1.85 118.68 123.01 1ajo s LEU 199 Ca 0.06 1.05 0.32 0.00 -1.03 0.00 0.00 54.13 54.53 1ajo s LEU 199 Cb -0.17 -3.19 1.79 0.00 0.03 0.00 0.00 46.19 44.64 1ajo s LEU 199 CO 0.08 -0.51 2.09 1.23 0.23 0.00 0.00 176.35 179.47 1ajo h GLY 200 N 9.13 0.00 2.00 -3.19 0.00 -1.17 -1.99 103.07 107.85 1ajo h GLY 200 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1ajo h GLY 200 CO 0.87 0.00 0.00 0.07 0.00 0.00 0.00 176.54 177.48 1ajo h LYS 201 N 0.00 0.00 -1.29 4.80 2.10 -1.76 -1.58 116.57 118.84 1ajo h LYS 201 Ca 0.06 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.64 1ajo h LYS 201 Cb 0.49 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 31.58 1ajo h LYS 201 CO -0.00 0.00 -0.45 0.34 -2.00 0.00 0.00 179.45 177.34 1ajo s ASP 202 N -5.36 -0.80 -0.05 7.07 -1.08 -0.75 -4.87 116.67 110.83 1ajo s ASP 202 Ca -0.00 -0.13 0.10 0.00 -0.52 0.00 0.00 52.55 51.99 1ajo s ASP 202 Cb 0.10 1.65 0.37 0.00 -1.46 0.00 0.00 42.92 43.57 1ajo s ASP 202 CO 0.49 -0.31 1.21 0.35 0.52 0.00 0.00 175.17 177.43 1ajo n THR 203 N 5.30 0.90 1.06 1.71 -2.24 -1.26 -2.75 114.28 117.01 1ajo n THR 203 Ca 0.04 -0.59 0.12 0.00 -2.27 0.00 0.00 64.05 61.35 1ajo n THR 203 Cb 0.52 -0.03 0.33 0.00 -2.10 0.00 0.00 70.33 69.05 1ajo n THR 203 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ajo n THR 204 N 0.48 0.17 -4.40 4.28 -2.24 -1.26 -0.65 114.28 110.67 1ajo n THR 204 Ca 0.13 -0.44 -0.20 0.00 -2.27 0.00 0.00 64.05 61.28 1ajo n THR 204 Cb 0.50 0.76 -0.10 0.00 -2.10 0.00 0.00 70.33 69.38 1ajo n THR 204 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ajo s LYS 205 N -1.83 1.48 0.03 -0.78 1.02 -1.11 -1.08 119.74 117.47 1ajo s LYS 205 Ca 0.34 -1.75 0.01 0.00 0.02 0.00 0.00 55.97 54.60 1ajo s LYS 205 Cb 0.20 -0.99 -0.02 0.00 -0.52 0.00 0.00 37.83 36.50 1ajo s LYS 205 CO 0.30 -0.00 -0.06 0.54 -0.92 0.00 0.00 175.35 175.21 1ajo s VAL 206 N -3.13 0.38 -0.13 3.17 0.11 -0.78 -4.69 120.40 115.32 1ajo s VAL 206 Ca 0.29 -0.83 0.01 0.00 -2.93 0.00 0.00 61.98 58.53 1ajo s VAL 206 Cb 0.04 -0.44 -0.00 0.00 -1.53 0.00 0.00 36.38 34.45 1ajo s VAL 206 CO 0.11 -0.30 -0.17 -1.58 -3.33 0.00 0.00 175.10 169.82 1ajo s GLN 207 N -1.21 3.21 0.02 1.54 0.74 0.01 -1.27 119.66 122.71 1ajo s GLN 207 Ca -0.09 -0.77 0.03 0.00 0.05 0.00 0.00 55.36 54.58 1ajo s GLN 207 Cb -0.08 -2.53 -0.04 0.00 1.10 0.00 0.00 33.01 31.47 1ajo s GLN 207 CO -0.00 0.13 -0.04 -0.06 -0.55 0.00 0.00 175.29 174.76 1ajo s PHE 208 N 0.53 2.94 0.22 1.67 0.08 0.12 -1.41 117.98 122.13 1ajo s PHE 208 Ca -0.11 -0.01 -0.23 0.00 0.12 0.00 0.00 56.93 56.70 1ajo s PHE 208 Cb -0.16 -1.61 0.04 0.00 -0.57 0.00 0.00 43.02 40.72 1ajo s PHE 208 CO 0.04 0.41 0.80 1.21 -0.10 0.00 0.00 175.22 177.59 1ajo s ASN 209 N -1.60 -0.24 0.00 1.36 2.47 -1.15 -1.05 114.94 114.73 1ajo s ASN 209 Ca 0.19 -0.50 -0.28 0.00 0.42 0.00 0.00 52.86 52.69 1ajo s ASN 209 Cb -0.11 0.63 0.09 0.00 -1.45 0.00 0.00 41.25 40.41 1ajo s ASN 209 CO 0.10 -1.16 0.80 -0.72 -3.72 0.00 0.00 177.10 172.39 1ajo s TYR 210 N -3.67 -0.46 0.01 0.43 1.13 -1.26 -0.26 117.35 113.28 1ajo s TYR 210 Ca 0.11 0.47 0.04 0.00 -1.41 0.00 0.00 57.07 56.28 1ajo s TYR 210 Cb -0.04 0.51 -0.01 0.00 -1.10 0.00 0.00 41.96 41.31 1ajo s TYR 210 CO 0.04 -0.60 -0.12 0.71 -2.51 0.00 0.00 175.55 173.07 1ajo s TYR 211 N -2.61 1.08 -0.15 -3.49 2.02 0.47 -3.63 117.35 111.05 1ajo s TYR 211 Ca 0.00 -0.26 -0.02 0.00 -0.37 0.00 0.00 57.07 56.42 1ajo s TYR 211 Cb -0.01 -0.68 0.05 0.00 -0.40 0.00 0.00 41.96 40.92 1ajo s TYR 211 CO -0.05 -0.00 0.00 0.99 -1.57 0.00 0.00 175.55 174.92 1ajo s THR 212 N -0.51 0.64 -1.21 -0.71 2.01 0.12 -1.25 115.64 114.73 1ajo s THR 212 Ca 0.03 -0.38 -0.09 0.00 0.31 0.00 0.00 61.69 61.56 1ajo s THR 212 Cb -0.06 -0.95 -0.01 0.00 0.01 0.00 0.00 72.50 71.48 1ajo s THR 212 CO 0.00 0.02 0.74 -3.20 -0.69 0.00 0.00 174.62 171.49 1ajo n ASN 213 N 5.03 -3.47 0.00 3.53 5.15 -0.42 0.93 115.26 126.01 1ajo n ASN 213 Ca -0.09 -0.89 0.15 0.00 -0.60 0.00 0.00 54.58 53.14 1ajo n ASN 213 Cb 0.48 -3.90 0.87 0.00 -0.53 0.00 0.00 39.78 36.71 1ajo n ASN 213 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27