#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yas s PHE 3 N 0.00 3.06 0.29 0.00 0.08 -1.26 -4.59 117.98 115.55 1yas s PHE 3 Ca 0.00 0.11 0.03 0.00 0.12 0.00 0.00 56.93 57.19 1yas s PHE 3 Cb 0.00 -1.73 -0.06 0.00 -0.57 0.00 0.00 43.02 40.66 1yas s PHE 3 CO 0.00 0.42 0.06 0.00 -0.10 0.00 0.00 175.22 175.60 1yas s ALA 4 N -0.90 2.04 -0.37 5.36 0.00 -1.26 -5.03 121.76 121.59 1yas s ALA 4 Ca 0.14 -1.94 -0.09 0.00 0.00 0.00 0.00 51.96 50.07 1yas s ALA 4 Cb -0.11 0.78 0.04 0.00 0.00 0.00 0.00 23.12 23.83 1yas s ALA 4 CO 0.04 -0.36 0.19 -1.58 0.00 0.00 0.00 175.76 174.05 1yas s HIS 5 N -3.49 3.27 -0.09 0.00 2.46 -1.26 -1.69 115.29 114.50 1yas s HIS 5 Ca 0.36 -1.25 -0.17 0.00 0.47 0.00 0.00 55.06 54.46 1yas s HIS 5 Cb 0.08 -2.52 -0.05 0.00 -0.13 0.00 0.00 32.58 29.97 1yas s HIS 5 CO 0.14 -0.73 0.46 -0.06 -2.47 0.00 0.00 174.74 172.09 1yas s PHE 6 N 1.47 3.57 -0.30 3.88 0.08 0.05 -0.73 117.98 126.00 1yas s PHE 6 Ca 0.01 0.92 -0.04 0.00 0.12 0.00 0.00 56.93 57.94 1yas s PHE 6 Cb -0.20 -2.50 0.03 0.00 -0.57 0.00 0.00 43.02 39.79 1yas s PHE 6 CO 0.04 0.28 0.03 0.08 -0.10 0.00 0.00 175.22 175.56 1yas s VAL 7 N 0.22 3.41 -0.21 -0.44 1.01 -0.10 -0.37 120.40 123.91 1yas s VAL 7 Ca 0.25 -1.09 -0.18 0.00 0.00 0.00 0.00 61.98 60.97 1yas s VAL 7 Cb -0.16 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 1yas s VAL 7 CO 0.11 -0.03 0.48 -0.76 0.00 0.00 0.00 175.10 174.91 1yas s LEU 8 N 1.36 4.13 -0.27 3.92 1.43 0.45 -0.65 118.68 129.06 1yas s LEU 8 Ca -0.01 0.60 -0.01 0.00 -1.03 0.00 0.00 54.13 53.67 1yas s LEU 8 Cb -0.18 -2.64 0.04 0.00 0.03 0.00 0.00 46.19 43.43 1yas s LEU 8 CO 0.00 -0.17 -0.05 -0.63 0.23 0.00 0.00 176.35 175.73 1yas s ILE 9 N 1.67 2.76 0.90 -0.59 1.01 -0.33 -2.67 121.20 123.94 1yas s ILE 9 Ca 0.22 -1.25 -0.12 0.00 0.00 0.00 0.00 60.65 59.50 1yas s ILE 9 Cb -0.15 -2.49 0.13 0.00 0.01 0.00 0.00 42.46 39.96 1yas s ILE 9 CO 0.09 0.07 1.10 -1.38 0.00 0.00 0.00 174.94 174.82 1yas s HIS 10 N 1.26 2.42 0.71 3.97 -3.43 -1.26 -2.36 115.29 116.60 1yas s HIS 10 Ca -0.03 1.09 -0.03 0.00 -0.80 0.00 0.00 55.06 55.29 1yas s HIS 10 Cb -0.18 -3.22 0.11 0.00 -1.43 0.00 0.00 32.58 27.86 1yas s HIS 10 CO -0.04 -2.36 0.99 -0.08 -2.00 0.00 0.00 174.74 171.25 1yas s THR 11 N -3.06 2.22 0.64 -5.38 -1.32 -1.25 -4.33 115.64 103.17 1yas s THR 11 Ca 0.63 -0.51 -0.18 0.00 -1.21 0.00 0.00 61.69 60.42 1yas s THR 11 Cb -0.17 -2.71 -0.02 0.00 -1.51 0.00 0.00 72.50 68.10 1yas s THR 11 CO 0.56 0.00 1.27 0.27 -2.21 0.00 0.00 174.62 174.50 1yas s ILE 12 N -3.16 2.21 0.00 5.08 -4.36 -1.26 -1.89 121.20 117.82 1yas s ILE 12 Ca 0.65 0.13 0.00 0.00 -0.26 0.00 0.00 60.65 61.17 1yas s ILE 12 Cb -0.07 -3.03 0.00 0.00 1.25 0.00 0.00 42.46 40.61 1yas s ILE 12 CO 0.44 -0.03 0.00 0.00 0.24 0.00 0.00 174.94 175.59 1yas n HIS 14 N -2.00 -0.38 -3.82 0.00 8.25 -0.79 -1.26 115.22 115.21 1yas n HIS 14 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 1yas n HIS 14 Cb 0.00 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.14 1yas n HIS 14 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1yas s GLY 15 N -0.88 0.37 0.50 -1.41 0.00 -1.26 -2.93 107.32 101.71 1yas s GLY 15 Ca 0.00 -0.73 0.26 0.00 0.00 0.00 0.00 44.72 44.25 1yas s GLY 15 CO 0.00 0.19 1.89 0.00 0.00 0.00 0.00 173.10 175.19 1yas h ALA 16 N 2.00 2.58 -0.58 3.20 0.00 -1.86 -2.71 119.26 121.89 1yas h ALA 16 Ca -0.33 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 54.74 1yas h ALA 16 Cb 1.24 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1yas h ALA 16 CO 0.42 -0.83 0.57 0.11 0.00 0.00 0.00 179.25 179.51 1yas h TRP 17 N 0.14 0.00 0.00 0.00 5.08 -1.93 0.34 115.95 119.58 1yas h TRP 17 Ca 0.42 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.39 1yas h TRP 17 Cb 1.43 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.59 1yas h TRP 17 CO -0.00 0.00 0.00 -0.84 -1.28 0.00 0.00 178.44 176.32 1yas h ILE 18 N 0.00 0.00 -0.40 0.12 -0.00 -1.91 -1.92 117.51 113.40 1yas h ILE 18 Ca 0.28 -0.26 0.00 0.00 -0.00 0.00 0.00 64.86 64.88 1yas h ILE 18 Cb 1.40 1.14 0.00 0.00 -0.00 0.00 0.00 36.82 39.36 1yas h ILE 18 CO -0.00 0.00 0.00 0.79 -0.00 0.00 0.00 178.15 178.94 1yas n TRP 19 N -2.81 0.77 0.30 0.16 7.02 0.11 -4.44 117.44 118.54 1yas n TRP 19 Ca -0.00 -0.33 0.19 0.00 -1.02 0.00 0.00 57.50 56.34 1yas n TRP 19 Cb 0.19 -0.10 0.91 0.00 -2.42 0.00 0.00 31.31 29.89 1yas n TRP 19 CO 0.00 0.00 0.00 1.12 -2.02 0.00 0.00 177.69 176.79 1yas h HIS 20 N 2.47 0.00 0.06 -5.99 2.07 -1.51 -0.95 115.15 111.29 1yas h HIS 20 Ca 0.00 0.00 -0.33 0.00 -2.85 0.00 0.00 60.37 57.19 1yas h HIS 20 Cb 0.81 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.76 1yas h HIS 20 CO 0.39 0.02 -1.91 1.63 -3.07 0.00 0.00 177.93 175.00 1yas n LYS 21 N -3.18 0.70 0.13 5.12 5.02 -1.26 -4.43 118.16 120.25 1yas n LYS 21 Ca -0.01 0.26 -0.22 0.00 -2.02 0.00 0.00 58.31 56.32 1yas n LYS 21 Cb 0.20 -1.73 -0.15 0.00 -0.02 0.00 0.00 35.03 33.33 1yas n LYS 21 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1yas h LEU 22 N 0.03 0.69 -0.16 -0.35 5.85 -1.61 -3.34 115.31 116.43 1yas h LEU 22 Ca -0.38 -0.76 0.04 0.00 0.84 0.00 0.00 57.88 57.62 1yas h LEU 22 Cb 2.03 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.79 1yas h LEU 22 CO 0.07 1.60 -0.10 0.50 -0.34 0.00 0.00 178.44 180.18 1yas h LYS 23 N 0.12 -0.09 -0.87 1.25 3.64 -1.41 -1.69 116.57 117.53 1yas h LYS 23 Ca -0.23 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.28 1yas h LYS 23 Cb 2.10 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 33.88 1yas h LYS 23 CO 0.24 -0.06 0.56 -1.35 -2.27 0.00 0.00 179.45 176.57 1yas h PRO 24 N -0.10 0.71 -0.22 1.90 0.11 -1.77 -2.37 132.00 130.26 1yas h PRO 24 Ca 0.09 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.12 1yas h PRO 24 Cb 0.24 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.18 1yas h PRO 24 CO -0.22 0.47 -0.03 -0.07 -0.21 0.00 0.00 178.00 177.94 1yas h LEU 25 N 0.74 0.41 -0.52 2.35 4.07 -1.45 -0.87 115.31 120.04 1yas h LEU 25 Ca 0.42 -0.34 -0.05 0.00 0.08 0.00 0.00 57.88 57.99 1yas h LEU 25 Cb 0.59 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.20 1yas h LEU 25 CO -0.18 0.66 0.14 -0.07 -1.08 0.00 0.00 178.44 177.90 1yas h LEU 26 N 0.16 0.79 -1.24 1.67 3.38 -1.15 -2.29 115.31 116.63 1yas h LEU 26 Ca 0.06 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1yas h LEU 26 Cb 0.47 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1yas h LEU 26 CO 0.02 0.81 -0.21 -0.33 0.09 0.00 0.00 178.44 178.81 1yas h GLU 27 N 0.73 0.26 0.00 1.13 5.08 -1.38 -1.05 114.58 119.34 1yas h GLU 27 Ca 0.17 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1yas h GLU 27 Cb 0.32 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1yas h GLU 27 CO -0.00 0.47 0.00 0.00 -1.00 0.00 0.00 179.01 178.48 1yas h ALA 28 N 1.55 1.00 -0.01 3.43 0.00 -0.65 0.28 119.26 124.85 1yas h ALA 28 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1yas h ALA 28 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1yas h ALA 28 CO 0.03 0.00 -0.17 1.28 0.00 0.00 0.00 179.25 180.40 1yas n LEU 29 N -2.87 1.50 0.00 0.00 7.99 -0.45 -4.95 117.00 118.22 1yas n LEU 29 Ca 0.01 -0.47 0.00 0.00 -0.01 0.00 0.00 56.01 55.54 1yas n LEU 29 Cb 0.29 -0.05 0.00 0.00 -0.11 0.00 0.00 43.42 43.54 1yas n LEU 29 CO 0.25 0.26 0.00 0.61 -1.51 0.00 0.00 177.39 177.01 1yas n GLY 30 N 1.29 0.83 3.85 -0.72 0.00 0.09 -4.98 105.19 105.54 1yas n GLY 30 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1yas n GLY 30 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yas s HIS 31 N -2.00 3.39 0.16 1.61 3.76 -0.92 -4.80 115.29 116.49 1yas s HIS 31 Ca 0.00 1.27 -0.22 0.00 -0.15 0.00 0.00 55.06 55.96 1yas s HIS 31 Cb 0.00 -2.59 -0.08 0.00 1.11 0.00 0.00 32.58 31.02 1yas s HIS 31 CO 0.00 -0.02 0.71 0.21 -0.85 0.00 0.00 174.74 174.80 1yas s LYS 32 N -3.27 4.39 -0.09 1.40 2.20 -0.68 -4.10 119.74 119.59 1yas s LYS 32 Ca 0.55 0.97 0.00 0.00 -0.36 0.00 0.00 55.97 57.14 1yas s LYS 32 Cb -0.10 -3.14 0.02 0.00 -1.51 0.00 0.00 37.83 33.11 1yas s LYS 32 CO 0.20 0.53 -0.07 0.08 -0.36 0.00 0.00 175.35 175.74 1yas s VAL 33 N -1.26 0.88 -0.15 4.02 1.01 -1.26 -0.77 120.40 122.87 1yas s VAL 33 Ca 0.36 -0.24 -0.04 0.00 0.00 0.00 0.00 61.98 62.06 1yas s VAL 33 Cb -0.20 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1yas s VAL 33 CO 0.23 0.33 -0.00 -0.89 0.00 0.00 0.00 175.10 174.77 1yas s THR 34 N 1.42 4.24 -0.34 3.92 2.01 0.51 -4.97 115.64 122.42 1yas s THR 34 Ca -0.01 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.77 1yas s THR 34 Cb -0.13 -2.86 0.10 0.00 0.01 0.00 0.00 72.50 69.62 1yas s THR 34 CO -0.04 0.50 0.08 0.00 -0.69 0.00 0.00 174.62 174.47 1yas s ALA 35 N 0.13 2.55 0.34 7.40 0.00 -1.26 -0.41 121.76 130.51 1yas s ALA 35 Ca 0.01 -2.35 -0.25 0.00 0.00 0.00 0.00 51.96 49.37 1yas s ALA 35 Cb -0.13 -1.89 -0.10 0.00 0.00 0.00 0.00 23.12 21.00 1yas s ALA 35 CO 0.02 -1.71 0.96 -0.51 0.00 0.00 0.00 175.76 174.52 1yas s LEU 36 N 1.02 4.27 -0.09 0.00 1.43 -1.09 -4.76 118.68 119.46 1yas s LEU 36 Ca 0.11 1.85 -0.22 0.00 -1.03 0.00 0.00 54.13 54.84 1yas s LEU 36 Cb -0.19 -4.09 -0.04 0.00 0.03 0.00 0.00 46.19 41.90 1yas s LEU 36 CO -0.12 -0.15 0.66 -1.81 0.23 0.00 0.00 176.35 175.16 1yas s ASP 37 N -1.66 6.90 0.87 2.29 1.01 -1.26 -3.63 116.67 121.18 1yas s ASP 37 Ca 0.52 1.09 -0.11 0.00 0.71 0.00 0.00 52.55 54.76 1yas s ASP 37 Cb -0.18 -2.39 0.17 0.00 1.01 0.00 0.00 42.92 41.53 1yas s ASP 37 CO 0.23 -0.13 1.20 -0.76 0.21 0.00 0.00 175.17 175.93 1yas s LEU 38 N 0.95 2.80 0.37 1.23 1.43 -1.26 -4.72 118.68 119.48 1yas s LEU 38 Ca 0.35 0.09 -0.28 0.00 -1.03 0.00 0.00 54.13 53.25 1yas s LEU 38 Cb -0.17 -2.27 -0.11 0.00 0.03 0.00 0.00 46.19 43.67 1yas s LEU 38 CO 0.16 -2.38 1.49 0.00 0.23 0.00 0.00 176.35 175.85 1yas s ALA 39 N -3.61 3.58 -1.57 4.21 0.00 -0.54 -2.24 121.76 121.58 1yas s ALA 39 Ca 0.70 1.57 0.00 0.00 0.00 0.00 0.00 51.96 54.24 1yas s ALA 39 Cb -0.05 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1yas s ALA 39 CO 0.50 -1.05 0.00 0.00 0.00 0.00 0.00 175.76 175.21 1yas n ALA 40 N 0.51 -0.62 -2.48 0.00 0.00 -1.26 -4.93 120.51 111.73 1yas n ALA 40 Ca 0.01 0.16 -0.20 0.00 0.00 0.00 0.00 53.44 53.41 1yas n ALA 40 Cb 0.39 -1.92 -0.11 0.00 0.00 0.00 0.00 19.45 17.81 1yas n ALA 40 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1yas s SER 41 N -2.11 2.37 1.48 0.00 0.01 -0.95 -4.66 113.70 109.85 1yas s SER 41 Ca 0.00 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.44 1yas s SER 41 Cb 0.00 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.11 1yas s SER 41 CO 0.00 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.19 1yas n GLY 42 N 0.47 3.39 1.98 3.44 0.00 -1.15 -1.29 105.19 112.03 1yas n GLY 42 Ca -0.15 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.64 1yas n GLY 42 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1yas n VAL 43 N 0.00 3.06 -2.44 1.61 0.24 -1.26 -4.94 118.33 114.60 1yas n VAL 43 Ca 0.00 -2.14 -0.41 0.00 -2.04 0.00 0.00 64.34 59.76 1yas n VAL 43 Cb 0.00 -0.44 -0.04 0.00 -1.47 0.00 0.00 33.84 31.89 1yas n VAL 43 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1yas s ASP 44 N -1.61 7.18 0.11 -1.34 2.15 -0.41 -4.96 116.67 117.80 1yas s ASP 44 Ca 0.54 2.22 0.27 0.00 0.43 0.00 0.00 52.55 56.01 1yas s ASP 44 Cb 0.46 -2.61 1.00 0.00 -0.30 0.00 0.00 42.92 41.47 1yas s ASP 44 CO 0.08 -0.26 1.83 -0.81 -0.17 0.00 0.00 175.17 175.84 1yas n PRO 45 N 1.97 0.14 -2.18 4.34 -0.04 -1.26 -4.51 135.00 133.46 1yas n PRO 45 Ca 0.02 0.13 -0.33 0.00 -0.04 0.00 0.00 63.50 63.28 1yas n PRO 45 Cb 0.45 -1.67 -0.00 0.00 -0.04 0.00 0.00 33.50 32.24 1yas n PRO 45 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1yas s ARG 46 N -3.06 3.49 0.17 0.54 0.52 -1.26 -5.02 118.95 114.33 1yas s ARG 46 Ca 0.12 1.20 0.01 0.00 -0.52 0.00 0.00 55.73 56.54 1yas s ARG 46 Cb 0.15 -2.06 -0.04 0.00 0.52 0.00 0.00 34.95 33.53 1yas s ARG 46 CO 0.55 -0.67 0.33 -0.65 0.02 0.00 0.00 175.30 174.88 1yas s GLN 47 N -3.92 3.48 0.52 3.54 -1.52 -1.26 -4.04 119.66 116.46 1yas s GLN 47 Ca 0.64 -0.48 0.23 0.00 -1.95 0.00 0.00 55.36 53.80 1yas s GLN 47 Cb -0.15 -2.91 1.41 0.00 -0.22 0.00 0.00 33.01 31.14 1yas s GLN 47 CO 0.33 0.46 2.12 0.97 -0.25 0.00 0.00 175.29 178.92 1yas h ILE 48 N 1.59 0.78 0.00 1.08 6.09 -1.83 -2.25 117.51 122.96 1yas h ILE 48 Ca -0.48 -0.32 -0.00 0.00 -1.37 0.00 0.00 64.86 62.69 1yas h ILE 48 Cb 1.19 1.19 -0.00 0.00 0.47 0.00 0.00 36.82 39.67 1yas h ILE 48 CO 0.68 0.08 -0.01 -0.33 -3.07 0.00 0.00 178.15 175.50 1yas h GLU 49 N 0.00 0.00 -0.01 2.19 3.07 -1.96 0.55 114.58 118.42 1yas h GLU 49 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1yas h GLU 49 Cb 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1yas h GLU 49 CO 0.01 0.01 -0.03 0.39 -1.40 0.00 0.00 179.01 177.99 1yas n GLU 50 N -3.26 1.30 -4.50 2.33 1.02 -0.85 -4.78 120.64 111.90 1yas n GLU 50 Ca -0.02 -0.57 -0.34 0.00 -0.02 0.00 0.00 57.16 56.21 1yas n GLU 50 Cb 0.12 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 29.93 1yas n GLU 50 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1yas s ILE 51 N -2.09 3.74 -1.14 -3.67 -1.09 0.18 -5.01 121.20 112.12 1yas s ILE 51 Ca 0.39 -0.42 0.12 0.00 -2.23 0.00 0.00 60.65 58.51 1yas s ILE 51 Cb 0.21 -2.61 0.00 0.00 -1.58 0.00 0.00 42.46 38.48 1yas s ILE 51 CO 0.37 0.52 0.72 0.61 -1.23 0.00 0.00 174.94 175.94 1yas n GLY 52 N 3.25 -0.12 3.78 6.18 0.00 -1.26 -4.93 105.19 112.09 1yas n GLY 52 Ca -0.18 -0.35 -0.04 0.00 0.00 0.00 0.00 46.02 45.45 1yas n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yas s SER 53 N -1.52 -0.20 0.42 1.61 1.04 -1.26 -4.98 113.70 108.82 1yas s SER 53 Ca 0.10 -0.46 0.20 0.00 0.48 0.00 0.00 55.95 56.28 1yas s SER 53 Cb 0.10 0.55 0.93 0.00 0.10 0.00 0.00 66.02 67.69 1yas s SER 53 CO 0.30 -1.01 1.86 0.15 0.98 0.00 0.00 173.24 175.51 1yas h PHE 54 N 2.00 0.00 -0.18 5.02 3.04 -1.89 -1.31 116.94 123.63 1yas h PHE 54 Ca -0.23 0.00 -0.11 0.00 3.98 0.00 0.00 57.97 61.61 1yas h PHE 54 Cb 1.23 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.75 1yas h PHE 54 CO 0.39 0.29 -0.32 -0.44 -2.02 0.00 0.00 178.31 176.21 1yas h ASP 55 N 0.00 0.59 -0.51 0.41 5.19 -1.98 -2.24 116.42 117.89 1yas h ASP 55 Ca -0.00 -0.54 0.01 0.00 -0.62 0.00 0.00 57.03 55.87 1yas h ASP 55 Cb 0.68 -0.17 -0.03 0.00 0.18 0.00 0.00 39.33 39.99 1yas h ASP 55 CO 0.04 1.02 0.33 -0.33 -3.12 0.00 0.00 179.24 177.18 1yas h GLU 56 N 0.19 0.66 -0.87 3.56 5.08 -1.89 -2.81 114.58 118.50 1yas h GLU 56 Ca 0.01 -0.04 0.17 0.00 -1.00 0.00 0.00 59.36 58.50 1yas h GLU 56 Cb 0.91 -0.15 -0.10 0.00 0.50 0.00 0.00 28.75 29.91 1yas h GLU 56 CO 0.07 0.44 0.44 -0.92 -1.00 0.00 0.00 179.01 178.04 1yas h TYR 57 N 0.68 0.75 0.00 4.33 3.20 -1.20 -2.00 116.97 122.73 1yas h TYR 57 Ca 0.19 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1yas h TYR 57 Cb -0.07 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.00 1yas h TYR 57 CO -0.04 0.11 0.00 0.43 -1.64 0.00 0.00 178.16 177.02 1yas n SER 58 N -4.92 0.00 -0.18 -2.11 7.64 -0.85 -1.47 113.62 111.73 1yas n SER 58 Ca 0.19 -0.71 -0.01 0.00 1.01 0.00 0.00 58.87 59.35 1yas n SER 58 Cb 0.51 -0.03 0.08 0.00 -1.01 0.00 0.00 64.21 63.76 1yas n SER 58 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1yas h GLU 59 N 0.00 0.10 -0.74 1.43 4.22 -1.38 -0.86 114.58 117.35 1yas h GLU 59 Ca 0.00 -0.01 0.10 0.00 0.08 0.00 0.00 59.36 59.53 1yas h GLU 59 Cb 0.02 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1yas h GLU 59 CO 0.00 0.07 0.49 -1.35 -2.18 0.00 0.00 179.01 176.03 1yas h PRO 60 N 0.10 0.61 -0.21 0.92 0.11 -1.85 -1.35 132.00 130.34 1yas h PRO 60 Ca 0.29 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.25 1yas h PRO 60 Cb 0.45 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.42 1yas h PRO 60 CO -0.49 0.40 -0.29 1.25 -0.21 0.00 0.00 178.00 178.66 1yas h LEU 61 N 0.63 0.62 -0.43 2.35 5.85 -1.49 -1.12 115.31 121.71 1yas h LEU 61 Ca 0.34 -0.51 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 1yas h LEU 61 Cb 0.49 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1yas h LEU 61 CO -0.12 1.01 0.18 -0.07 -0.34 0.00 0.00 178.44 179.10 1yas h LEU 62 N 0.25 0.59 -0.73 2.25 3.38 -1.03 -0.55 115.31 119.47 1yas h LEU 62 Ca 0.02 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1yas h LEU 62 Cb 0.87 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 1yas h LEU 62 CO 0.07 0.58 0.25 0.74 0.09 0.00 0.00 178.44 180.17 1yas h THR 63 N 0.55 1.26 -0.03 0.22 2.02 -1.29 -0.51 112.91 115.13 1yas h THR 63 Ca 0.14 -0.86 0.02 0.00 0.77 0.00 0.00 66.41 66.49 1yas h THR 63 Cb 0.17 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 1yas h THR 63 CO -0.01 0.34 -0.13 0.15 0.37 0.00 0.00 175.52 176.23 1yas h PHE 64 N 1.06 -0.33 -0.25 3.16 3.57 -0.87 -1.78 116.94 121.50 1yas h PHE 64 Ca 0.24 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.68 1yas h PHE 64 Cb 0.27 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 1yas h PHE 64 CO 0.02 -0.20 -0.14 -0.07 -2.23 0.00 0.00 178.31 175.70 1yas h LEU 65 N -0.21 0.40 -1.02 0.59 3.38 -0.77 -1.61 115.31 116.07 1yas h LEU 65 Ca 0.05 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1yas h LEU 65 Cb 0.28 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1yas h LEU 65 CO -0.15 0.57 0.20 -0.08 0.09 0.00 0.00 178.44 179.07 1yas h GLU 66 N 0.39 0.90 0.00 1.13 4.57 -0.80 -2.99 114.58 117.77 1yas h GLU 66 Ca 0.07 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1yas h GLU 66 Cb 0.47 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1yas h GLU 66 CO 0.03 0.77 0.00 0.00 -1.18 0.00 0.00 179.01 178.63 1yas h ALA 67 N 1.34 1.00 -2.56 2.92 0.00 -0.40 -3.45 119.26 118.11 1yas h ALA 67 Ca 0.20 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.58 1yas h ALA 67 Cb 0.24 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1yas h ALA 67 CO -0.01 0.00 0.62 -0.51 0.00 0.00 0.00 179.25 179.35 1yas s LEU 68 N -5.46 4.39 0.32 0.00 1.43 -1.13 -4.98 118.68 113.24 1yas s LEU 68 Ca 0.02 2.20 -0.29 0.00 -1.03 0.00 0.00 54.13 55.03 1yas s LEU 68 Cb 0.09 -3.59 -0.12 0.00 0.03 0.00 0.00 46.19 42.60 1yas s LEU 68 CO 0.48 -0.52 1.41 -2.65 0.23 0.00 0.00 176.35 175.30 1yas n PRO 69 N 3.53 2.33 -1.48 1.29 -0.02 -1.26 -4.92 135.00 134.47 1yas n PRO 69 Ca 0.09 0.82 -0.56 0.00 -2.02 0.00 0.00 63.50 61.82 1yas n PRO 69 Cb 0.44 -2.49 -0.07 0.00 -0.02 0.00 0.00 33.50 31.37 1yas n PRO 69 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1yas n PRO 70 N 1.12 0.03 0.00 0.52 -0.02 -1.26 -1.90 135.00 133.50 1yas n PRO 70 Ca 0.06 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1yas n PRO 70 Cb 0.36 -1.41 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 1yas n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yas n GLY 71 N 1.63 3.20 3.89 -1.23 0.00 -1.26 -5.05 105.19 106.37 1yas n GLY 71 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1yas n GLY 71 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1yas s GLU 72 N -0.48 3.64 0.12 1.61 -1.05 -0.80 -5.07 118.70 116.67 1yas s GLU 72 Ca 0.00 -0.04 0.09 0.00 -0.15 0.00 0.00 54.97 54.87 1yas s GLU 72 Cb 0.00 -2.81 -0.04 0.00 -0.44 0.00 0.00 34.13 30.84 1yas s GLU 72 CO 0.00 0.44 -0.22 0.15 0.95 0.00 0.00 175.26 176.58 1yas s LYS 73 N -2.71 1.22 0.13 -4.83 1.02 -1.26 -4.73 119.74 108.58 1yas s LYS 73 Ca 0.42 -1.25 0.06 0.00 0.02 0.00 0.00 55.97 55.23 1yas s LYS 73 Cb -0.12 -1.51 -0.04 0.00 -0.52 0.00 0.00 37.83 35.64 1yas s LYS 73 CO 0.24 0.35 -0.15 0.14 -0.92 0.00 0.00 175.35 175.01 1yas s VAL 74 N -1.26 1.45 -0.31 3.17 -7.23 -0.18 -4.44 120.40 111.59 1yas s VAL 74 Ca 0.10 -1.78 -0.11 0.00 -1.81 0.00 0.00 61.98 58.38 1yas s VAL 74 Cb -0.09 -1.62 -0.02 0.00 0.56 0.00 0.00 36.38 35.20 1yas s VAL 74 CO 0.05 -0.40 0.19 -0.63 -0.31 0.00 0.00 175.10 174.00 1yas s ILE 75 N -2.15 5.00 -0.07 -0.62 1.01 0.09 -0.98 121.20 123.48 1yas s ILE 75 Ca 0.11 -0.21 -0.27 0.00 0.00 0.00 0.00 60.65 60.28 1yas s ILE 75 Cb -0.05 -3.51 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 1yas s ILE 75 CO 0.04 0.09 0.89 -0.76 0.00 0.00 0.00 174.94 175.19 1yas s LEU 76 N 1.69 4.30 -0.25 2.97 1.43 -0.56 -0.93 118.68 127.33 1yas s LEU 76 Ca 0.06 1.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.60 1yas s LEU 76 Cb -0.17 -3.38 0.04 0.00 0.03 0.00 0.00 46.19 42.71 1yas s LEU 76 CO 0.09 -0.28 -0.10 -0.69 0.23 0.00 0.00 176.35 175.60 1yas s VAL 77 N 1.33 2.48 0.04 -1.59 1.01 0.18 0.02 120.40 123.87 1yas s VAL 77 Ca 0.45 -1.29 0.09 0.00 0.00 0.00 0.00 61.98 61.23 1yas s VAL 77 Cb -0.19 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 1yas s VAL 77 CO 0.21 0.13 -0.25 -0.83 0.00 0.00 0.00 175.10 174.35 1yas s GLY 78 N 1.22 1.41 -0.02 4.51 0.00 -0.40 -1.19 107.32 112.85 1yas s GLY 78 Ca -0.03 -1.24 0.04 0.00 0.00 0.00 0.00 44.72 43.48 1yas s GLY 78 CO -0.06 -1.12 -0.12 -1.83 0.00 0.00 0.00 173.10 169.98 1yas s GLU 79 N -1.17 2.48 2.76 2.90 -1.05 -1.00 -0.53 118.70 123.08 1yas s GLU 79 Ca 0.12 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 54.21 1yas s GLU 79 Cb -0.10 -2.41 0.00 0.00 -0.44 0.00 0.00 34.13 31.18 1yas s GLU 79 CO 0.02 0.61 0.00 0.45 0.95 0.00 0.00 175.26 177.29 1yas n SER 80 N 1.95 0.00 0.00 0.83 2.88 -0.94 -0.58 113.62 117.76 1yas n SER 80 Ca -0.17 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.49 1yas n SER 80 Cb 0.52 0.00 0.67 0.00 -0.75 0.00 0.00 64.21 64.65 1yas n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yas h GLY 82 N 3.73 0.00 0.53 0.00 0.00 -1.03 -1.45 103.07 104.85 1yas h GLY 82 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.44 1yas h GLY 82 CO 0.00 0.00 0.64 -1.33 0.00 0.00 0.00 176.54 175.85 1yas h GLY 83 N 0.00 1.62 1.16 4.60 0.00 -1.75 -1.80 103.07 106.91 1yas h GLY 83 Ca 0.25 -0.44 -0.13 0.00 0.00 0.00 0.00 47.33 47.02 1yas h GLY 83 CO -0.00 0.20 -0.24 1.41 0.00 0.00 0.00 176.54 177.91 1yas h LEU 84 N 1.03 0.98 -1.02 3.11 3.38 -1.51 -2.06 115.31 119.22 1yas h LEU 84 Ca 0.48 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1yas h LEU 84 Cb 0.42 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1yas h LEU 84 CO -0.24 1.16 0.66 0.78 0.09 0.00 0.00 178.44 180.88 1yas h ASN 85 N 0.81 1.12 -0.67 -0.43 2.35 -1.53 -1.49 115.58 115.74 1yas h ASN 85 Ca 0.10 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.79 1yas h ASN 85 Cb 0.81 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 1yas h ASN 85 CO 0.07 0.80 0.25 0.40 -1.65 0.00 0.00 177.43 177.29 1yas h ILE 86 N 1.32 1.25 -0.47 2.81 2.04 -1.13 -0.35 117.51 122.97 1yas h ILE 86 Ca 0.38 -0.80 -0.04 0.00 1.00 0.00 0.00 64.86 65.40 1yas h ILE 86 Cb -0.10 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 1yas h ILE 86 CO -0.10 0.31 0.15 0.00 0.00 0.00 0.00 178.15 178.52 1yas h ALA 87 N 1.11 0.62 -0.37 1.87 0.00 -0.84 -0.24 119.26 121.40 1yas h ALA 87 Ca 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1yas h ALA 87 Cb 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1yas h ALA 87 CO -0.01 0.27 0.19 0.82 0.00 0.00 0.00 179.25 180.52 1yas h ILE 88 N 0.63 1.16 -0.41 0.00 2.04 -1.11 -2.64 117.51 117.18 1yas h ILE 88 Ca 0.15 -0.44 -0.13 0.00 1.00 0.00 0.00 64.86 65.45 1yas h ILE 88 Cb 0.27 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 1yas h ILE 88 CO -0.01 0.17 -0.24 0.00 0.00 0.00 0.00 178.15 178.07 1yas h ALA 89 N 1.04 0.79 0.00 1.87 0.00 -0.88 -3.02 119.26 119.06 1yas h ALA 89 Ca 0.13 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1yas h ALA 89 Cb 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1yas h ALA 89 CO -0.02 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1yas h ALA 90 N 0.99 1.00 0.00 0.00 0.00 -0.98 0.59 119.26 120.87 1yas h ALA 90 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1yas h ALA 90 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1yas h ALA 90 CO 0.06 0.00 -0.03 -0.25 0.00 0.00 0.00 179.25 179.04 1yas n ASP 91 N -2.70 0.20 -0.01 0.00 9.92 -1.00 -2.71 116.55 120.24 1yas n ASP 91 Ca 0.02 0.48 -0.00 0.00 -0.53 0.00 0.00 54.79 54.76 1yas n ASP 91 Cb 0.31 -0.52 -0.02 0.00 -0.64 0.00 0.00 41.12 40.25 1yas n ASP 91 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1yas n LYS 92 N -1.66 2.22 -2.37 -1.24 4.81 -0.65 -4.84 118.16 114.44 1yas n LYS 92 Ca 0.07 -0.01 -0.02 0.00 -0.87 0.00 0.00 58.31 57.47 1yas n LYS 92 Cb 0.36 -1.07 0.05 0.00 0.02 0.00 0.00 35.03 34.39 1yas n LYS 92 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1yas n TYR 93 N -1.91 1.19 0.18 5.64 4.01 0.11 -4.91 117.16 121.47 1yas n TYR 93 Ca -0.03 -1.82 0.17 0.00 -0.16 0.00 0.00 57.90 56.06 1yas n TYR 93 Cb 0.39 -0.23 0.79 0.00 -0.31 0.00 0.00 39.34 39.98 1yas n TYR 93 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1yas h GLU 95 N 0.00 0.00 -0.01 0.00 3.07 -1.90 -2.85 114.58 112.88 1yas h GLU 95 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1yas h GLU 95 Cb 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.42 1yas h GLU 95 CO -0.00 0.16 -0.20 1.63 -1.40 0.00 0.00 179.01 179.20 1yas n LYS 96 N -3.56 1.19 -3.74 2.33 5.02 0.20 -4.88 118.16 114.72 1yas n LYS 96 Ca -0.01 -0.76 -0.38 0.00 -2.02 0.00 0.00 58.31 55.14 1yas n LYS 96 Cb 0.30 -1.48 -0.12 0.00 -0.02 0.00 0.00 35.03 33.71 1yas n LYS 96 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1yas s ILE 97 N -2.33 3.85 0.19 -0.18 1.01 -1.08 -1.01 121.20 121.64 1yas s ILE 97 Ca 0.28 -1.07 -0.07 0.00 0.00 0.00 0.00 60.65 59.79 1yas s ILE 97 Cb 0.20 -3.15 0.04 0.00 0.01 0.00 0.00 42.46 39.55 1yas s ILE 97 CO 0.46 -0.15 1.61 0.00 0.00 0.00 0.00 174.94 176.86 1yas h ALA 98 N 8.23 0.81 -1.73 9.38 0.00 -1.33 -3.47 119.26 131.17 1yas h ALA 98 Ca -0.24 -0.36 0.16 0.00 0.00 0.00 0.00 54.91 54.47 1yas h ALA 98 Cb 1.09 -0.18 -0.19 0.00 0.00 0.00 0.00 17.79 18.51 1yas h ALA 98 CO 0.61 0.65 0.66 0.00 0.00 0.00 0.00 179.25 181.17 1yas s ALA 99 N -4.74 -1.96 -0.10 0.00 0.00 -1.25 -4.53 121.76 109.17 1yas s ALA 99 Ca -0.11 1.43 0.04 0.00 0.00 0.00 0.00 51.96 53.32 1yas s ALA 99 Cb 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 23.12 23.05 1yas s ALA 99 CO 0.85 -0.53 -0.23 0.00 0.00 0.00 0.00 175.76 175.85 1yas s ALA 100 N -2.22 2.20 -0.20 0.00 0.00 -0.45 -1.50 121.76 119.59 1yas s ALA 100 Ca 0.05 -0.97 -0.11 0.00 0.00 0.00 0.00 51.96 50.93 1yas s ALA 100 Cb -0.01 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 22.22 1yas s ALA 100 CO -0.05 0.27 0.19 0.08 0.00 0.00 0.00 175.76 176.25 1yas s VAL 101 N 0.37 5.36 -0.27 0.00 1.01 0.10 -1.28 120.40 125.69 1yas s VAL 101 Ca -0.18 0.31 -0.09 0.00 0.00 0.00 0.00 61.98 62.02 1yas s VAL 101 Cb -0.18 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1yas s VAL 101 CO 0.08 0.40 0.12 -0.36 0.00 0.00 0.00 175.10 175.34 1yas s PHE 102 N 0.57 3.14 -0.38 5.22 0.40 0.50 -1.27 117.98 126.15 1yas s PHE 102 Ca 0.11 -0.34 -0.02 0.00 -0.60 0.00 0.00 56.93 56.08 1yas s PHE 102 Cb -0.12 -2.30 0.10 0.00 0.51 0.00 0.00 43.02 41.21 1yas s PHE 102 CO 0.01 -0.34 0.15 -1.58 0.70 0.00 0.00 175.22 174.17 1yas s HIS 103 N 1.65 3.55 -1.60 0.36 2.46 0.31 -0.14 115.29 121.88 1yas s HIS 103 Ca 0.06 -2.36 -0.06 0.00 0.47 0.00 0.00 55.06 53.17 1yas s HIS 103 Cb -0.16 -2.99 0.06 0.00 -0.13 0.00 0.00 32.58 29.36 1yas s HIS 103 CO 0.06 -0.94 0.27 0.09 -2.47 0.00 0.00 174.74 171.75 1yas n ASN 104 N 4.57 -0.20 -4.66 9.88 3.02 -0.34 -2.21 115.26 125.32 1yas n ASN 104 Ca -0.04 -1.19 -0.24 0.00 -0.03 0.00 0.00 54.58 53.08 1yas n ASN 104 Cb 0.42 -2.01 -0.07 0.00 -0.61 0.00 0.00 39.78 37.51 1yas n ASN 104 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1yas s SER 105 N -4.08 4.69 0.45 6.41 0.15 -1.26 -2.71 113.70 117.35 1yas s SER 105 Ca 0.22 -0.52 -0.24 0.00 0.70 0.00 0.00 55.95 56.11 1yas s SER 105 Cb -0.13 -0.95 -0.08 0.00 -1.71 0.00 0.00 66.02 63.16 1yas s SER 105 CO 0.98 0.03 1.20 0.68 1.20 0.00 0.00 173.24 177.33 1yas s VAL 106 N -2.06 2.97 -0.45 4.45 -7.23 -0.65 -4.88 120.40 112.54 1yas s VAL 106 Ca 0.30 0.76 0.02 0.00 -1.81 0.00 0.00 61.98 61.25 1yas s VAL 106 Cb -0.08 -3.41 0.14 0.00 0.56 0.00 0.00 36.38 33.60 1yas s VAL 106 CO 0.20 0.03 0.25 -0.22 -0.31 0.00 0.00 175.10 175.04 1yas s LEU 107 N -2.86 2.71 0.91 1.32 2.96 -1.26 -4.30 118.68 118.15 1yas s LEU 107 Ca 0.62 -2.67 -0.10 0.00 -0.22 0.00 0.00 54.13 51.75 1yas s LEU 107 Cb -0.31 -1.03 0.14 0.00 0.50 0.00 0.00 46.19 45.49 1yas s LEU 107 CO 0.39 -0.26 1.14 -2.84 -1.32 0.00 0.00 176.35 173.45 1yas s PRO 108 N 0.29 1.09 0.00 0.98 0.02 -1.26 -4.88 135.00 131.24 1yas s PRO 108 Ca 0.18 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.68 1yas s PRO 108 Cb -0.23 -1.74 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1yas s PRO 108 CO -0.01 -2.56 0.00 -0.40 -0.33 0.00 0.00 177.00 173.70 1yas n ASP 109 N -4.18 1.42 -0.30 2.53 5.68 -1.26 -5.03 116.55 115.42 1yas n ASP 109 Ca 0.11 -0.88 0.06 0.00 -0.50 0.00 0.00 54.79 53.58 1yas n ASP 109 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1yas n ASP 109 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1yas n THR 110 N 0.00 0.00 -0.04 2.12 -2.24 -1.26 -4.44 114.28 108.42 1yas n THR 110 Ca 0.00 -0.38 -0.08 0.00 -2.27 0.00 0.00 64.05 61.32 1yas n THR 110 Cb 0.00 1.15 -0.14 0.00 -2.10 0.00 0.00 70.33 69.24 1yas n THR 110 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1yas n GLU 111 N -0.15 0.65 -4.51 -0.78 4.71 -1.26 -4.77 120.64 114.53 1yas n GLU 111 Ca 0.05 0.20 -0.25 0.00 -0.01 0.00 0.00 57.16 57.16 1yas n GLU 111 Cb 0.26 -1.72 -0.10 0.00 -1.01 0.00 0.00 31.44 28.87 1yas n GLU 111 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 1yas s HIS 112 N -2.62 2.28 0.89 -0.32 3.76 -1.26 -5.13 115.29 112.89 1yas s HIS 112 Ca -0.06 -0.52 -0.12 0.00 -0.15 0.00 0.00 55.06 54.21 1yas s HIS 112 Cb 0.08 -1.26 0.07 0.00 1.11 0.00 0.00 32.58 32.58 1yas s HIS 112 CO 0.83 0.54 0.79 0.00 -0.85 0.00 0.00 174.74 176.04 1yas h PRO 114 N -1.39 0.00 0.00 0.00 0.11 -1.77 -2.14 132.00 126.81 1yas h PRO 114 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1yas h PRO 114 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1yas h PRO 114 CO 0.39 0.05 0.00 -1.13 -0.21 0.00 0.00 178.00 177.11 1yas n SER 115 N -3.43 0.00 -0.19 -2.05 3.41 -1.23 -4.48 113.62 105.65 1yas n SER 115 Ca -0.02 0.47 -0.03 0.00 -0.26 0.00 0.00 58.87 59.03 1yas n SER 115 Cb 0.18 -0.49 0.03 0.00 -0.26 0.00 0.00 64.21 63.68 1yas n SER 115 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1yas h TYR 116 N 0.00 -0.57 0.00 7.33 3.20 -1.71 0.30 116.97 125.53 1yas h TYR 116 Ca 0.00 0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.86 1yas h TYR 116 Cb 0.48 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 39.08 1yas h TYR 116 CO 0.00 -0.32 -0.34 0.28 -1.64 0.00 0.00 178.16 176.14 1yas h VAL 117 N -0.09 1.05 0.11 1.81 2.07 -1.84 -1.65 116.25 117.71 1yas h VAL 117 Ca 0.26 -1.25 -0.27 0.00 0.82 0.00 0.00 66.70 66.26 1yas h VAL 117 Cb 0.49 1.71 0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1yas h VAL 117 CO -0.63 0.33 -1.20 0.58 0.02 0.00 0.00 177.57 176.68 1yas h VAL 118 N 0.00 1.42 -0.65 2.57 2.07 -1.50 -0.30 116.25 119.85 1yas h VAL 118 Ca -0.00 -2.78 -0.08 0.00 0.82 0.00 0.00 66.70 64.65 1yas h VAL 118 Cb 0.68 2.80 -0.03 0.00 -1.52 0.00 0.00 31.29 33.22 1yas h VAL 118 CO 0.04 0.82 0.09 0.44 0.02 0.00 0.00 177.57 178.99 1yas h ASP 119 N 0.15 1.05 0.38 0.57 3.32 -0.79 -2.13 116.42 118.97 1yas h ASP 119 Ca -0.14 -0.27 -0.11 0.00 0.02 0.00 0.00 57.03 56.53 1yas h ASP 119 Cb 1.89 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 41.15 1yas h ASP 119 CO 0.21 1.05 -0.48 0.50 -1.72 0.00 0.00 179.24 178.80 1yas h LYS 120 N 1.01 0.12 -0.63 3.56 1.63 -1.11 -2.64 116.57 118.51 1yas h LYS 120 Ca 0.20 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.85 1yas h LYS 120 Cb 0.45 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.06 1yas h LYS 120 CO 0.01 0.58 0.08 1.25 -3.45 0.00 0.00 179.45 177.93 1yas h LEU 121 N 0.10 1.01 -1.51 5.20 5.85 -0.72 -2.76 115.31 122.48 1yas h LEU 121 Ca 0.00 -0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 1yas h LEU 121 Cb 0.89 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1yas h LEU 121 CO 0.07 1.01 -0.23 0.24 -0.34 0.00 0.00 178.44 179.19 1yas h MET 122 N 0.98 0.00 -0.12 1.25 2.86 -1.04 0.28 114.93 119.14 1yas h MET 122 Ca 0.19 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.60 1yas h MET 122 Cb 0.45 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.12 1yas h MET 122 CO 0.02 0.23 -0.82 0.93 1.06 0.00 0.00 176.91 178.32 1yas h GLU 123 N 0.00 0.77 0.05 1.72 5.08 -1.25 -3.04 114.58 117.91 1yas h GLU 123 Ca -0.00 -0.67 -0.23 0.00 -1.00 0.00 0.00 59.36 57.46 1yas h GLU 123 Cb 0.54 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1yas h GLU 123 CO 0.03 1.27 -1.05 0.28 -1.00 0.00 0.00 179.01 178.54 1yas h VAL 124 N 0.49 1.56 -2.74 3.13 2.07 -1.23 -3.40 116.25 116.12 1yas h VAL 124 Ca -0.07 -3.02 -0.61 0.00 0.82 0.00 0.00 66.70 63.83 1yas h VAL 124 Cb 1.46 2.75 -0.40 0.00 -1.52 0.00 0.00 31.29 33.58 1yas h VAL 124 CO 0.17 0.87 -0.75 0.33 0.02 0.00 0.00 177.57 178.22 1yas n PHE 125 N -3.52 1.51 0.49 1.57 7.35 0.94 -4.97 117.46 120.83 1yas n PHE 125 Ca -0.04 -3.89 0.11 0.00 -0.76 0.00 0.00 57.45 52.87 1yas n PHE 125 Cb 0.93 -0.26 -0.01 0.00 0.35 0.00 0.00 39.48 40.49 1yas n PHE 125 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1yas n PRO 126 N 2.26 0.34 -3.68 -7.13 -0.04 -1.15 -4.46 135.00 121.15 1yas n PRO 126 Ca 0.24 -0.02 -0.39 0.00 -0.04 0.00 0.00 63.50 63.30 1yas n PRO 126 Cb 0.41 -1.60 -0.11 0.00 -0.04 0.00 0.00 33.50 32.16 1yas n PRO 126 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1yas s ASP 127 N -4.04 5.47 -0.25 3.54 2.15 -1.26 -4.93 116.67 117.34 1yas s ASP 127 Ca 0.02 -1.42 0.10 0.00 0.43 0.00 0.00 52.55 51.68 1yas s ASP 127 Cb 0.14 -1.92 0.68 0.00 -0.30 0.00 0.00 42.92 41.51 1yas s ASP 127 CO 0.82 -0.46 1.63 0.79 -0.17 0.00 0.00 175.17 177.78 1yas n TRP 128 N 4.84 2.01 0.00 -5.34 7.02 -1.26 -5.03 117.44 119.68 1yas n TRP 128 Ca -0.10 -0.88 0.00 0.00 -1.02 0.00 0.00 57.50 55.50 1yas n TRP 128 Cb 0.43 -0.55 0.00 0.00 -2.42 0.00 0.00 31.31 28.77 1yas n TRP 128 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1yas n LYS 129 N 0.18 0.00 -0.11 -0.99 5.02 -1.26 -1.94 118.16 119.06 1yas n LYS 129 Ca 0.31 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.61 1yas n LYS 129 Cb 1.18 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 36.24 1yas n LYS 129 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1yas n ASP 130 N 3.37 1.48 -4.75 4.39 5.75 -1.26 -4.92 116.55 120.61 1yas n ASP 130 Ca 0.00 -2.11 -0.41 0.00 -0.01 0.00 0.00 54.79 52.26 1yas n ASP 130 Cb 0.00 -0.47 -0.02 0.00 -1.03 0.00 0.00 41.12 39.60 1yas n ASP 130 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1yas s THR 131 N -1.30 2.35 0.26 2.12 2.01 -0.82 -3.92 115.64 116.34 1yas s THR 131 Ca 0.07 0.29 0.07 0.00 0.31 0.00 0.00 61.69 62.43 1yas s THR 131 Cb 0.05 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.34 1yas s THR 131 CO 0.02 0.05 0.24 0.42 -0.69 0.00 0.00 174.62 174.67 1yas s THR 132 N -0.02 4.58 0.13 -0.82 -4.23 -0.06 -4.85 115.64 110.38 1yas s THR 132 Ca 0.61 -1.30 0.05 0.00 -1.18 0.00 0.00 61.69 59.87 1yas s THR 132 Cb -0.45 -3.50 -0.04 0.00 1.34 0.00 0.00 72.50 69.85 1yas s THR 132 CO 0.46 -0.33 -0.11 -0.31 -0.54 0.00 0.00 174.62 173.78 1yas s TYR 133 N -2.11 1.28 0.15 3.99 2.02 -1.26 -0.65 117.35 120.77 1yas s TYR 133 Ca 0.34 -0.67 -0.14 0.00 -0.37 0.00 0.00 57.07 56.23 1yas s TYR 133 Cb -0.08 -0.66 0.02 0.00 -0.40 0.00 0.00 41.96 40.84 1yas s TYR 133 CO 0.26 0.10 0.39 -0.59 -1.57 0.00 0.00 175.55 174.13 1yas s PHE 134 N -2.79 0.03 0.11 2.71 -0.71 -1.05 -4.98 117.98 111.29 1yas s PHE 134 Ca 0.12 -0.38 0.10 0.00 -1.04 0.00 0.00 56.93 55.74 1yas s PHE 134 Cb -0.01 0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 41.95 1yas s PHE 134 CO 0.01 -0.76 -0.26 0.95 -1.34 0.00 0.00 175.22 173.83 1yas s THR 135 N -3.88 2.13 0.12 -4.49 -4.23 -1.26 -0.78 115.64 103.26 1yas s THR 135 Ca 0.09 -1.65 -0.05 0.00 -1.18 0.00 0.00 61.69 58.91 1yas s THR 135 Cb 0.02 -1.88 -0.02 0.00 1.34 0.00 0.00 72.50 71.95 1yas s THR 135 CO -0.06 0.11 0.14 -0.72 -0.54 0.00 0.00 174.62 173.55 1yas s TYR 136 N -1.03 0.56 -0.14 3.99 1.13 -0.62 -4.94 117.35 116.30 1yas s TYR 136 Ca 0.12 -0.96 -0.01 0.00 -1.41 0.00 0.00 57.07 54.80 1yas s TYR 136 Cb -0.10 -0.27 -0.02 0.00 -1.10 0.00 0.00 41.96 40.47 1yas s TYR 136 CO 0.05 -0.57 -0.09 0.99 -2.51 0.00 0.00 175.55 173.42 1yas s THR 137 N -3.98 3.41 -0.05 -3.49 2.01 -1.26 0.05 115.64 112.35 1yas s THR 137 Ca 0.17 -0.53 -0.02 0.00 0.31 0.00 0.00 61.69 61.61 1yas s THR 137 Cb 0.06 -2.46 0.04 0.00 0.01 0.00 0.00 72.50 70.15 1yas s THR 137 CO -0.02 0.52 0.09 -0.75 -0.69 0.00 0.00 174.62 173.77 1yas s LYS 138 N 0.29 0.02 -1.52 4.92 2.36 -0.45 -4.88 119.74 120.48 1yas s LYS 138 Ca -0.07 0.32 -0.09 0.00 -2.55 0.00 0.00 55.97 53.58 1yas s LYS 138 Cb -0.15 -0.25 0.07 0.00 -1.05 0.00 0.00 37.83 36.45 1yas s LYS 138 CO 0.04 -0.20 0.72 -0.25 1.55 0.00 0.00 175.35 177.21 1yas n ASP 139 N 4.42 -2.53 0.00 1.43 9.92 -1.26 -1.22 116.55 127.31 1yas n ASP 139 Ca -0.23 -0.92 0.00 0.00 -0.53 0.00 0.00 54.79 53.11 1yas n ASP 139 Cb 0.51 -3.31 0.00 0.00 -0.64 0.00 0.00 41.12 37.67 1yas n ASP 139 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1yas n GLY 140 N -1.68 0.32 3.67 0.44 0.00 -1.26 -5.02 105.19 101.67 1yas n GLY 140 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1yas n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yas s LYS 141 N -0.85 3.56 -0.23 1.61 1.02 -0.36 -5.08 119.74 119.41 1yas s LYS 141 Ca 0.00 -0.35 -0.25 0.00 0.02 0.00 0.00 55.97 55.39 1yas s LYS 141 Cb 0.00 -3.05 -0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1yas s LYS 141 CO 0.00 0.47 0.85 -2.00 -0.92 0.00 0.00 175.35 173.75 1yas s GLU 142 N -0.22 4.20 0.02 1.68 2.12 -1.26 -1.34 118.70 123.91 1yas s GLU 142 Ca 0.07 0.99 0.04 0.00 0.36 0.00 0.00 54.97 56.43 1yas s GLU 142 Cb -0.12 -3.64 -0.03 0.00 0.26 0.00 0.00 34.13 30.60 1yas s GLU 142 CO 0.02 -0.50 -0.07 0.42 -0.54 0.00 0.00 175.26 174.59 1yas s ILE 143 N 2.78 3.64 -0.34 -3.70 1.01 0.11 -4.94 121.20 119.77 1yas s ILE 143 Ca 0.36 -0.84 -0.12 0.00 0.00 0.00 0.00 60.65 60.05 1yas s ILE 143 Cb -0.15 -2.61 -0.01 0.00 0.01 0.00 0.00 42.46 39.70 1yas s ILE 143 CO 0.08 0.35 0.22 -0.89 0.00 0.00 0.00 174.94 174.69 1yas s THR 144 N -1.04 5.09 0.52 2.92 2.01 -1.26 -1.59 115.64 122.28 1yas s THR 144 Ca 0.18 -0.29 -0.04 0.00 0.31 0.00 0.00 61.69 61.85 1yas s THR 144 Cb -0.11 -3.62 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 1yas s THR 144 CO 0.09 -0.00 0.79 -0.83 -0.69 0.00 0.00 174.62 173.98 1yas s GLY 145 N 1.69 1.56 0.03 4.40 0.00 0.04 -4.28 107.32 110.76 1yas s GLY 145 Ca 0.06 -0.77 -0.08 0.00 0.00 0.00 0.00 44.72 43.93 1yas s GLY 145 CO 0.09 -0.56 0.15 0.48 0.00 0.00 0.00 173.10 173.27 1yas s LEU 146 N -4.78 1.56 -0.17 0.66 2.34 -0.09 -2.54 118.68 115.67 1yas s LEU 146 Ca 0.50 -0.41 -0.01 0.00 0.06 0.00 0.00 54.13 54.28 1yas s LEU 146 Cb -0.10 0.78 0.05 0.00 -0.56 0.00 0.00 46.19 46.35 1yas s LEU 146 CO 0.43 -0.51 -0.03 -0.75 -1.06 0.00 0.00 176.35 174.42 1yas s LYS 147 N -2.41 1.25 0.10 1.48 2.20 0.17 -0.86 119.74 121.67 1yas s LYS 147 Ca -0.06 -0.50 -0.35 0.00 -0.36 0.00 0.00 55.97 54.70 1yas s LYS 147 Cb -0.02 -2.01 -0.14 0.00 -1.51 0.00 0.00 37.83 34.15 1yas s LYS 147 CO -0.03 -0.48 1.59 1.28 -0.36 0.00 0.00 175.35 177.35 1yas n LEU 148 N 4.91 2.88 -4.81 5.43 4.77 -1.26 -0.88 117.00 128.04 1yas n LEU 148 Ca -0.11 1.07 -0.33 0.00 -0.03 0.00 0.00 56.01 56.61 1yas n LEU 148 Cb 0.47 -1.37 -0.03 0.00 -2.33 0.00 0.00 43.42 40.17 1yas n LEU 148 CO 0.16 -0.39 0.70 -0.83 -1.33 0.00 0.00 177.39 175.70 1yas s GLY 149 N 1.39 2.34 0.32 -0.72 0.00 -1.25 -4.83 107.32 104.56 1yas s GLY 149 Ca 0.82 0.47 0.12 0.00 0.00 0.00 0.00 44.72 46.13 1yas s GLY 149 CO 0.42 0.78 1.72 0.74 0.00 0.00 0.00 173.10 176.76 1yas h PHE 150 N 1.23 0.00 0.02 1.90 0.04 -1.93 0.22 116.94 118.42 1yas h PHE 150 Ca -0.48 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 60.02 1yas h PHE 150 Cb 1.21 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.38 1yas h PHE 150 CO 0.59 0.49 -1.07 1.15 -0.60 0.00 0.00 178.31 178.87 1yas h THR 151 N 0.00 1.30 -0.42 -1.55 2.02 -1.93 -1.38 112.91 110.95 1yas h THR 151 Ca -0.00 -2.33 0.01 0.00 0.77 0.00 0.00 66.41 64.85 1yas h THR 151 Cb 0.88 2.45 -0.02 0.00 -1.74 0.00 0.00 68.15 69.72 1yas h THR 151 CO 0.06 0.71 0.26 0.25 0.37 0.00 0.00 175.52 177.18 1yas h LEU 152 N 0.34 0.45 -0.19 2.58 5.85 -1.76 -1.09 115.31 121.50 1yas h LEU 152 Ca -0.13 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.62 1yas h LEU 152 Cb 1.73 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.62 1yas h LEU 152 CO 0.21 0.32 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.52 1yas h LEU 153 N 0.54 -0.16 -0.14 2.25 4.07 -0.93 0.35 115.31 121.28 1yas h LEU 153 Ca 0.16 0.05 -0.01 0.00 0.08 0.00 0.00 57.88 58.17 1yas h LEU 153 Cb -0.03 0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 1yas h LEU 153 CO -0.05 -0.06 0.06 -0.09 -1.08 0.00 0.00 178.44 177.22 1yas h ARG 154 N 0.01 0.20 0.16 1.13 9.65 -0.97 -0.18 114.38 124.39 1yas h ARG 154 Ca 0.09 -0.03 -0.27 0.00 -1.10 0.00 0.00 59.98 58.67 1yas h ARG 154 Cb 0.13 -0.03 0.01 0.00 -1.39 0.00 0.00 29.97 28.69 1yas h ARG 154 CO -0.19 0.28 -1.27 0.93 2.80 0.00 0.00 179.97 182.53 1yas h GLU 155 N 0.08 0.34 0.00 0.20 5.08 -1.17 -3.07 114.58 116.03 1yas h GLU 155 Ca 0.05 -0.58 -0.37 0.00 -1.00 0.00 0.00 59.36 57.46 1yas h GLU 155 Cb 0.15 0.22 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 1yas h GLU 155 CO -0.00 1.28 -2.38 0.09 -1.00 0.00 0.00 179.01 176.99 1yas n ASN 156 N -3.91 0.58 -0.12 1.42 4.13 0.10 -4.24 115.26 113.21 1yas n ASN 156 Ca -0.20 -0.03 -0.18 0.00 1.68 0.00 0.00 54.58 55.85 1yas n ASN 156 Cb 0.93 0.65 -0.11 0.00 -1.54 0.00 0.00 39.78 39.72 1yas n ASN 156 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1yas n LEU 157 N -2.86 2.91 -1.26 3.41 4.32 -1.15 -3.65 117.00 118.71 1yas n LEU 157 Ca -0.35 -0.10 -0.07 0.00 -0.02 0.00 0.00 56.01 55.46 1yas n LEU 157 Cb 1.10 -0.86 0.18 0.00 -1.62 0.00 0.00 43.42 42.22 1yas n LEU 157 CO 0.38 0.90 0.66 -1.22 -1.22 0.00 0.00 177.39 176.88 1yas n TYR 158 N -3.29 1.26 -0.37 -1.77 4.02 -0.09 -3.09 117.16 113.82 1yas n TYR 158 Ca -0.45 -1.73 0.01 0.00 -0.01 0.00 0.00 57.90 55.73 1yas n TYR 158 Cb 0.96 -0.51 0.07 0.00 -0.02 0.00 0.00 39.34 39.84 1yas n TYR 158 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1yas n THR 159 N -1.09 -0.48 -0.22 -0.72 -1.04 -1.16 -0.85 114.28 108.72 1yas n THR 159 Ca 0.35 2.27 0.08 0.00 -2.04 0.00 0.00 64.05 64.71 1yas n THR 159 Cb 1.00 -3.05 0.21 0.00 -1.82 0.00 0.00 70.33 66.67 1yas n THR 159 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1yas n LEU 160 N -5.49 3.29 -4.86 -4.42 4.32 -1.26 -4.94 117.00 103.64 1yas n LEU 160 Ca 0.12 -1.96 -0.31 0.00 -0.02 0.00 0.00 56.01 53.84 1yas n LEU 160 Cb 0.42 -0.32 -0.01 0.00 -1.62 0.00 0.00 43.42 41.89 1yas n LEU 160 CO -0.13 0.82 0.67 0.00 -1.22 0.00 0.00 177.39 177.53 1yas s GLY 162 N -3.72 1.67 0.45 0.00 0.00 -1.26 -4.79 107.32 99.68 1yas s GLY 162 Ca 0.56 0.36 0.12 0.00 0.00 0.00 0.00 44.72 45.76 1yas s GLY 162 CO 0.44 0.75 2.06 -0.56 0.00 0.00 0.00 173.10 175.79 1yas h PRO 163 N -1.46 0.32 -0.06 2.90 0.13 -1.97 -1.58 132.00 130.28 1yas h PRO 163 Ca -0.44 -0.02 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 1yas h PRO 163 Cb 1.25 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1yas h PRO 163 CO 0.48 0.21 -0.50 1.05 -0.23 0.00 0.00 178.00 179.01 1yas h GLU 164 N 0.33 0.15 -0.08 0.86 9.09 -1.99 0.11 114.58 123.06 1yas h GLU 164 Ca 0.14 -0.09 -0.07 0.00 0.05 0.00 0.00 59.36 59.40 1yas h GLU 164 Cb 0.17 0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 1yas h GLU 164 CO -0.03 0.62 -0.24 0.93 0.05 0.00 0.00 179.01 180.34 1yas h GLU 165 N 0.12 0.30 -0.96 1.06 4.39 -1.68 -2.87 114.58 114.95 1yas h GLU 165 Ca 0.00 -0.22 0.09 0.00 0.34 0.00 0.00 59.36 59.58 1yas h GLU 165 Cb 0.93 0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 29.54 1yas h GLU 165 CO 0.07 0.84 0.60 -0.92 -1.16 0.00 0.00 179.01 178.43 1yas h TYR 166 N -0.18 1.09 -0.28 4.33 3.20 -1.27 -2.34 116.97 121.52 1yas h TYR 166 Ca -0.01 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.94 1yas h TYR 166 Cb 0.85 -0.35 -0.05 0.00 1.54 0.00 0.00 36.73 38.73 1yas h TYR 166 CO 0.12 0.48 -0.01 1.49 -1.64 0.00 0.00 178.16 178.60 1yas h GLU 167 N 1.00 0.07 -0.69 1.82 4.57 -0.75 -0.81 114.58 119.79 1yas h GLU 167 Ca 0.45 -0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.72 1yas h GLU 167 Cb 0.35 -0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 28.85 1yas h GLU 167 CO -0.23 0.05 0.33 -0.07 -1.18 0.00 0.00 179.01 177.90 1yas h LEU 168 N 0.07 0.41 -0.07 1.64 3.38 -1.21 -0.69 115.31 118.84 1yas h LEU 168 Ca 0.13 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.18 1yas h LEU 168 Cb 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1yas h LEU 168 CO -0.23 0.23 0.01 0.00 0.09 0.00 0.00 178.44 178.54 1yas h ALA 169 N 1.43 0.07 -0.96 1.53 0.00 -0.86 0.26 119.26 120.73 1yas h ALA 169 Ca 0.34 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.35 1yas h ALA 169 Cb 0.38 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 1yas h ALA 169 CO -0.28 -0.46 0.62 0.87 0.00 0.00 0.00 179.25 180.00 1yas h LYS 170 N 0.04 1.01 0.11 0.00 1.57 -0.26 -0.81 116.57 118.23 1yas h LYS 170 Ca 0.03 -0.06 -0.28 0.00 -1.87 0.00 0.00 60.65 58.47 1yas h LYS 170 Cb 0.03 -0.23 0.02 0.00 0.08 0.00 0.00 32.23 32.13 1yas h LYS 170 CO -0.04 0.67 -1.20 0.52 -0.57 0.00 0.00 179.45 178.82 1yas h MET 171 N 1.04 0.46 0.00 3.15 2.86 -0.90 -3.40 114.93 118.14 1yas h MET 171 Ca 0.43 -0.64 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 1yas h MET 171 Cb 0.30 0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1yas h MET 171 CO -0.19 1.27 -1.13 1.28 1.06 0.00 0.00 176.91 179.21 1yas n LEU 172 N -3.69 0.35 -4.76 1.22 4.77 0.88 -4.99 117.00 110.78 1yas n LEU 172 Ca -0.11 -0.27 -0.41 0.00 -0.03 0.00 0.00 56.01 55.20 1yas n LEU 172 Cb 0.98 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.04 1yas n LEU 172 CO 0.56 0.09 0.98 0.42 -1.33 0.00 0.00 177.39 178.10 1yas s THR 173 N -2.64 2.93 0.44 -5.08 -4.23 -0.33 -4.81 115.64 101.92 1yas s THR 173 Ca 0.00 0.86 0.06 0.00 -1.18 0.00 0.00 61.69 61.44 1yas s THR 173 Cb 0.10 -3.55 -0.04 0.00 1.34 0.00 0.00 72.50 70.35 1yas s THR 173 CO 0.59 0.17 0.15 -0.13 -0.54 0.00 0.00 174.62 174.86 1yas s ARG 174 N -1.05 2.18 0.26 3.99 0.52 -0.39 -5.02 118.95 119.44 1yas s ARG 174 Ca 0.52 -1.97 -0.30 0.00 -0.52 0.00 0.00 55.73 53.47 1yas s ARG 174 Cb -0.38 -1.88 -0.10 0.00 0.52 0.00 0.00 34.95 33.10 1yas s ARG 174 CO 0.46 -0.18 1.46 0.15 0.02 0.00 0.00 175.30 177.21 1yas s LYS 175 N -3.90 4.24 0.00 3.54 1.02 -1.26 -4.44 119.74 118.94 1yas s LYS 175 Ca 0.35 2.35 0.00 0.00 0.02 0.00 0.00 55.97 58.70 1yas s LYS 175 Cb 0.04 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1yas s LYS 175 CO 0.19 -0.45 0.00 0.41 -0.92 0.00 0.00 175.35 174.59 1yas n GLY 176 N 2.06 4.68 3.53 -3.33 0.00 -0.04 -4.68 105.19 107.41 1yas n GLY 176 Ca 0.06 -1.74 -0.16 0.00 0.00 0.00 0.00 46.02 44.18 1yas n GLY 176 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1yas s SER 177 N -0.35 -0.65 0.16 1.61 0.15 -1.26 -0.91 113.70 112.44 1yas s SER 177 Ca 0.00 0.91 0.24 0.00 0.70 0.00 0.00 55.95 57.80 1yas s SER 177 Cb 0.00 0.82 0.29 0.00 -1.71 0.00 0.00 66.02 65.42 1yas s SER 177 CO 0.00 -0.47 1.29 -0.07 1.20 0.00 0.00 173.24 175.19 1yas h LEU 178 N 3.75 0.00 -0.70 3.45 3.38 -1.97 -3.48 115.31 119.75 1yas h LEU 178 Ca -0.28 -0.15 -0.48 0.00 0.09 0.00 0.00 57.88 57.06 1yas h LEU 178 Cb 1.15 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.80 1yas h LEU 178 CO 0.28 0.08 -0.74 0.49 0.09 0.00 0.00 178.44 178.63 1yas n PHE 179 N -2.28 -2.01 -0.18 1.13 3.72 -1.26 -4.85 117.46 111.73 1yas n PHE 179 Ca 0.03 0.78 -0.06 0.00 -0.05 0.00 0.00 57.45 58.15 1yas n PHE 179 Cb 0.47 -3.43 0.04 0.00 -0.94 0.00 0.00 39.48 35.61 1yas n PHE 179 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1yas h GLN 180 N -1.67 0.61 0.00 -1.08 4.15 -1.94 -0.79 115.11 114.40 1yas h GLN 180 Ca -0.55 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 58.79 1yas h GLN 180 Cb 1.36 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.91 1yas h GLN 180 CO 0.68 0.41 -0.18 -2.95 -1.93 0.00 0.00 178.83 174.86 1yas h ASN 181 N 0.63 0.00 0.56 -0.69 -0.00 -1.95 -1.70 115.58 112.43 1yas h ASN 181 Ca 0.21 0.00 -0.29 0.00 -0.00 0.00 0.00 56.30 56.22 1yas h ASN 181 Cb 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.32 1yas h ASN 181 CO -0.09 0.18 -1.41 0.40 -0.00 0.00 0.00 177.43 176.51 1yas h ILE 182 N 0.00 1.28 -0.94 6.14 2.04 -1.58 -3.26 117.51 121.19 1yas h ILE 182 Ca -0.00 -2.93 0.03 0.00 1.00 0.00 0.00 64.86 62.96 1yas h ILE 182 Cb 0.36 2.79 -0.05 0.00 -0.74 0.00 0.00 36.82 39.17 1yas h ILE 182 CO 0.02 0.83 0.61 -0.07 0.00 0.00 0.00 178.15 179.55 1yas h LEU 183 N 0.06 1.03 -0.01 1.44 3.38 -0.90 -1.59 115.31 118.72 1yas h LEU 183 Ca -0.19 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.78 1yas h LEU 183 Cb 1.97 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 42.47 1yas h LEU 183 CO 0.16 0.71 -0.09 0.00 0.09 0.00 0.00 178.44 179.32 1yas h ALA 184 N 1.38 -0.08 0.00 1.53 0.00 -1.36 -2.83 119.26 117.90 1yas h ALA 184 Ca 0.37 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1yas h ALA 184 Cb -0.02 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1yas h ALA 184 CO -0.11 -0.57 0.00 1.63 0.00 0.00 0.00 179.25 180.19 1yas n LYS 185 N -5.21 0.26 -2.17 0.00 5.02 -1.03 -4.57 118.16 110.46 1yas n LYS 185 Ca -0.06 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 55.86 1yas n LYS 185 Cb 0.14 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 1yas n LYS 185 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1yas s ARG 186 N -2.72 4.39 0.45 1.97 3.52 -0.63 -5.01 118.95 120.93 1yas s ARG 186 Ca 0.21 2.14 -0.23 0.00 -0.13 0.00 0.00 55.73 57.73 1yas s ARG 186 Cb 0.18 -3.11 -0.10 0.00 -1.56 0.00 0.00 34.95 30.35 1yas s ARG 186 CO 0.44 -0.17 0.88 -0.35 -0.81 0.00 0.00 175.30 175.29 1yas n PRO 187 N 1.37 1.07 -1.93 5.12 -0.04 -1.26 -4.40 135.00 134.93 1yas n PRO 187 Ca 0.02 0.39 -0.37 0.00 -0.04 0.00 0.00 63.50 63.50 1yas n PRO 187 Cb 0.42 -1.92 0.04 0.00 -0.04 0.00 0.00 33.50 32.00 1yas n PRO 187 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1yas s PHE 188 N -1.37 2.34 0.35 0.54 0.40 -1.26 -4.72 117.98 114.27 1yas s PHE 188 Ca 0.65 1.48 -0.28 0.00 -0.60 0.00 0.00 56.93 58.18 1yas s PHE 188 Cb -0.54 -3.59 -0.10 0.00 0.51 0.00 0.00 43.02 39.30 1yas s PHE 188 CO 0.56 -2.45 1.34 -0.06 0.70 0.00 0.00 175.22 175.30 1yas s PHE 189 N -1.48 2.93 0.38 0.36 0.08 -1.26 -4.97 117.98 114.01 1yas s PHE 189 Ca 0.76 1.37 -0.09 0.00 0.12 0.00 0.00 56.93 59.10 1yas s PHE 189 Cb -0.34 -3.74 -0.06 0.00 -0.57 0.00 0.00 43.02 38.32 1yas s PHE 189 CO 0.38 -2.09 0.71 0.95 -0.10 0.00 0.00 175.22 175.07 1yas s THR 190 N -1.16 4.86 0.26 0.64 -4.23 -1.26 -4.52 115.64 110.23 1yas s THR 190 Ca 0.51 0.43 0.04 0.00 -1.18 0.00 0.00 61.69 61.49 1yas s THR 190 Cb -0.41 -3.74 0.01 0.00 1.34 0.00 0.00 72.50 69.70 1yas s THR 190 CO 0.54 -0.49 1.64 0.11 -0.54 0.00 0.00 174.62 175.88 1yas h LYS 191 N 1.29 0.34 0.00 3.99 1.57 -1.93 0.18 116.57 122.01 1yas h LYS 191 Ca -0.47 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.02 1yas h LYS 191 Cb 1.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 1yas h LYS 191 CO 0.64 0.72 -0.98 0.93 -0.57 0.00 0.00 179.45 180.19 1yas h GLU 192 N 0.28 0.00 0.00 3.15 4.39 -1.94 -2.22 114.58 118.24 1yas h GLU 192 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1yas h GLU 192 Cb 0.90 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 1yas h GLU 192 CO 0.07 0.30 0.00 0.41 -1.16 0.00 0.00 179.01 178.64 1yas n GLY 193 N 1.29 0.92 0.20 -3.84 0.00 -1.22 -4.34 105.19 98.20 1yas n GLY 193 Ca -0.04 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 1yas n GLY 193 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1yas h TYR 194 N 0.00 0.41 -0.53 1.61 3.20 -1.43 -2.71 116.97 117.52 1yas h TYR 194 Ca 0.00 0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.01 1yas h TYR 194 Cb 0.00 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 1yas h TYR 194 CO 0.00 0.19 0.37 0.78 -1.64 0.00 0.00 178.16 177.86 1yas h GLY 195 N 0.45 0.28 1.64 1.82 0.00 -0.65 -2.42 103.07 104.20 1yas h GLY 195 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1yas h GLY 195 CO -0.18 0.04 -0.21 -1.14 0.00 0.00 0.00 176.54 175.05 1yas n SER 196 N -4.44 0.41 -4.76 0.19 3.41 -0.84 -4.90 113.62 102.70 1yas n SER 196 Ca 0.09 0.29 -0.41 0.00 -0.26 0.00 0.00 58.87 58.58 1yas n SER 196 Cb 0.47 -0.30 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 1yas n SER 196 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1yas s ILE 197 N -3.05 2.93 0.17 -1.33 1.09 -0.91 -5.00 121.20 115.10 1yas s ILE 197 Ca 0.11 0.86 -0.31 0.00 -1.10 0.00 0.00 60.65 60.21 1yas s ILE 197 Cb 0.16 -3.55 -0.10 0.00 -1.06 0.00 0.00 42.46 37.92 1yas s ILE 197 CO 0.61 0.17 1.51 -0.54 -0.10 0.00 0.00 174.94 176.59 1yas s LYS 198 N -1.05 4.25 -0.14 2.79 3.01 -1.26 -4.93 119.74 122.41 1yas s LYS 198 Ca 0.52 2.29 0.02 0.00 -1.01 0.00 0.00 55.97 57.79 1yas s LYS 198 Cb -0.38 -3.16 0.02 0.00 -1.01 0.00 0.00 37.83 33.29 1yas s LYS 198 CO 0.46 -0.54 -0.18 0.15 0.51 0.00 0.00 175.35 175.75 1yas s LYS 199 N 0.85 2.63 -0.21 1.68 -0.14 -1.26 -1.34 119.74 121.95 1yas s LYS 199 Ca 0.67 -0.70 -0.05 0.00 -1.36 0.00 0.00 55.97 54.53 1yas s LYS 199 Cb -0.42 -2.23 -0.02 0.00 -1.68 0.00 0.00 37.83 33.48 1yas s LYS 199 CO 0.33 -0.11 -0.00 0.42 -0.76 0.00 0.00 175.35 175.23 1yas s ILE 200 N 1.10 3.88 -0.24 2.17 1.09 -0.41 -0.49 121.20 128.30 1yas s ILE 200 Ca -0.02 -0.33 -0.07 0.00 -1.10 0.00 0.00 60.65 59.13 1yas s ILE 200 Cb -0.14 -2.76 -0.03 0.00 -1.06 0.00 0.00 42.46 38.47 1yas s ILE 200 CO -0.06 0.42 0.06 -0.47 -0.10 0.00 0.00 174.94 174.80 1yas s TYR 201 N 1.10 3.09 -0.12 3.97 6.14 0.16 -0.37 117.35 131.32 1yas s TYR 201 Ca 0.02 -0.41 -0.00 0.00 0.64 0.00 0.00 57.07 57.32 1yas s TYR 201 Cb -0.14 -2.22 -0.02 0.00 0.42 0.00 0.00 41.96 39.99 1yas s TYR 201 CO 0.01 -0.34 -0.11 0.08 0.64 0.00 0.00 175.55 175.83 1yas s VAL 202 N 1.53 3.23 0.19 3.14 1.01 0.80 0.26 120.40 130.57 1yas s VAL 202 Ca 0.06 -0.61 -0.22 0.00 0.00 0.00 0.00 61.98 61.21 1yas s VAL 202 Cb -0.15 -2.35 0.05 0.00 0.00 0.00 0.00 36.38 33.93 1yas s VAL 202 CO 0.03 0.54 0.62 -1.66 0.00 0.00 0.00 175.10 174.63 1yas s TRP 203 N 0.10 -0.40 0.02 5.22 1.48 -0.73 -1.20 118.94 123.43 1yas s TRP 203 Ca -0.05 0.11 0.07 0.00 -1.06 0.00 0.00 56.10 55.18 1yas s TRP 203 Cb -0.14 0.58 -0.02 0.00 -1.16 0.00 0.00 33.47 32.72 1yas s TRP 203 CO 0.04 -0.96 -0.21 -0.08 -4.06 0.00 0.00 176.95 171.69 1yas s THR 204 N -3.81 1.68 -1.37 0.66 -1.32 -1.26 -0.51 115.64 109.71 1yas s THR 204 Ca 0.04 -1.08 0.20 0.00 -1.21 0.00 0.00 61.69 59.64 1yas s THR 204 Cb -0.02 -1.43 0.32 0.00 -1.51 0.00 0.00 72.50 69.86 1yas s THR 204 CO -0.07 0.32 1.62 -0.90 -2.21 0.00 0.00 174.62 173.38 1yas n ASP 205 N 2.14 0.00 -0.17 8.08 5.68 -1.26 -3.06 116.55 127.96 1yas n ASP 205 Ca -0.16 0.07 0.15 0.00 -0.50 0.00 0.00 54.79 54.34 1yas n ASP 205 Cb 0.53 -0.31 0.73 0.00 -1.14 0.00 0.00 41.12 40.93 1yas n ASP 205 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yas n GLN 206 N -1.31 1.10 -1.90 0.11 1.13 -1.26 -4.67 117.38 110.58 1yas n GLN 206 Ca 0.09 -0.34 -0.42 0.00 -1.94 0.00 0.00 57.00 54.38 1yas n GLN 206 Cb 0.17 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.00 1yas n GLN 206 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1yas s ASP 207 N -2.14 6.59 0.00 1.08 -1.08 -1.17 -4.52 116.67 115.43 1yas s ASP 207 Ca 0.40 2.42 0.17 0.00 -0.52 0.00 0.00 52.55 55.02 1yas s ASP 207 Cb 0.21 -2.54 0.73 0.00 -1.46 0.00 0.00 42.92 39.86 1yas s ASP 207 CO 0.39 -0.95 1.51 -0.62 0.52 0.00 0.00 175.17 176.02 1yas n GLU 208 N 6.80 1.51 0.00 4.34 -0.58 -1.25 -4.06 120.64 127.41 1yas n GLU 208 Ca 0.18 -0.78 0.00 0.00 -0.42 0.00 0.00 57.16 56.14 1yas n GLU 208 Cb 0.42 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 1yas n GLU 208 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1yas n ILE 209 N 0.03 0.00 -2.54 -3.67 -0.00 -1.24 -4.78 119.36 107.16 1yas n ILE 209 Ca 0.14 0.00 -0.43 0.00 -0.00 0.00 0.00 62.75 62.46 1yas n ILE 209 Cb 0.24 -0.98 0.00 0.00 -0.00 0.00 0.00 39.64 38.90 1yas n ILE 209 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 1yas n PHE 210 N -2.68 3.76 -1.23 1.39 3.01 -1.26 -4.79 117.46 115.66 1yas n PHE 210 Ca 0.00 -3.00 -0.34 0.00 1.01 0.00 0.00 57.45 55.11 1yas n PHE 210 Cb 0.38 -2.09 0.11 0.00 -0.01 0.00 0.00 39.48 37.87 1yas n PHE 210 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1yas n LEU 211 N 4.78 4.26 -0.29 4.37 4.77 -1.26 -4.63 117.00 129.00 1yas n LEU 211 Ca 0.40 0.63 0.18 0.00 -0.03 0.00 0.00 56.01 57.18 1yas n LEU 211 Cb 0.39 -1.48 0.46 0.00 -2.33 0.00 0.00 43.42 40.46 1yas n LEU 211 CO 0.75 -1.75 1.22 -0.65 -1.33 0.00 0.00 177.39 175.63 1yas h PRO 212 N -0.60 0.49 -0.68 3.23 0.11 -1.83 0.87 132.00 133.60 1yas h PRO 212 Ca -0.47 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.63 1yas h PRO 212 Cb 1.31 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1yas h PRO 212 CO 0.47 0.32 0.43 1.49 -0.21 0.00 0.00 178.00 180.50 1yas h GLU 213 N 0.51 0.82 -0.04 1.05 4.81 -1.98 0.12 114.58 119.87 1yas h GLU 213 Ca 0.52 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.69 1yas h GLU 213 Cb 1.15 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.35 1yas h GLU 213 CO -0.25 0.55 -0.03 0.35 -0.73 0.00 0.00 179.01 178.89 1yas h PHE 214 N 0.85 0.10 -0.60 0.92 3.57 -1.18 -2.14 116.94 118.46 1yas h PHE 214 Ca 0.27 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 1yas h PHE 214 Cb -0.01 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 1yas h PHE 214 CO -0.04 0.54 0.08 1.96 -2.23 0.00 0.00 178.31 178.62 1yas h GLN 215 N -0.36 1.01 0.00 1.11 4.20 -1.18 -0.34 115.11 119.54 1yas h GLN 215 Ca 0.01 -0.28 -0.10 0.00 0.06 0.00 0.00 58.65 58.34 1yas h GLN 215 Cb 0.52 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 1yas h GLN 215 CO 0.01 0.96 -0.46 -0.07 -0.67 0.00 0.00 178.83 178.61 1yas h LEU 216 N 0.92 0.00 -0.44 1.46 3.38 -0.86 -2.14 115.31 117.63 1yas h LEU 216 Ca 0.18 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1yas h LEU 216 Cb 0.46 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1yas h LEU 216 CO 0.02 0.46 0.00 -0.25 0.09 0.00 0.00 178.44 178.75 1yas h TRP 217 N 0.00 0.84 -0.53 1.13 7.01 -0.77 -2.44 115.95 121.19 1yas h TRP 217 Ca -0.00 -0.14 -0.06 0.00 2.11 0.00 0.00 58.89 60.79 1yas h TRP 217 Cb 0.88 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.70 1yas h TRP 217 CO 0.00 0.82 0.10 1.96 -2.79 0.00 0.00 178.44 178.54 1yas h GLN 218 N 0.61 0.87 -0.70 2.65 4.20 -0.69 -0.23 115.11 121.82 1yas h GLN 218 Ca 0.12 -0.23 0.05 0.00 0.06 0.00 0.00 58.65 58.66 1yas h GLN 218 Cb 0.49 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 1yas h GLN 218 CO 0.02 0.84 0.41 0.82 -0.67 0.00 0.00 178.83 180.26 1yas h ILE 219 N 0.76 1.02 -0.12 2.54 2.04 -1.35 -1.90 117.51 120.51 1yas h ILE 219 Ca 0.16 -0.27 -0.21 0.00 1.00 0.00 0.00 64.86 65.55 1yas h ILE 219 Cb 0.38 0.17 0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1yas h ILE 219 CO 0.01 0.14 -0.77 -0.08 0.00 0.00 0.00 178.15 177.45 1yas h GLU 220 N 0.78 0.65 -0.60 2.37 4.57 -1.15 -3.12 114.58 118.07 1yas h GLU 220 Ca 0.30 -0.54 -0.05 0.00 -1.18 0.00 0.00 59.36 57.89 1yas h GLU 220 Cb 0.13 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.81 1yas h GLU 220 CO -0.16 1.16 0.16 -0.97 -1.18 0.00 0.00 179.01 178.02 1yas h ASN 221 N 0.44 0.87 -2.05 1.04 -1.24 -0.63 -3.40 115.58 110.61 1yas h ASN 221 Ca -0.05 -0.16 -0.34 0.00 0.71 0.00 0.00 56.30 56.47 1yas h ASN 221 Cb 1.38 -0.23 -0.32 0.00 0.73 0.00 0.00 38.32 39.89 1yas h ASN 221 CO 0.15 0.83 -0.65 -0.47 -1.29 0.00 0.00 177.43 176.00 1yas s TYR 222 N -5.27 -0.43 -0.10 0.67 5.04 -0.75 -5.08 117.35 111.43 1yas s TYR 222 Ca -0.10 -0.38 -0.35 0.00 -2.44 0.00 0.00 57.07 53.80 1yas s TYR 222 Cb 0.15 -0.43 -0.12 0.00 0.35 0.00 0.00 41.96 41.92 1yas s TYR 222 CO 0.81 -0.94 1.87 1.63 -1.34 0.00 0.00 175.55 177.58 1yas n LYS 223 N 4.93 2.10 -1.49 4.97 4.01 -1.18 -4.62 118.16 126.87 1yas n LYS 223 Ca 0.03 0.77 -0.32 0.00 -0.51 0.00 0.00 58.31 58.28 1yas n LYS 223 Cb 0.46 -2.60 0.07 0.00 -0.51 0.00 0.00 35.03 32.45 1yas n LYS 223 CO 0.00 0.00 0.00 -2.14 -1.11 0.00 0.00 177.40 174.15 1yas s PRO 224 N 4.02 2.44 0.23 1.97 0.02 -1.26 -4.98 135.00 137.44 1yas s PRO 224 Ca 0.93 1.37 -0.03 0.00 0.02 0.00 0.00 61.00 63.28 1yas s PRO 224 Cb -0.72 -1.91 0.24 0.00 0.02 0.00 0.00 34.50 32.14 1yas s PRO 224 CO 0.53 -1.53 1.68 -0.44 -0.33 0.00 0.00 177.00 176.91 1yas h ASP 225 N -0.50 0.76 -3.80 2.53 5.19 -1.17 -3.44 116.42 115.99 1yas h ASP 225 Ca -0.46 -0.24 -0.25 0.00 -0.62 0.00 0.00 57.03 55.46 1yas h ASP 225 Cb 1.25 -0.21 -0.28 0.00 0.18 0.00 0.00 39.33 40.27 1yas h ASP 225 CO 0.52 0.92 -0.73 -0.54 -3.12 0.00 0.00 179.24 176.29 1yas s LYS 226 N -4.72 0.09 -0.06 3.56 -0.14 -1.13 -5.03 119.74 112.31 1yas s LYS 226 Ca -0.09 -0.05 0.05 0.00 -1.36 0.00 0.00 55.97 54.51 1yas s LYS 226 Cb 0.14 -0.08 -0.00 0.00 -1.68 0.00 0.00 37.83 36.21 1yas s LYS 226 CO 0.83 0.02 -0.21 0.08 -0.76 0.00 0.00 175.35 175.31 1yas s VAL 227 N -0.07 1.74 -0.08 3.17 1.01 -1.26 -0.66 120.40 124.26 1yas s VAL 227 Ca -0.00 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.13 1yas s VAL 227 Cb -0.01 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1yas s VAL 227 CO -0.00 0.49 -0.17 -0.31 0.00 0.00 0.00 175.10 175.11 1yas s TYR 228 N 0.08 1.92 -0.22 5.22 1.51 0.14 -4.94 117.35 121.06 1yas s TYR 228 Ca -0.08 -0.74 -0.04 0.00 -1.01 0.00 0.00 57.07 55.20 1yas s TYR 228 Cb -0.14 -1.34 -0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1yas s TYR 228 CO 0.04 -0.33 -0.04 0.21 -1.11 0.00 0.00 175.55 174.32 1yas s LYS 229 N 0.49 3.37 -0.14 -0.62 2.20 -1.26 -1.77 119.74 122.02 1yas s LYS 229 Ca -0.16 -0.63 -0.22 0.00 -0.36 0.00 0.00 55.97 54.60 1yas s LYS 229 Cb -0.16 -3.01 -0.03 0.00 -1.51 0.00 0.00 37.83 33.12 1yas s LYS 229 CO 0.06 -0.20 0.69 0.08 -0.36 0.00 0.00 175.35 175.62 1yas s VAL 230 N 1.48 5.01 0.15 4.02 1.01 0.34 -4.96 120.40 127.45 1yas s VAL 230 Ca 0.06 1.36 -0.30 0.00 0.00 0.00 0.00 61.98 63.10 1yas s VAL 230 Cb -0.14 -4.01 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 1yas s VAL 230 CO -0.03 0.16 1.10 -1.61 0.00 0.00 0.00 175.10 174.71 1yas s GLU 231 N 1.46 4.58 1.93 2.72 0.41 -1.26 -4.31 118.70 124.22 1yas s GLU 231 Ca 0.34 1.69 0.00 0.00 -0.41 0.00 0.00 54.97 56.59 1yas s GLU 231 Cb -0.17 -3.30 0.00 0.00 -1.78 0.00 0.00 34.13 28.88 1yas s GLU 231 CO 0.14 0.03 0.00 0.41 -0.49 0.00 0.00 175.26 175.35 1yas n GLY 232 N 2.28 -1.50 7.00 -1.39 0.00 -1.26 -5.05 105.19 105.27 1yas n GLY 232 Ca 0.04 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1yas n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yas n GLY 233 N 0.00 -1.61 0.00 -0.02 0.00 -1.26 -4.58 105.19 97.71 1yas n GLY 233 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.73 1yas n GLY 233 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yas n ASP 234 N -0.21 0.00 -0.30 1.61 5.68 -1.26 -4.73 116.55 117.33 1yas n ASP 234 Ca 0.00 -0.21 -0.01 0.00 -0.50 0.00 0.00 54.79 54.07 1yas n ASP 234 Cb 0.00 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.09 1yas n ASP 234 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1yas h HIS 235 N 0.21 0.99 -2.10 2.11 -0.00 -1.80 -3.25 115.15 111.32 1yas h HIS 235 Ca 0.00 0.03 -0.76 0.00 -0.00 0.00 0.00 60.37 59.64 1yas h HIS 235 Cb 0.00 -0.33 -0.19 0.00 -0.00 0.00 0.00 27.41 26.89 1yas h HIS 235 CO 0.00 0.56 1.45 1.63 -0.00 0.00 0.00 177.93 181.57 1yas n LYS 236 N -4.58 3.58 0.25 5.26 4.76 -1.18 -4.79 118.16 121.46 1yas n LYS 236 Ca 0.10 -3.87 0.09 0.00 -2.87 0.00 0.00 58.31 51.77 1yas n LYS 236 Cb 0.10 -2.90 0.64 0.00 -1.84 0.00 0.00 35.03 31.04 1yas n LYS 236 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1yas h LEU 237 N 8.33 0.00 -0.42 -0.35 3.38 -1.94 -0.50 115.31 123.81 1yas h LEU 237 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1yas h LEU 237 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1yas h LEU 237 CO 1.37 0.12 0.00 0.00 0.09 0.00 0.00 178.44 180.02 1yas n GLN 238 N -4.06 0.13 -0.10 1.13 0.00 -1.26 -0.54 117.38 112.68 1yas n GLN 238 Ca -0.02 0.35 -0.16 0.00 0.00 0.00 0.00 57.00 57.16 1yas n GLN 238 Cb 0.21 -1.74 -0.09 0.00 0.00 0.00 0.00 30.24 28.62 1yas n GLN 238 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1yas n LEU 239 N -1.99 2.74 0.08 2.61 4.77 -0.34 -4.25 117.00 120.63 1yas n LEU 239 Ca 0.03 -0.05 0.12 0.00 -0.03 0.00 0.00 56.01 56.08 1yas n LEU 239 Cb 0.22 -0.70 0.01 0.00 -2.33 0.00 0.00 43.42 40.62 1yas n LEU 239 CO 0.18 0.78 0.01 0.35 -1.33 0.00 0.00 177.39 177.39 1yas n THR 240 N -3.25 0.50 -2.76 -5.08 -2.24 -0.37 -4.39 114.28 96.69 1yas n THR 240 Ca -0.37 -0.48 -0.03 0.00 -2.27 0.00 0.00 64.05 60.90 1yas n THR 240 Cb 0.87 -0.23 0.04 0.00 -2.10 0.00 0.00 70.33 68.91 1yas n THR 240 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1yas n LYS 241 N -2.50 1.70 -0.19 -0.78 4.76 0.29 -4.79 118.16 116.65 1yas n LYS 241 Ca 0.00 -3.49 -0.01 0.00 -2.87 0.00 0.00 58.31 51.94 1yas n LYS 241 Cb 0.52 -1.57 0.09 0.00 -1.84 0.00 0.00 35.03 32.24 1yas n LYS 241 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1yas h THR 242 N 4.86 0.80 -0.69 -0.18 2.02 -1.69 -1.54 112.91 116.49 1yas h THR 242 Ca -0.10 -0.14 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 1yas h THR 242 Cb 1.26 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 1yas h THR 242 CO 0.28 0.07 0.29 0.50 0.37 0.00 0.00 175.52 177.04 1yas h LYS 243 N 0.39 1.02 -0.57 6.66 3.64 -1.92 0.03 116.57 125.82 1yas h LYS 243 Ca 0.28 -0.17 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 1yas h LYS 243 Cb 0.32 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1yas h LYS 243 CO -0.28 0.83 0.02 0.93 -2.27 0.00 0.00 179.45 178.69 1yas h GLU 244 N 0.97 0.96 -0.21 1.90 3.07 -1.75 0.47 114.58 119.99 1yas h GLU 244 Ca 0.23 -0.27 -0.18 0.00 -0.50 0.00 0.00 59.36 58.63 1yas h GLU 244 Cb 0.18 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1yas h GLU 244 CO -0.02 0.93 -0.58 0.82 -1.40 0.00 0.00 179.01 178.76 1yas h ILE 245 N 0.89 1.29 -0.63 3.13 1.08 -0.82 -1.65 117.51 120.81 1yas h ILE 245 Ca 0.17 -1.79 0.02 0.00 -0.39 0.00 0.00 64.86 62.86 1yas h ILE 245 Cb 0.49 1.84 -0.04 0.00 -3.07 0.00 0.00 36.82 36.04 1yas h ILE 245 CO 0.02 0.57 0.41 0.00 -0.69 0.00 0.00 178.15 178.46 1yas h ALA 246 N 0.60 0.81 -0.39 1.87 0.00 -0.67 0.77 119.26 122.25 1yas h ALA 246 Ca -0.01 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1yas h ALA 246 Cb 1.20 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1yas h ALA 246 CO 0.13 0.19 0.22 0.93 0.00 0.00 0.00 179.25 180.72 1yas h GLU 247 N 0.82 0.44 -0.47 0.00 5.08 -0.75 0.79 114.58 120.49 1yas h GLU 247 Ca 0.24 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1yas h GLU 247 Cb -0.05 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1yas h GLU 247 CO -0.07 0.29 0.31 0.82 -1.00 0.00 0.00 179.01 179.36 1yas h ILE 248 N 0.45 1.13 0.00 3.13 2.04 -0.93 -0.89 117.51 122.44 1yas h ILE 248 Ca 0.16 -0.24 -0.08 0.00 1.00 0.00 0.00 64.86 65.70 1yas h ILE 248 Cb 0.02 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 1yas h ILE 248 CO -0.08 0.12 -0.36 -0.07 0.00 0.00 0.00 178.15 177.76 1yas h LEU 249 N 0.64 0.00 -0.07 1.44 3.38 -0.22 -0.62 115.31 119.86 1yas h LEU 249 Ca 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1yas h LEU 249 Cb -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1yas h LEU 249 CO -0.04 0.36 0.00 -0.61 0.09 0.00 0.00 178.44 178.25 1yas h GLN 250 N 0.00 0.12 -0.64 1.13 5.75 -0.38 -1.96 115.11 119.13 1yas h GLN 250 Ca -0.00 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 1yas h GLN 250 Cb 0.72 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.23 1yas h GLN 250 CO 0.05 0.37 0.37 1.49 -2.65 0.00 0.00 178.83 178.46 1yas h GLU 251 N -0.15 0.86 -0.51 1.69 4.81 -0.73 -1.05 114.58 119.50 1yas h GLU 251 Ca 0.02 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.10 1yas h GLU 251 Cb 0.31 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1yas h GLU 251 CO 0.00 0.61 0.01 0.28 -0.73 0.00 0.00 179.01 179.19 1yas h VAL 252 N 0.88 1.26 -0.84 0.32 2.07 -0.96 -2.23 116.25 116.74 1yas h VAL 252 Ca 0.23 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1yas h VAL 252 Cb -0.02 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1yas h VAL 252 CO -0.04 0.38 0.54 0.00 0.02 0.00 0.00 177.57 178.46 1yas h ALA 253 N 0.94 1.07 0.00 1.67 0.00 -1.02 -0.64 119.26 121.29 1yas h ALA 253 Ca 0.15 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1yas h ALA 253 Cb 0.51 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1yas h ALA 253 CO 0.02 0.51 -0.23 -0.44 0.00 0.00 0.00 179.25 179.11 1yas h ASP 254 N 1.15 0.00 0.13 0.00 3.32 -0.95 -3.35 116.42 116.73 1yas h ASP 254 Ca 0.31 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.00 1yas h ASP 254 Cb -0.09 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.40 1yas h ASP 254 CO -0.06 0.23 -2.20 0.41 -1.72 0.00 0.00 179.24 175.89 1yas n THR 255 N -3.75 1.48 -5.08 0.35 -1.04 -0.86 -4.78 114.28 100.60 1yas n THR 255 Ca -0.01 -0.80 -0.31 0.00 -2.04 0.00 0.00 64.05 60.88 1yas n THR 255 Cb 0.34 -0.77 -0.15 0.00 -1.82 0.00 0.00 70.33 67.93 1yas n THR 255 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1yas s TYR 256 N -2.52 2.40 0.00 -1.42 2.02 -0.30 -5.11 117.35 112.42 1yas s TYR 256 Ca -0.12 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.20 1yas s TYR 256 Cb 0.07 -1.48 0.00 0.00 -0.40 0.00 0.00 41.96 40.15 1yas s TYR 256 CO 0.80 0.06 0.00 0.27 -1.57 0.00 0.00 175.55 175.12