#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y7h n GLU 3 N 0.00 -3.73 -1.61 -1.58 2.13 -1.26 -4.97 120.64 109.62 1y7h n GLU 3 Ca 0.00 2.88 -0.30 0.00 0.66 0.00 0.00 57.16 60.40 1y7h n GLU 3 Cb 0.00 -3.94 0.09 0.00 0.27 0.00 0.00 31.44 27.86 1y7h n GLU 3 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1y7h s GLY 4 N -0.50 1.62 0.47 8.31 0.00 -1.26 -5.07 107.32 110.89 1y7h s GLY 4 Ca -0.21 -0.28 0.09 0.00 0.00 0.00 0.00 44.72 44.31 1y7h s GLY 4 CO 0.59 0.16 0.64 0.54 0.00 0.00 0.00 173.10 175.03 1y7h s LYS 5 N -5.22 2.65 -0.34 2.90 -0.14 -1.26 -4.90 119.74 113.44 1y7h s LYS 5 Ca 0.61 -1.38 0.03 0.00 -1.36 0.00 0.00 55.97 53.87 1y7h s LYS 5 Cb -0.14 -2.72 0.10 0.00 -1.68 0.00 0.00 37.83 33.39 1y7h s LYS 5 CO 0.54 -0.47 0.07 -1.58 -0.76 0.00 0.00 175.35 173.14 1y7h s HIS 6 N -2.46 3.17 0.00 3.18 5.65 -1.26 -1.09 115.29 122.48 1y7h s HIS 6 Ca 0.57 -2.65 -0.26 0.00 0.25 0.00 0.00 55.06 52.97 1y7h s HIS 6 Cb -0.08 -2.58 -0.04 0.00 -1.18 0.00 0.00 32.58 28.69 1y7h s HIS 6 CO 0.35 -0.92 0.83 -0.06 -0.65 0.00 0.00 174.74 174.28 1y7h s PHE 7 N 1.07 3.67 -0.33 3.88 0.08 -0.85 -0.66 117.98 124.84 1y7h s PHE 7 Ca 0.11 1.50 0.03 0.00 0.12 0.00 0.00 56.93 58.69 1y7h s PHE 7 Cb -0.19 -2.93 0.10 0.00 -0.57 0.00 0.00 43.02 39.43 1y7h s PHE 7 CO -0.13 0.12 0.05 0.08 -0.10 0.00 0.00 175.22 175.25 1y7h s VAL 8 N 0.55 1.97 -0.04 -0.44 1.01 -0.33 -1.46 120.40 121.67 1y7h s VAL 8 Ca 0.43 -2.11 -0.30 0.00 0.00 0.00 0.00 61.98 60.00 1y7h s VAL 8 Cb -0.20 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 1y7h s VAL 8 CO 0.24 -0.59 1.00 -0.76 0.00 0.00 0.00 175.10 174.99 1y7h s LEU 9 N 1.06 4.32 -0.21 3.92 1.43 -0.85 -1.60 118.68 126.75 1y7h s LEU 9 Ca 0.10 1.63 0.01 0.00 -1.03 0.00 0.00 54.13 54.84 1y7h s LEU 9 Cb -0.19 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.50 1y7h s LEU 9 CO -0.11 -0.35 -0.16 -0.69 0.23 0.00 0.00 176.35 175.27 1y7h s VAL 10 N 1.43 2.19 0.90 -1.59 1.01 0.29 -3.55 120.40 121.08 1y7h s VAL 10 Ca 0.51 -1.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.26 1y7h s VAL 10 Cb -0.20 -2.04 0.13 0.00 0.00 0.00 0.00 36.38 34.27 1y7h s VAL 10 CO 0.24 0.36 1.09 -1.38 0.00 0.00 0.00 175.10 175.41 1y7h s HIS 11 N 1.25 2.33 0.77 5.22 -3.43 -1.26 -1.05 115.29 119.12 1y7h s HIS 11 Ca 0.01 1.20 -0.03 0.00 -0.80 0.00 0.00 55.06 55.44 1y7h s HIS 11 Cb -0.15 -3.18 0.15 0.00 -1.43 0.00 0.00 32.58 27.97 1y7h s HIS 11 CO -0.10 -2.41 1.06 0.20 -2.00 0.00 0.00 174.74 171.48 1y7h s GLY 12 N -3.48 1.76 0.50 -1.38 0.00 -1.17 -3.68 107.32 99.88 1y7h s GLY 12 Ca 0.63 -1.69 -0.23 0.00 0.00 0.00 0.00 44.72 43.43 1y7h s GLY 12 CO 0.57 -1.07 1.40 0.00 0.00 0.00 0.00 173.10 173.99 1y7h s ALA 13 N -3.28 3.02 0.00 3.20 0.00 -1.26 -2.57 121.76 120.87 1y7h s ALA 13 Ca 0.68 1.41 0.00 0.00 0.00 0.00 0.00 51.96 54.05 1y7h s ALA 13 Cb -0.05 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1y7h s ALA 13 CO 0.46 -1.31 0.00 0.00 0.00 0.00 0.00 175.76 174.91 1y7h s HIS 15 N -2.16 1.87 0.34 0.00 4.02 -1.06 -2.47 115.29 115.83 1y7h s HIS 15 Ca 0.00 -0.96 0.05 0.00 1.02 0.00 0.00 55.06 55.17 1y7h s HIS 15 Cb 0.00 -1.60 -0.02 0.00 -1.02 0.00 0.00 32.58 29.94 1y7h s HIS 15 CO 0.00 0.22 0.34 0.20 1.02 0.00 0.00 174.74 176.52 1y7h s GLY 16 N -3.87 2.10 0.54 -2.22 0.00 -1.26 -4.06 107.32 98.55 1y7h s GLY 16 Ca 0.06 -1.92 0.36 0.00 0.00 0.00 0.00 44.72 43.23 1y7h s GLY 16 CO 0.03 -1.33 1.81 -1.33 0.00 0.00 0.00 173.10 172.28 1y7h h GLY 17 N 2.12 0.02 1.58 0.20 0.00 -1.79 0.13 103.07 105.33 1y7h h GLY 17 Ca -0.26 -0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.11 1y7h h GLY 17 CO 0.37 -0.00 0.17 0.11 0.00 0.00 0.00 176.54 177.19 1y7h h TRP 18 N 0.01 0.00 0.00 5.60 5.08 -1.89 -2.46 115.95 122.28 1y7h h TRP 18 Ca 0.56 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.53 1y7h h TRP 18 Cb 2.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 28.40 1y7h h TRP 18 CO -0.00 0.00 0.00 -1.13 -1.28 0.00 0.00 178.44 176.03 1y7h n SER 19 N -3.82 0.45 -1.21 0.11 3.41 0.44 -1.14 113.62 111.85 1y7h n SER 19 Ca 0.01 0.68 0.09 0.00 -0.26 0.00 0.00 58.87 59.39 1y7h n SER 19 Cb 0.29 -0.75 0.29 0.00 -0.26 0.00 0.00 64.21 63.77 1y7h n SER 19 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1y7h n TRP 20 N -2.07 1.05 -0.12 7.33 7.02 -0.92 -4.62 117.44 125.10 1y7h n TRP 20 Ca -0.00 -0.59 0.27 0.00 -1.02 0.00 0.00 57.50 56.16 1y7h n TRP 20 Cb 0.07 -0.14 0.72 0.00 -2.42 0.00 0.00 31.31 29.54 1y7h n TRP 20 CO 0.00 0.00 0.00 0.10 -2.02 0.00 0.00 177.69 175.77 1y7h h TYR 21 N 3.35 0.00 0.19 -5.99 -0.00 -1.32 0.45 116.97 113.65 1y7h h TYR 21 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 58.73 58.38 1y7h h TYR 21 Cb 1.16 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.90 1y7h h TYR 21 CO 0.54 0.00 -1.74 0.87 -0.00 0.00 0.00 178.16 177.82 1y7h h LYS 22 N 0.00 0.40 -0.03 0.10 1.57 -1.84 -3.38 116.57 113.40 1y7h h LYS 22 Ca 0.38 -0.68 -0.08 0.00 -1.87 0.00 0.00 60.65 58.39 1y7h h LYS 22 Cb 1.60 0.25 0.01 0.00 0.08 0.00 0.00 32.23 34.17 1y7h h LYS 22 CO -0.00 1.32 -0.31 1.25 -0.57 0.00 0.00 179.45 181.14 1y7h h LEU 23 N 0.11 0.32 -0.99 2.94 5.85 -1.34 -3.33 115.31 118.86 1y7h h LEU 23 Ca -0.34 -0.71 0.16 0.00 0.84 0.00 0.00 57.88 57.83 1y7h h LEU 23 Cb 2.10 -0.10 -0.17 0.00 0.37 0.00 0.00 40.66 42.87 1y7h h LEU 23 CO 0.18 0.99 -0.35 1.17 -0.34 0.00 0.00 178.44 180.09 1y7h n LYS 24 N -4.45 -0.20 -0.32 1.25 4.81 0.14 -0.32 118.16 119.07 1y7h n LYS 24 Ca -0.09 1.52 -0.02 0.00 -0.87 0.00 0.00 58.31 58.85 1y7h n LYS 24 Cb 0.51 -2.27 0.10 0.00 0.02 0.00 0.00 35.03 33.40 1y7h n LYS 24 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1y7h h PRO 25 N 0.00 1.09 -0.83 1.64 0.11 -1.73 -1.78 132.00 130.49 1y7h h PRO 25 Ca 0.38 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.42 1y7h h PRO 25 Cb 0.62 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 31.45 1y7h h PRO 25 CO -0.99 0.72 0.51 -0.07 -0.21 0.00 0.00 178.00 177.96 1y7h h LEU 26 N 1.12 1.00 -0.23 2.35 4.07 -0.78 -2.13 115.31 120.71 1y7h h LEU 26 Ca 0.34 -0.06 -0.21 0.00 0.08 0.00 0.00 57.88 58.03 1y7h h LEU 26 Cb -0.04 -0.25 0.01 0.00 1.08 0.00 0.00 40.66 41.45 1y7h h LEU 26 CO -0.10 0.77 -0.69 -0.07 -1.08 0.00 0.00 178.44 177.27 1y7h h LEU 27 N 1.14 0.93 -1.63 1.67 3.38 -1.23 -2.90 115.31 116.67 1y7h h LEU 27 Ca 0.30 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1y7h h LEU 27 Cb -0.05 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.43 1y7h h LEU 27 CO -0.06 1.36 0.00 -0.33 0.09 0.00 0.00 178.44 179.50 1y7h h GLU 28 N 0.57 0.00 0.00 1.13 5.08 -0.99 0.31 114.58 120.69 1y7h h GLU 28 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1y7h h GLU 28 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1y7h h GLU 28 CO 0.14 0.00 -0.80 0.00 -1.00 0.00 0.00 179.01 177.35 1y7h h ALA 29 N 2.06 0.56 -0.21 3.43 0.00 -1.18 -3.19 119.26 120.72 1y7h h ALA 29 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1y7h h ALA 29 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1y7h h ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1y7h n ALA 30 N -2.05 2.52 -1.00 0.00 0.00 0.07 -4.85 120.51 115.22 1y7h n ALA 30 Ca 0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1y7h n ALA 30 Cb 0.51 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1y7h n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y7h n GLY 31 N 0.76 0.49 3.95 0.00 0.00 -1.20 -4.99 105.19 104.20 1y7h n GLY 31 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1y7h n GLY 31 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1y7h s HIS 32 N -1.99 3.24 0.01 1.61 3.76 -1.05 -4.39 115.29 116.48 1y7h s HIS 32 Ca 0.00 0.23 -0.01 0.00 -0.15 0.00 0.00 55.06 55.13 1y7h s HIS 32 Cb 0.00 -2.27 -0.04 0.00 1.11 0.00 0.00 32.58 31.38 1y7h s HIS 32 CO 0.00 -0.31 0.16 0.21 -0.85 0.00 0.00 174.74 173.95 1y7h s LYS 33 N -4.52 3.32 -0.03 1.40 2.20 -0.25 -4.07 119.74 117.79 1y7h s LYS 33 Ca 0.48 -0.40 0.02 0.00 -0.36 0.00 0.00 55.97 55.70 1y7h s LYS 33 Cb -0.10 -3.01 0.01 0.00 -1.51 0.00 0.00 37.83 33.22 1y7h s LYS 33 CO 0.38 0.65 -0.09 0.08 -0.36 0.00 0.00 175.35 176.01 1y7h s VAL 34 N -1.34 0.79 -0.28 4.02 1.01 -1.26 -2.01 120.40 121.32 1y7h s VAL 34 Ca 0.28 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.93 1y7h s VAL 34 Cb -0.13 -0.71 0.08 0.00 0.00 0.00 0.00 36.38 35.62 1y7h s VAL 34 CO 0.20 0.25 -0.01 -0.89 0.00 0.00 0.00 175.10 174.65 1y7h s THR 35 N 0.31 1.79 -0.96 3.92 2.01 -0.53 -5.00 115.64 117.17 1y7h s THR 35 Ca -0.05 -1.69 -0.15 0.00 0.31 0.00 0.00 61.69 60.11 1y7h s THR 35 Cb -0.10 -2.15 0.19 0.00 0.01 0.00 0.00 72.50 70.45 1y7h s THR 35 CO 0.01 -0.34 1.04 0.00 -0.69 0.00 0.00 174.62 174.64 1y7h s ALA 36 N 1.22 3.93 0.50 7.40 0.00 -1.26 -2.01 121.76 131.52 1y7h s ALA 36 Ca 0.01 -3.22 -0.18 0.00 0.00 0.00 0.00 51.96 48.58 1y7h s ALA 36 Cb -0.19 -3.80 -0.08 0.00 0.00 0.00 0.00 23.12 19.05 1y7h s ALA 36 CO -0.09 -2.58 0.99 -0.48 0.00 0.00 0.00 175.76 173.59 1y7h s LEU 37 N 1.02 3.71 -0.38 0.00 2.34 -1.23 -4.53 118.68 119.61 1y7h s LEU 37 Ca 0.29 1.67 -0.12 0.00 0.06 0.00 0.00 54.13 56.03 1y7h s LEU 37 Cb -0.07 -4.53 0.02 0.00 -0.56 0.00 0.00 46.19 41.06 1y7h s LEU 37 CO -0.08 -0.62 0.22 -1.81 -1.06 0.00 0.00 176.35 173.00 1y7h s ASP 38 N -2.69 5.81 0.93 1.48 1.11 -1.26 -3.33 116.67 118.71 1y7h s ASP 38 Ca 0.61 -0.95 -0.12 0.00 0.18 0.00 0.00 52.55 52.28 1y7h s ASP 38 Cb -0.11 -2.05 0.15 0.00 1.07 0.00 0.00 42.92 41.97 1y7h s ASP 38 CO 0.26 -0.39 1.09 -0.76 1.18 0.00 0.00 175.17 176.55 1y7h s LEU 39 N 1.58 2.07 0.65 1.23 1.43 -1.26 -4.86 118.68 119.53 1y7h s LEU 39 Ca 0.03 1.43 -0.17 0.00 -1.03 0.00 0.00 54.13 54.39 1y7h s LEU 39 Cb -0.19 -3.78 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 1y7h s LEU 39 CO 0.07 -2.81 0.68 0.00 0.23 0.00 0.00 176.35 174.52 1y7h n ALA 40 N -3.99 -0.88 -1.31 4.21 0.00 -1.17 -1.97 120.51 115.40 1y7h n ALA 40 Ca 0.07 -0.12 -0.09 0.00 0.00 0.00 0.00 53.44 53.29 1y7h n ALA 40 Cb 0.56 -1.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.03 1y7h n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y7h n ALA 41 N -2.08 -0.16 -2.44 0.00 0.00 -1.26 -4.91 120.51 109.66 1y7h n ALA 41 Ca 0.12 0.14 -0.25 0.00 0.00 0.00 0.00 53.44 53.45 1y7h n ALA 41 Cb 0.49 -1.04 -0.12 0.00 0.00 0.00 0.00 19.45 18.78 1y7h n ALA 41 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1y7h s SER 42 N -1.77 3.12 1.36 0.00 0.01 -0.83 -4.77 113.70 110.81 1y7h s SER 42 Ca 0.00 -0.84 0.00 0.00 1.31 0.00 0.00 55.95 56.42 1y7h s SER 42 Cb 0.00 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.02 1y7h s SER 42 CO 0.00 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.34 1y7h n GLY 43 N 0.41 3.35 0.96 3.44 0.00 -1.26 -1.00 105.19 111.10 1y7h n GLY 43 Ca -0.14 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 45.94 1y7h n GLY 43 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1y7h n THR 44 N 0.00 0.82 -1.93 2.61 -2.24 -1.26 -4.94 114.28 107.35 1y7h n THR 44 Ca 0.00 -0.68 -0.42 0.00 -2.27 0.00 0.00 64.05 60.68 1y7h n THR 44 Cb 0.00 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.41 1y7h n THR 44 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1y7h s ASP 45 N -0.92 6.60 0.00 3.42 2.15 -0.17 -4.87 116.67 122.89 1y7h s ASP 45 Ca 0.32 2.49 0.09 0.00 0.43 0.00 0.00 52.55 55.88 1y7h s ASP 45 Cb 0.18 -2.56 0.47 0.00 -0.30 0.00 0.00 42.92 40.71 1y7h s ASP 45 CO 0.20 -0.89 1.14 0.18 -0.17 0.00 0.00 175.17 175.63 1y7h n LEU 46 N 5.57 0.00 -4.86 -1.34 4.77 -1.26 -4.51 117.00 115.36 1y7h n LEU 46 Ca 0.16 0.24 -0.31 0.00 -0.03 0.00 0.00 56.01 56.07 1y7h n LEU 46 Cb 0.40 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1y7h n LEU 46 CO 0.63 -0.17 0.67 -0.13 -1.33 0.00 0.00 177.39 177.06 1y7h s ARG 47 N -2.48 3.73 0.10 3.23 0.52 -1.26 -5.01 118.95 117.78 1y7h s ARG 47 Ca 0.09 0.77 0.04 0.00 -0.52 0.00 0.00 55.73 56.11 1y7h s ARG 47 Cb 0.06 -2.14 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 1y7h s ARG 47 CO 0.13 -0.41 0.08 0.15 0.02 0.00 0.00 175.30 175.27 1y7h s LYS 48 N -4.69 2.84 0.47 3.54 1.02 -1.26 -4.01 119.74 117.64 1y7h s LYS 48 Ca 0.56 -0.76 0.12 0.00 0.02 0.00 0.00 55.97 55.90 1y7h s LYS 48 Cb -0.11 -2.68 1.07 0.00 -0.52 0.00 0.00 37.83 35.59 1y7h s LYS 48 CO 0.44 0.54 2.10 0.97 -0.92 0.00 0.00 175.35 178.49 1y7h h ILE 49 N 2.48 1.05 0.00 2.17 6.09 -1.87 -0.58 117.51 126.86 1y7h h ILE 49 Ca -0.47 -0.11 -0.01 0.00 -1.37 0.00 0.00 64.86 62.90 1y7h h ILE 49 Cb 1.17 0.78 -0.00 0.00 0.47 0.00 0.00 36.82 39.24 1y7h h ILE 49 CO 0.64 0.05 -0.04 -0.33 -3.07 0.00 0.00 178.15 175.41 1y7h h GLU 50 N 0.26 0.00 0.00 2.19 3.07 -1.97 -2.49 114.58 115.64 1y7h h GLU 50 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1y7h h GLU 50 Cb -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1y7h h GLU 50 CO -0.01 0.04 0.00 0.93 -1.40 0.00 0.00 179.01 178.56 1y7h h GLU 51 N 0.00 0.00 -5.74 2.33 5.08 -1.50 -3.44 114.58 111.30 1y7h h GLU 51 Ca -0.00 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.73 1y7h h GLU 51 Cb 0.37 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 1y7h h GLU 51 CO 0.00 0.00 -0.33 -0.51 -1.00 0.00 0.00 179.01 177.17 1y7h s LEU 52 N -6.19 4.38 0.00 1.33 1.43 -0.94 -4.98 118.68 113.72 1y7h s LEU 52 Ca 0.06 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 1y7h s LEU 52 Cb 0.06 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.93 1y7h s LEU 52 CO 0.64 0.30 0.00 0.54 0.23 0.00 0.00 176.35 178.06 1y7h n ARG 53 N 2.34 1.32 -4.34 1.70 1.74 -1.26 -5.01 116.66 113.15 1y7h n ARG 53 Ca -0.16 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.75 1y7h n ARG 53 Cb 0.53 -0.88 -0.10 0.00 -1.02 0.00 0.00 32.46 30.98 1y7h n ARG 53 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1y7h s THR 54 N -1.62 0.76 0.35 0.55 -4.23 -1.26 -4.77 115.64 105.42 1y7h s THR 54 Ca 0.00 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.60 1y7h s THR 54 Cb 0.00 -2.61 0.10 0.00 1.34 0.00 0.00 72.50 71.33 1y7h s THR 54 CO 0.00 -0.07 1.82 0.25 -0.54 0.00 0.00 174.62 176.09 1y7h h LEU 55 N 2.35 0.17 0.19 4.79 5.85 -1.94 -2.78 115.31 123.93 1y7h h LEU 55 Ca -0.39 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 1y7h h LEU 55 Cb 1.24 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1y7h h LEU 55 CO 0.63 0.46 -0.09 0.22 -0.34 0.00 0.00 178.44 179.32 1y7h h TYR 56 N 0.15 -0.23 -0.87 1.25 5.03 -1.96 0.63 116.97 120.96 1y7h h TYR 56 Ca 0.02 -0.01 0.24 0.00 2.58 0.00 0.00 58.73 61.57 1y7h h TYR 56 Cb 0.59 0.08 -0.04 0.00 1.55 0.00 0.00 36.73 38.90 1y7h h TYR 56 CO 0.01 -0.03 0.61 -0.44 -1.32 0.00 0.00 178.16 176.99 1y7h h ASP 57 N -0.40 0.11 0.86 -2.11 3.45 -1.90 0.56 116.42 116.99 1y7h h ASP 57 Ca -0.03 0.01 -0.22 0.00 0.43 0.00 0.00 57.03 57.23 1y7h h ASP 57 Cb 0.31 -0.01 -0.03 0.00 -0.56 0.00 0.00 39.33 39.04 1y7h h ASP 57 CO 0.04 0.04 -1.23 0.22 -1.57 0.00 0.00 179.24 176.75 1y7h h TYR 58 N 0.11 0.00 -0.02 4.55 3.20 -1.21 -3.33 116.97 120.27 1y7h h TYR 58 Ca 0.43 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.30 1y7h h TYR 58 Cb 1.52 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.79 1y7h h TYR 58 CO -0.00 0.86 -0.01 2.41 -1.64 0.00 0.00 178.16 179.79 1y7h n THR 59 N -3.16 0.00 -0.31 1.81 -1.04 0.17 -3.03 114.28 108.72 1y7h n THR 59 Ca -0.07 -0.37 -0.12 0.00 -2.04 0.00 0.00 64.05 61.46 1y7h n THR 59 Cb 0.93 0.97 -0.10 0.00 -1.82 0.00 0.00 70.33 70.31 1y7h n THR 59 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1y7h h LEU 60 N 3.44 -2.03 -1.37 -4.42 5.85 -0.82 0.23 115.31 116.18 1y7h h LEU 60 Ca 0.00 0.29 0.30 0.00 0.84 0.00 0.00 57.88 59.31 1y7h h LEU 60 Cb 0.73 0.87 -0.10 0.00 0.37 0.00 0.00 40.66 42.54 1y7h h LEU 60 CO 0.00 -0.30 0.70 -0.65 -0.34 0.00 0.00 178.44 177.85 1y7h h PRO 61 N -0.16 0.32 -1.20 5.25 0.11 -1.88 0.16 132.00 134.61 1y7h h PRO 61 Ca 0.12 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1y7h h PRO 61 Cb 0.48 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1y7h h PRO 61 CO -0.80 0.21 0.00 -0.11 -0.21 0.00 0.00 178.00 177.10 1y7h n LEU 62 N -4.64 2.19 0.00 2.35 7.94 0.79 -2.18 117.00 123.46 1y7h n LEU 62 Ca 0.27 -1.10 0.00 0.00 -1.11 0.00 0.00 56.01 54.08 1y7h n LEU 62 Cb 0.98 -0.38 0.00 0.00 0.53 0.00 0.00 43.42 44.55 1y7h n LEU 62 CO 0.25 0.37 0.00 -0.62 -1.11 0.00 0.00 177.39 176.28 1y7h n GLU 64 N 0.58 0.00 0.00 1.96 1.02 0.57 -4.70 120.64 120.07 1y7h n GLU 64 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1y7h n GLU 64 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.79 1y7h n GLU 64 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1y7h n LEU 65 N 0.00 0.38 0.00 -4.62 7.94 -0.93 -2.80 117.00 116.97 1y7h n LEU 65 Ca 0.00 -0.19 0.00 0.00 -1.11 0.00 0.00 56.01 54.71 1y7h n LEU 65 Cb 0.00 -0.19 0.00 0.00 0.53 0.00 0.00 43.42 43.76 1y7h n LEU 65 CO 0.00 0.09 0.00 1.21 -1.11 0.00 0.00 177.39 177.58 1y7h n GLU 67 N 0.26 0.00 0.05 1.96 4.07 -1.26 -3.06 120.64 122.66 1y7h n GLU 67 Ca 0.00 0.00 0.06 0.00 -0.06 0.00 0.00 57.16 57.16 1y7h n GLU 67 Cb 0.09 0.00 0.28 0.00 -0.06 0.00 0.00 31.44 31.75 1y7h n GLU 67 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1y7h n SER 68 N 0.00 0.20 -4.72 4.31 7.64 -1.12 -4.70 113.62 115.24 1y7h n SER 68 Ca 0.00 0.57 -0.42 0.00 1.01 0.00 0.00 58.87 60.03 1y7h n SER 68 Cb 0.00 -0.61 -0.03 0.00 -1.01 0.00 0.00 64.21 62.56 1y7h n SER 68 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1y7h s LEU 69 N -3.49 4.38 0.00 -3.43 1.43 -1.17 -5.03 118.68 111.36 1y7h s LEU 69 Ca 0.03 2.03 -0.16 0.00 -1.03 0.00 0.00 54.13 54.99 1y7h s LEU 69 Cb 0.06 -3.58 0.24 0.00 0.03 0.00 0.00 46.19 42.93 1y7h s LEU 69 CO 0.18 -0.45 0.96 -1.20 0.23 0.00 0.00 176.35 176.07 1y7h n SER 70 N 3.77 -1.42 -0.01 2.29 7.64 -1.26 -4.94 113.62 119.70 1y7h n SER 70 Ca 0.08 -1.14 -0.13 0.00 1.01 0.00 0.00 58.87 58.69 1y7h n SER 70 Cb 0.46 -0.84 -0.10 0.00 -1.01 0.00 0.00 64.21 62.72 1y7h n SER 70 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y7h h ALA 71 N -2.42 -0.04 0.00 -0.43 0.00 -1.98 -3.07 119.26 111.31 1y7h h ALA 71 Ca -0.35 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1y7h h ALA 71 Cb 1.04 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1y7h h ALA 71 CO 0.23 -0.22 0.00 -0.40 0.00 0.00 0.00 179.25 178.86 1y7h n ASP 72 N -4.83 0.81 -3.92 0.00 3.85 -1.26 -4.44 116.55 106.76 1y7h n ASP 72 Ca -0.09 -1.98 -0.29 0.00 -0.71 0.00 0.00 54.79 51.72 1y7h n ASP 72 Cb 0.29 -0.40 -0.13 0.00 -1.35 0.00 0.00 41.12 39.53 1y7h n ASP 72 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1y7h s GLU 73 N -1.19 2.12 0.64 0.11 2.12 -1.16 -5.09 118.70 116.26 1y7h s GLU 73 Ca 0.00 -2.86 -0.04 0.00 0.36 0.00 0.00 54.97 52.42 1y7h s GLU 73 Cb 0.00 -3.30 0.05 0.00 0.26 0.00 0.00 34.13 31.13 1y7h s GLU 73 CO 0.00 -1.18 0.93 0.15 -0.54 0.00 0.00 175.26 174.62 1y7h s LYS 74 N -0.69 2.39 0.08 4.30 3.01 -1.26 -4.43 119.74 123.14 1y7h s LYS 74 Ca 0.20 -0.36 -0.13 0.00 -1.01 0.00 0.00 55.97 54.67 1y7h s LYS 74 Cb -0.18 -2.27 0.02 0.00 -1.01 0.00 0.00 37.83 34.38 1y7h s LYS 74 CO -0.06 -1.02 0.29 0.14 0.51 0.00 0.00 175.35 175.21 1y7h s VAL 75 N -3.07 0.10 -0.31 3.17 -7.23 -0.84 -4.55 120.40 107.66 1y7h s VAL 75 Ca 0.58 -0.82 -0.08 0.00 -1.81 0.00 0.00 61.98 59.85 1y7h s VAL 75 Cb -0.11 -1.12 0.00 0.00 0.56 0.00 0.00 36.38 35.71 1y7h s VAL 75 CO 0.43 -0.45 0.12 -0.63 -0.31 0.00 0.00 175.10 174.26 1y7h s ILE 76 N -3.28 4.33 0.04 -0.62 1.01 0.17 -1.92 121.20 120.93 1y7h s ILE 76 Ca 0.00 -0.55 -0.25 0.00 0.00 0.00 0.00 60.65 59.85 1y7h s ILE 76 Cb 0.02 -3.23 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 1y7h s ILE 76 CO -0.08 0.06 0.78 -0.76 0.00 0.00 0.00 174.94 174.95 1y7h s LEU 77 N 1.56 4.44 -0.28 2.97 1.43 -0.92 -1.19 118.68 126.69 1y7h s LEU 77 Ca 0.04 1.46 0.01 0.00 -1.03 0.00 0.00 54.13 54.60 1y7h s LEU 77 Cb -0.17 -3.26 0.08 0.00 0.03 0.00 0.00 46.19 42.87 1y7h s LEU 77 CO 0.05 -0.02 0.02 -0.69 0.23 0.00 0.00 176.35 175.93 1y7h s VAL 78 N 0.08 1.50 -0.04 -1.59 1.01 -0.62 0.11 120.40 120.85 1y7h s VAL 78 Ca 0.40 -1.51 -0.01 0.00 0.00 0.00 0.00 61.98 60.85 1y7h s VAL 78 Cb -0.20 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1y7h s VAL 78 CO 0.23 -0.38 0.05 -0.83 0.00 0.00 0.00 175.10 174.17 1y7h s GLY 79 N 1.35 1.95 -0.02 4.51 0.00 -0.14 0.11 107.32 115.08 1y7h s GLY 79 Ca 0.03 -0.84 0.07 0.00 0.00 0.00 0.00 44.72 43.97 1y7h s GLY 79 CO -0.12 -0.67 -0.23 -1.58 0.00 0.00 0.00 173.10 170.50 1y7h s HIS 80 N -1.06 2.10 0.00 1.90 2.46 -0.22 0.06 115.29 120.53 1y7h s HIS 80 Ca 0.18 -0.40 0.00 0.00 0.47 0.00 0.00 55.06 55.31 1y7h s HIS 80 Cb -0.12 -1.35 0.00 0.00 -0.13 0.00 0.00 32.58 30.98 1y7h s HIS 80 CO 0.09 -0.04 0.00 0.45 -2.47 0.00 0.00 174.74 172.76 1y7h n SER 81 N 2.53 0.00 0.05 9.88 2.88 -1.12 0.13 113.62 127.96 1y7h n SER 81 Ca -0.16 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.42 1y7h n SER 81 Cb 0.52 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.18 1y7h n SER 81 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1y7h n LEU 82 N 0.00 0.17 0.19 2.46 7.94 -1.26 -1.17 117.00 125.33 1y7h n LEU 82 Ca 0.00 0.57 0.14 0.00 -1.11 0.00 0.00 56.01 55.61 1y7h n LEU 82 Cb 0.00 -0.58 0.69 0.00 0.53 0.00 0.00 43.42 44.05 1y7h n LEU 82 CO 0.00 -0.59 0.91 1.23 -1.11 0.00 0.00 177.39 177.83 1y7h h GLY 83 N 0.36 0.00 -1.52 -3.96 0.00 0.99 -3.21 103.07 95.74 1y7h h GLY 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1y7h h GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1y7h n GLY 84 N -0.98 0.45 1.81 4.60 0.00 -0.32 -2.02 105.19 108.73 1y7h n GLY 84 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1y7h n GLY 84 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1y7h n ASN 86 N 0.63 0.00 -0.15 1.61 5.03 -1.21 -2.75 115.26 118.42 1y7h n ASN 86 Ca 0.00 0.00 0.10 0.00 0.87 0.00 0.00 54.58 55.55 1y7h n ASN 86 Cb 0.10 0.00 0.43 0.00 -1.02 0.00 0.00 39.78 39.29 1y7h n ASN 86 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1y7h h LEU 87 N 0.00 0.51 -0.48 3.41 4.07 -1.73 -2.16 115.31 118.94 1y7h h LEU 87 Ca 0.00 0.01 0.09 0.00 0.08 0.00 0.00 57.88 58.06 1y7h h LEU 87 Cb 0.00 -0.10 -0.08 0.00 1.08 0.00 0.00 40.66 41.57 1y7h h LEU 87 CO 0.00 0.31 0.01 1.23 -1.08 0.00 0.00 178.44 178.91 1y7h h GLY 88 N 0.57 0.50 1.40 0.83 0.00 -1.79 -0.85 103.07 103.73 1y7h h GLY 88 Ca 0.32 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.68 1y7h h GLY 88 CO -0.11 -0.12 0.27 1.41 0.00 0.00 0.00 176.54 177.99 1y7h h LEU 89 N 0.13 0.71 -0.86 3.11 4.07 -1.73 -0.21 115.31 120.52 1y7h h LEU 89 Ca 0.24 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.13 1y7h h LEU 89 Cb 0.35 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.91 1y7h h LEU 89 CO -0.39 0.61 0.00 0.00 -1.08 0.00 0.00 178.44 177.58 1y7h n ALA 90 N -2.45 1.49 0.00 1.53 0.00 -0.32 -1.38 120.51 119.37 1y7h n ALA 90 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1y7h n ALA 90 Cb 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1y7h n ALA 90 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1y7h n GLU 92 N 0.23 0.00 -0.09 0.00 4.07 -0.09 0.89 120.64 125.66 1y7h n GLU 92 Ca 0.00 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 56.95 1y7h n GLU 92 Cb 0.06 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.31 1y7h n GLU 92 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1y7h n LYS 93 N 0.00 0.68 -2.89 5.31 4.81 -0.48 -4.62 118.16 120.96 1y7h n LYS 93 Ca 0.00 0.13 -0.23 0.00 -0.87 0.00 0.00 58.31 57.34 1y7h n LYS 93 Cb 0.00 -1.58 -0.02 0.00 0.02 0.00 0.00 35.03 33.45 1y7h n LYS 93 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1y7h n TYR 94 N -3.11 2.66 -0.21 5.64 4.01 0.26 -4.93 117.16 121.48 1y7h n TYR 94 Ca -0.37 -3.67 -0.05 0.00 -0.16 0.00 0.00 57.90 53.65 1y7h n TYR 94 Cb 1.06 -0.39 0.11 0.00 -0.31 0.00 0.00 39.34 39.82 1y7h n TYR 94 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1y7h h PRO 95 N 2.92 1.02 0.00 -0.72 0.13 -1.84 -2.65 132.00 130.86 1y7h h PRO 95 Ca 0.13 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1y7h h PRO 95 Cb 0.76 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.75 1y7h h PRO 95 CO 0.71 0.89 0.00 0.00 -0.23 0.00 0.00 178.00 179.37 1y7h n GLN 96 N -4.26 0.79 -0.36 0.86 0.00 -1.26 -2.82 117.38 110.34 1y7h n GLN 96 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 57.00 57.13 1y7h n GLN 96 Cb 0.23 -1.34 0.22 0.00 0.00 0.00 0.00 30.24 29.35 1y7h n GLN 96 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1y7h n LYS 97 N -0.84 2.82 -3.77 2.61 5.02 -1.00 -4.92 118.16 118.08 1y7h n LYS 97 Ca 0.13 -2.63 -0.26 0.00 -2.02 0.00 0.00 58.31 53.53 1y7h n LYS 97 Cb 0.06 -1.68 -0.17 0.00 -0.02 0.00 0.00 35.03 33.22 1y7h n LYS 97 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1y7h s ILE 98 N -2.40 0.55 0.20 -0.18 1.01 -1.13 -1.99 121.20 117.26 1y7h s ILE 98 Ca 0.37 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.62 1y7h s ILE 98 Cb 0.28 -0.86 0.13 0.00 0.01 0.00 0.00 42.46 42.02 1y7h s ILE 98 CO 0.10 0.04 1.87 1.88 0.00 0.00 0.00 174.94 178.83 1y7h h TYR 99 N 8.26 0.86 -2.00 3.97 0.99 -1.70 -3.46 116.97 123.90 1y7h h TYR 99 Ca -0.19 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.58 1y7h h TYR 99 Cb 1.12 -0.29 -0.19 0.00 1.00 0.00 0.00 36.73 38.37 1y7h h TYR 99 CO 0.39 0.54 0.36 0.00 -0.00 0.00 0.00 178.16 179.45 1y7h s ALA 100 N -6.14 -1.82 -0.17 3.88 0.00 -1.26 -4.48 121.76 111.78 1y7h s ALA 100 Ca -0.13 1.27 -0.04 0.00 0.00 0.00 0.00 51.96 53.07 1y7h s ALA 100 Cb 0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 1y7h s ALA 100 CO 0.77 -0.44 -0.04 0.00 0.00 0.00 0.00 175.76 176.05 1y7h s ALA 101 N -1.75 2.94 -0.34 0.00 0.00 0.39 -2.17 121.76 120.83 1y7h s ALA 101 Ca -0.04 -0.90 -0.06 0.00 0.00 0.00 0.00 51.96 50.96 1y7h s ALA 101 Cb -0.00 -1.58 0.04 0.00 0.00 0.00 0.00 23.12 21.58 1y7h s ALA 101 CO 0.02 0.07 0.10 0.08 0.00 0.00 0.00 175.76 176.03 1y7h s VAL 102 N 0.62 3.72 -0.56 0.00 1.01 0.31 -0.68 120.40 124.82 1y7h s VAL 102 Ca -0.03 -1.19 -0.22 0.00 0.00 0.00 0.00 61.98 60.54 1y7h s VAL 102 Cb -0.14 -3.13 0.06 0.00 0.00 0.00 0.00 36.38 33.17 1y7h s VAL 102 CO 0.02 -0.20 0.82 -0.36 0.00 0.00 0.00 175.10 175.39 1y7h s PHE 103 N 1.38 2.87 -0.73 5.22 0.40 0.34 -0.97 117.98 126.50 1y7h s PHE 103 Ca -0.02 -0.35 -0.21 0.00 -0.60 0.00 0.00 56.93 55.75 1y7h s PHE 103 Cb -0.20 -3.93 0.09 0.00 0.51 0.00 0.00 43.02 39.49 1y7h s PHE 103 CO 0.02 -1.30 1.00 -1.17 0.70 0.00 0.00 175.22 174.47 1y7h s LEU 104 N 3.45 4.62 -1.71 -0.37 2.96 0.11 -1.26 118.68 126.47 1y7h s LEU 104 Ca 0.22 -1.31 -0.17 0.00 -0.22 0.00 0.00 54.13 52.66 1y7h s LEU 104 Cb -0.16 -2.41 0.15 0.00 0.50 0.00 0.00 46.19 44.27 1y7h s LEU 104 CO 0.14 -1.32 0.64 0.00 -1.32 0.00 0.00 176.35 174.49 1y7h n ALA 105 N 7.33 -1.38 -2.13 5.97 0.00 -0.65 -2.79 120.51 126.86 1y7h n ALA 105 Ca 0.04 -0.12 -0.21 0.00 0.00 0.00 0.00 53.44 53.15 1y7h n ALA 105 Cb 0.46 -2.81 0.03 0.00 0.00 0.00 0.00 19.45 17.13 1y7h n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y7h s ALA 106 N -3.44 4.53 0.79 0.00 0.00 -1.26 -3.22 121.76 119.16 1y7h s ALA 106 Ca 0.63 -1.84 -0.04 0.00 0.00 0.00 0.00 51.96 50.72 1y7h s ALA 106 Cb -0.36 -1.27 0.15 0.00 0.00 0.00 0.00 23.12 21.64 1y7h s ALA 106 CO 0.96 -0.58 1.01 1.19 0.00 0.00 0.00 175.76 178.34 1y7h n PHE 107 N -1.98 -3.21 -3.98 0.00 3.01 -0.58 -4.85 117.46 105.88 1y7h n PHE 107 Ca 0.09 -1.53 -0.13 0.00 1.01 0.00 0.00 57.45 56.89 1y7h n PHE 107 Cb 0.62 -0.75 -0.02 0.00 -0.01 0.00 0.00 39.48 39.32 1y7h n PHE 107 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1y7h n PRO 109 N -2.95 0.75 -4.46 -1.08 -0.04 -1.26 -4.14 135.00 121.81 1y7h n PRO 109 Ca 0.16 -2.57 -0.26 0.00 -0.04 0.00 0.00 63.50 60.79 1y7h n PRO 109 Cb 0.55 2.59 -0.07 0.00 -0.04 0.00 0.00 33.50 36.53 1y7h n PRO 109 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1y7h n ASP 110 N -1.62 1.11 -0.00 3.54 5.75 -1.26 -4.96 116.55 119.11 1y7h n ASP 110 Ca -0.01 -3.24 0.06 0.00 -0.01 0.00 0.00 54.79 51.59 1y7h n ASP 110 Cb 0.56 1.11 -0.08 0.00 -1.03 0.00 0.00 41.12 41.68 1y7h n ASP 110 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1y7h n SER 111 N -1.52 0.96 0.03 -1.12 3.41 -1.26 -4.68 113.62 109.45 1y7h n SER 111 Ca -0.05 -0.59 -0.02 0.00 -0.26 0.00 0.00 58.87 57.95 1y7h n SER 111 Cb 0.63 1.17 -0.01 0.00 -0.26 0.00 0.00 64.21 65.74 1y7h n SER 111 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1y7h h VAL 112 N 0.00 0.00 -3.58 -3.33 2.07 -1.97 -3.44 116.25 106.01 1y7h h VAL 112 Ca 0.00 -0.26 -0.38 0.00 0.82 0.00 0.00 66.70 66.88 1y7h h VAL 112 Cb 0.40 0.00 0.16 0.00 -1.52 0.00 0.00 31.29 30.33 1y7h h VAL 112 CO 0.00 0.00 0.33 1.41 0.02 0.00 0.00 177.57 179.33 1y7h n HIS 113 N -3.00 -3.97 -2.51 1.57 8.25 -1.26 -5.03 115.22 109.27 1y7h n HIS 113 Ca -0.01 -1.03 -0.35 0.00 -0.26 0.00 0.00 57.72 56.07 1y7h n HIS 113 Cb 0.04 -0.94 -0.03 0.00 1.12 0.00 0.00 29.99 30.18 1y7h n HIS 113 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1y7h s ASN 114 N -5.17 6.50 0.61 0.41 -0.87 -1.26 -4.86 114.94 110.30 1y7h s ASN 114 Ca 0.67 2.02 0.26 0.00 -1.57 0.00 0.00 52.86 54.24 1y7h s ASN 114 Cb -0.02 -2.58 1.13 0.00 -0.02 0.00 0.00 41.25 39.76 1y7h s ASN 114 CO 0.48 -0.67 1.56 0.28 -2.57 0.00 0.00 177.10 176.18 1y7h h SER 115 N 2.03 0.00 0.03 -1.22 0.02 -1.59 0.45 113.55 113.27 1y7h h SER 115 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1y7h h SER 115 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1y7h h SER 115 CO 0.61 0.00 -0.03 -1.54 -1.14 0.00 0.00 176.83 174.72 1y7h n SER 116 N -3.32 1.19 0.00 3.07 3.41 -1.06 -4.52 113.62 112.38 1y7h n SER 116 Ca 0.13 -1.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.43 1y7h n SER 116 Cb 1.05 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 65.01 1y7h n SER 116 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1y7h n PHE 117 N -0.14 0.00 -0.26 7.33 7.35 0.16 -1.04 117.46 130.87 1y7h n PHE 117 Ca 0.19 0.00 0.19 0.00 -0.76 0.00 0.00 57.45 57.07 1y7h n PHE 117 Cb 0.32 -0.49 0.51 0.00 0.35 0.00 0.00 39.48 40.16 1y7h n PHE 117 CO 0.00 0.00 0.00 -0.39 -0.76 0.00 0.00 176.76 175.61 1y7h h VAL 118 N 0.00 0.66 -0.07 -2.13 -1.51 -1.82 -0.18 116.25 111.20 1y7h h VAL 118 Ca 0.00 -0.14 -0.04 0.00 -1.23 0.00 0.00 66.70 65.29 1y7h h VAL 118 Cb 0.00 0.21 -0.00 0.00 -2.13 0.00 0.00 31.29 29.37 1y7h h VAL 118 CO 0.00 0.08 -0.11 -0.07 -1.23 0.00 0.00 177.57 176.24 1y7h h LEU 119 N 0.42 0.22 -0.44 4.19 3.38 -1.68 -1.45 115.31 119.94 1y7h h LEU 119 Ca 0.49 -0.53 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1y7h h LEU 119 Cb 1.20 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.84 1y7h h LEU 119 CO -0.19 0.70 0.18 -0.33 0.09 0.00 0.00 178.44 178.89 1y7h h GLU 120 N -0.26 0.36 -0.51 1.13 5.08 0.02 0.75 114.58 121.15 1y7h h GLU 120 Ca 0.01 -0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.41 1y7h h GLU 120 Cb 0.65 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1y7h h GLU 120 CO 0.02 0.24 0.34 1.96 -1.00 0.00 0.00 179.01 180.57 1y7h h GLN 121 N 0.37 0.41 -0.31 2.33 1.08 -1.07 0.61 115.11 118.52 1y7h h GLN 121 Ca 0.20 -0.02 -0.17 0.00 -1.45 0.00 0.00 58.65 57.20 1y7h h GLN 121 Cb 0.16 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1y7h h GLN 121 CO -0.18 0.27 -0.48 -0.92 -0.95 0.00 0.00 178.83 176.57 1y7h h TYR 122 N 0.42 1.06 -0.03 2.96 3.20 0.21 -1.40 116.97 123.40 1y7h h TYR 122 Ca 0.22 -0.35 -0.16 0.00 3.14 0.00 0.00 58.73 61.58 1y7h h TYR 122 Cb 0.34 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 1y7h h TYR 122 CO -0.00 1.17 -0.72 -0.91 -1.64 0.00 0.00 178.16 176.06 1y7h h ASN 123 N 0.68 0.19 0.84 -2.11 2.35 0.09 -2.38 115.58 115.24 1y7h h ASN 123 Ca 0.03 -0.13 -0.24 0.00 -0.55 0.00 0.00 56.30 55.42 1y7h h ASN 123 Cb 1.08 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 39.37 1y7h h ASN 123 CO 0.11 0.84 -1.14 -0.33 -1.65 0.00 0.00 177.43 175.26 1y7h h GLU 124 N 0.10 0.08 -0.00 0.81 5.08 -0.93 -3.29 114.58 116.43 1y7h h GLU 124 Ca -0.02 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1y7h h GLU 124 Cb 1.28 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1y7h h GLU 124 CO 0.11 1.03 -0.43 0.54 -1.00 0.00 0.00 179.01 179.25 1y7h n ARG 125 N -3.38 0.44 -4.38 2.33 1.74 -0.53 -4.84 116.66 108.05 1y7h n ARG 125 Ca -0.04 -0.28 -0.33 0.00 -0.77 0.00 0.00 57.85 56.43 1y7h n ARG 125 Cb 0.97 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.77 1y7h n ARG 125 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1y7h s THR 126 N -2.75 2.64 0.24 0.55 2.01 -0.90 -5.06 115.64 112.37 1y7h s THR 126 Ca 0.17 -0.77 -0.31 0.00 0.31 0.00 0.00 61.69 61.09 1y7h s THR 126 Cb 0.18 -2.13 -0.11 0.00 0.01 0.00 0.00 72.50 70.45 1y7h s THR 126 CO 0.63 0.51 1.63 -2.16 -0.69 0.00 0.00 174.62 174.53 1y7h s PRO 127 N 0.98 4.15 0.60 4.92 0.04 -1.26 -4.78 135.00 139.64 1y7h s PRO 127 Ca -0.02 2.54 0.29 0.00 0.04 0.00 0.00 61.00 63.84 1y7h s PRO 127 Cb -0.15 -3.07 1.38 0.00 0.04 0.00 0.00 34.50 32.70 1y7h s PRO 127 CO -0.03 -0.66 1.78 0.00 0.04 0.00 0.00 177.00 178.13 1y7h h ALA 128 N 5.91 2.31 0.00 8.56 0.00 -1.99 0.25 119.26 134.30 1y7h h ALA 128 Ca -0.45 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 1y7h h ALA 128 Cb 1.21 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1y7h h ALA 128 CO 0.87 -0.92 -0.24 0.93 0.00 0.00 0.00 179.25 179.90 1y7h h GLU 129 N 0.00 0.00 -0.49 0.00 3.07 -1.97 -2.82 114.58 112.37 1y7h h GLU 129 Ca 0.27 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.13 1y7h h GLU 129 Cb 1.52 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.41 1y7h h GLU 129 CO -0.00 0.24 0.30 -0.97 -1.40 0.00 0.00 179.01 177.17 1y7h h ASN 130 N 0.00 0.57 -0.03 1.42 -0.00 -0.86 -2.40 115.58 114.28 1y7h h ASN 130 Ca -0.00 -0.02 0.01 0.00 -0.00 0.00 0.00 56.30 56.28 1y7h h ASN 130 Cb 0.44 -0.14 -0.00 0.00 -0.00 0.00 0.00 38.32 38.62 1y7h h ASN 130 CO 0.03 0.44 0.20 -0.50 -0.00 0.00 0.00 177.43 177.60 1y7h h TRP 131 N 0.66 0.00 0.00 0.67 4.06 -1.64 -3.47 115.95 116.23 1y7h h TRP 131 Ca 0.18 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.13 1y7h h TRP 131 Cb -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.13 1y7h h TRP 131 CO 0.00 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 176.16 1y7h n LEU 132 N -3.06 0.00 -1.46 -4.49 4.77 -0.91 -2.07 117.00 109.78 1y7h n LEU 132 Ca -0.02 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.95 1y7h n LEU 132 Cb 0.27 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.57 1y7h n LEU 132 CO 0.17 0.00 0.73 -0.90 -1.33 0.00 0.00 177.39 176.06 1y7h n ASP 133 N 5.89 3.77 -4.76 -1.43 3.85 -1.26 -4.93 116.55 117.69 1y7h n ASP 133 Ca 0.00 -2.68 -0.40 0.00 -0.71 0.00 0.00 54.79 51.00 1y7h n ASP 133 Cb 0.00 -0.64 -0.04 0.00 -1.35 0.00 0.00 41.12 39.09 1y7h n ASP 133 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1y7h s THR 134 N -2.05 3.51 -0.15 2.12 2.01 -0.88 -3.91 115.64 116.28 1y7h s THR 134 Ca 0.34 1.52 -0.03 0.00 0.31 0.00 0.00 61.69 63.82 1y7h s THR 134 Cb 0.26 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.78 1y7h s THR 134 CO 0.09 0.36 -0.05 0.00 -0.69 0.00 0.00 174.62 174.32 1y7h s GLN 135 N -1.39 3.62 -0.39 4.92 -2.07 -0.55 -4.94 119.66 118.85 1y7h s GLN 135 Ca 0.45 -0.55 -0.04 0.00 -1.82 0.00 0.00 55.36 53.40 1y7h s GLN 135 Cb -0.32 -2.87 0.10 0.00 -1.09 0.00 0.00 33.01 28.83 1y7h s GLN 135 CO 0.41 0.23 0.18 -0.06 -1.32 0.00 0.00 175.29 174.73 1y7h s PHE 136 N 0.38 3.49 -0.08 9.60 0.08 -1.25 -1.24 117.98 128.96 1y7h s PHE 136 Ca -0.05 -2.18 0.01 0.00 0.12 0.00 0.00 56.93 54.83 1y7h s PHE 136 Cb -0.14 -3.00 -0.03 0.00 -0.57 0.00 0.00 43.02 39.27 1y7h s PHE 136 CO 0.03 -0.93 -0.09 -0.51 -0.10 0.00 0.00 175.22 173.63 1y7h s LEU 137 N 1.21 3.05 0.11 -0.37 1.43 0.01 -4.88 118.68 119.23 1y7h s LEU 137 Ca 0.05 -0.09 -0.27 0.00 -1.03 0.00 0.00 54.13 52.79 1y7h s LEU 137 Cb -0.22 -1.66 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 1y7h s LEU 137 CO -0.03 0.32 0.84 -2.16 0.23 0.00 0.00 176.35 175.56 1y7h s PRO 138 N -0.58 4.61 -0.12 1.29 0.04 -1.26 -0.04 135.00 138.93 1y7h s PRO 138 Ca 0.09 1.24 0.16 0.00 0.04 0.00 0.00 61.00 62.53 1y7h s PRO 138 Cb -0.12 -3.34 0.39 0.00 0.04 0.00 0.00 34.50 31.48 1y7h s PRO 138 CO 0.02 0.34 1.19 2.48 0.04 0.00 0.00 177.00 181.07 1y7h n TYR 139 N 2.43 0.00 -0.05 0.56 4.11 0.36 -4.95 117.16 119.62 1y7h n TYR 139 Ca -0.02 -1.03 0.00 0.00 -0.00 0.00 0.00 57.90 56.86 1y7h n TYR 139 Cb 0.49 -0.20 0.00 0.00 -0.00 0.00 0.00 39.34 39.64 1y7h n TYR 139 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1y7h n GLY 140 N -0.51 5.48 3.19 -7.48 0.00 -1.22 -4.71 105.19 99.95 1y7h n GLY 140 Ca 0.13 -1.21 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 1y7h n GLY 140 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y7h s SER 141 N 1.00 0.74 0.29 1.61 1.04 -0.91 -4.82 113.70 112.65 1y7h s SER 141 Ca 0.00 -1.18 0.21 0.00 0.48 0.00 0.00 55.95 55.46 1y7h s SER 141 Cb 0.00 0.21 1.07 0.00 0.10 0.00 0.00 66.02 67.39 1y7h s SER 141 CO 0.00 -0.65 1.65 -0.81 0.98 0.00 0.00 173.24 174.41 1y7h n PRO 142 N -0.15 0.15 -0.05 4.02 -0.04 -1.26 0.11 135.00 137.78 1y7h n PRO 142 Ca -0.06 0.57 -0.20 0.00 -0.04 0.00 0.00 63.50 63.77 1y7h n PRO 142 Cb 0.63 -1.91 -0.13 0.00 -0.04 0.00 0.00 33.50 32.05 1y7h n PRO 142 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1y7h n GLU 143 N -2.21 0.71 -3.24 0.54 1.02 -1.26 -4.60 120.64 111.60 1y7h n GLU 143 Ca -0.00 0.21 -0.24 0.00 -0.02 0.00 0.00 57.16 57.11 1y7h n GLU 143 Cb 0.09 -1.63 -0.06 0.00 -0.02 0.00 0.00 31.44 29.81 1y7h n GLU 143 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1y7h n GLU 144 N -3.38 1.62 -1.94 3.49 -0.58 -0.75 -5.11 120.64 113.99 1y7h n GLU 144 Ca -0.37 -3.90 -0.39 0.00 -0.42 0.00 0.00 57.16 52.09 1y7h n GLU 144 Cb 1.03 -1.73 0.01 0.00 -0.57 0.00 0.00 31.44 30.18 1y7h n GLU 144 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1y7h s PRO 145 N -2.04 3.60 -0.04 3.49 0.04 0.31 -2.13 135.00 138.23 1y7h s PRO 145 Ca 0.39 2.18 -0.02 0.00 0.04 0.00 0.00 61.00 63.59 1y7h s PRO 145 Cb 0.20 -2.52 0.03 0.00 0.04 0.00 0.00 34.50 32.25 1y7h s PRO 145 CO -0.08 -0.80 0.05 -0.51 0.04 0.00 0.00 177.00 175.71 1y7h s LEU 146 N -2.94 0.21 -0.08 -3.56 1.43 -1.26 -4.82 118.68 107.66 1y7h s LEU 146 Ca 0.64 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.82 1y7h s LEU 146 Cb -0.39 -0.16 -0.03 0.00 0.03 0.00 0.00 46.19 45.65 1y7h s LEU 146 CO 0.48 -0.24 -0.10 -0.89 0.23 0.00 0.00 176.35 175.83 1y7h s THR 147 N 2.11 3.46 0.00 5.49 2.01 -1.26 0.14 115.64 127.58 1y7h s THR 147 Ca 0.04 -0.56 0.00 0.00 0.31 0.00 0.00 61.69 61.48 1y7h s THR 147 Cb -0.12 -2.41 0.00 0.00 0.01 0.00 0.00 72.50 69.98 1y7h s THR 147 CO -0.03 0.58 0.00 -1.54 -0.69 0.00 0.00 174.62 172.94 1y7h n SER 148 N 2.48 1.38 0.00 3.53 3.41 0.94 -4.47 113.62 120.90 1y7h n SER 148 Ca -0.18 -0.73 0.00 0.00 -0.26 0.00 0.00 58.87 57.70 1y7h n SER 148 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1y7h n SER 148 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1y7h n PHE 150 N -0.23 0.00 -1.78 7.33 7.35 -0.38 -0.81 117.46 128.95 1y7h n PHE 150 Ca 0.00 0.00 -0.39 0.00 -0.76 0.00 0.00 57.45 56.30 1y7h n PHE 150 Cb 0.00 0.00 0.04 0.00 0.35 0.00 0.00 39.48 39.87 1y7h n PHE 150 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1y7h s PHE 151 N 0.00 2.31 0.48 -5.13 0.08 -1.26 -1.48 117.98 112.97 1y7h s PHE 151 Ca 0.00 1.34 0.08 0.00 0.12 0.00 0.00 56.93 58.47 1y7h s PHE 151 Cb 0.00 -3.84 0.03 0.00 -0.57 0.00 0.00 43.02 38.64 1y7h s PHE 151 CO 0.00 -2.94 0.56 0.20 -0.10 0.00 0.00 175.22 172.93 1y7h s GLY 152 N -0.84 2.00 0.32 4.36 0.00 -1.25 -4.87 107.32 107.03 1y7h s GLY 152 Ca 0.69 -1.81 -0.00 0.00 0.00 0.00 0.00 44.72 43.60 1y7h s GLY 152 CO 0.50 -1.66 1.99 -0.56 0.00 0.00 0.00 173.10 173.36 1y7h h PRO 153 N 0.64 0.98 0.53 2.90 0.13 -1.96 -1.49 132.00 133.73 1y7h h PRO 153 Ca -0.37 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 64.67 1y7h h PRO 153 Cb 1.28 -0.22 0.01 0.00 0.13 0.00 0.00 31.00 32.20 1y7h h PRO 153 CO 0.49 0.65 -0.26 0.87 -0.23 0.00 0.00 178.00 179.52 1y7h h LYS 154 N 1.01 -0.69 -0.64 0.86 1.79 -1.95 -1.43 116.57 115.52 1y7h h LYS 154 Ca 0.27 0.05 0.10 0.00 -2.18 0.00 0.00 60.65 58.89 1y7h h LYS 154 Cb -0.11 0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 30.65 1y7h h LYS 154 CO -0.06 -0.39 0.43 0.35 -1.08 0.00 0.00 179.45 178.70 1y7h h PHE 155 N -1.04 0.49 0.10 -1.35 3.04 -1.82 0.29 116.94 116.65 1y7h h PHE 155 Ca -0.07 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.89 1y7h h PHE 155 Cb 0.62 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.97 1y7h h PHE 155 CO 0.01 0.23 -0.05 1.25 -2.02 0.00 0.00 178.31 177.73 1y7h h LEU 156 N 0.46 -0.12 0.01 0.59 5.85 -1.20 0.80 115.31 121.70 1y7h h LEU 156 Ca 0.30 -0.31 -0.27 0.00 0.84 0.00 0.00 57.88 58.44 1y7h h LEU 156 Cb 0.55 0.03 0.02 0.00 0.37 0.00 0.00 40.66 41.63 1y7h h LEU 156 CO -0.09 0.26 -1.11 0.00 -0.34 0.00 0.00 178.44 177.16 1y7h h ALA 157 N 0.32 0.14 0.00 1.25 0.00 -0.82 0.27 119.26 120.42 1y7h h ALA 157 Ca -0.01 -0.75 -0.13 0.00 0.00 0.00 0.00 54.91 54.02 1y7h h ALA 157 Cb 0.42 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1y7h h ALA 157 CO 0.02 0.76 -1.01 0.45 0.00 0.00 0.00 179.25 179.47 1y7h h HIS 158 N 0.27 0.00 0.00 0.00 3.86 -0.55 -0.90 115.15 117.83 1y7h h HIS 158 Ca -0.14 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 58.89 1y7h h HIS 158 Cb 1.78 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 30.21 1y7h h HIS 158 CO 0.09 0.50 -1.72 1.63 0.86 0.00 0.00 177.93 179.29 1y7h n LYS 159 N -3.00 2.17 -0.08 2.45 4.76 0.26 -4.56 118.16 120.15 1y7h n LYS 159 Ca -0.04 -0.01 -0.12 0.00 -2.87 0.00 0.00 58.31 55.27 1y7h n LYS 159 Cb 0.77 -1.27 -0.07 0.00 -1.84 0.00 0.00 35.03 32.62 1y7h n LYS 159 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1y7h n LEU 160 N -2.37 2.79 -0.89 -0.35 4.77 -0.83 -2.00 117.00 118.11 1y7h n LEU 160 Ca -0.17 -0.05 0.03 0.00 -0.03 0.00 0.00 56.01 55.79 1y7h n LEU 160 Cb 0.82 -0.56 0.22 0.00 -2.33 0.00 0.00 43.42 41.57 1y7h n LEU 160 CO 0.23 0.73 0.67 -1.22 -1.33 0.00 0.00 177.39 176.46 1y7h n TYR 161 N -3.06 0.84 0.26 -1.77 4.02 0.89 -3.75 117.16 114.59 1y7h n TYR 161 Ca -0.29 -1.24 0.18 0.00 -0.01 0.00 0.00 57.90 56.54 1y7h n TYR 161 Cb 0.80 -0.37 0.90 0.00 -0.02 0.00 0.00 39.34 40.65 1y7h n TYR 161 CO 0.00 0.00 0.00 -0.56 -1.01 0.00 0.00 176.86 175.29 1y7h h GLN 162 N 1.17 0.00 -0.17 -0.72 -0.00 -1.39 -0.00 115.11 114.00 1y7h h GLN 162 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.75 1y7h h GLN 162 Cb 1.46 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.94 1y7h h GLN 162 CO 0.26 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.37 1y7h n LEU 163 N -3.43 2.32 -4.92 0.06 4.77 -1.26 -5.01 117.00 109.54 1y7h n LEU 163 Ca 0.00 -1.61 -0.26 0.00 -0.03 0.00 0.00 56.01 54.11 1y7h n LEU 163 Cb 0.30 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 1y7h n LEU 163 CO 0.22 0.55 0.31 0.00 -1.33 0.00 0.00 177.39 177.14 1y7h s SER 165 N -3.91 3.13 0.36 0.00 1.04 -1.26 -4.89 113.70 108.16 1y7h s SER 165 Ca 0.44 1.46 0.10 0.00 0.48 0.00 0.00 55.95 58.44 1y7h s SER 165 Cb -0.10 -2.14 0.68 0.00 0.10 0.00 0.00 66.02 64.56 1y7h s SER 165 CO 0.39 -2.85 1.83 1.55 0.98 0.00 0.00 173.24 175.14 1y7h h PRO 166 N -1.70 0.16 0.21 4.02 0.13 -1.97 -2.91 132.00 129.94 1y7h h PRO 166 Ca -0.51 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 1y7h h PRO 166 Cb 1.29 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1y7h h PRO 166 CO 0.54 0.43 -0.19 0.93 -0.23 0.00 0.00 178.00 179.49 1y7h h GLU 167 N 0.14 -0.40 -0.87 0.86 3.07 -1.99 0.21 114.58 115.60 1y7h h GLU 167 Ca 0.02 0.03 0.11 0.00 -0.50 0.00 0.00 59.36 59.02 1y7h h GLU 167 Cb 0.58 0.09 -0.06 0.00 -0.84 0.00 0.00 28.75 28.52 1y7h h GLU 167 CO 0.04 -0.27 0.56 -0.44 -1.40 0.00 0.00 179.01 177.51 1y7h h ASP 168 N -0.42 0.74 0.39 1.42 3.45 -1.90 -0.18 116.42 119.91 1y7h h ASP 168 Ca -0.00 0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.46 1y7h h ASP 168 Cb 0.38 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.03 1y7h h ASP 168 CO -0.03 0.42 -0.19 0.25 -1.57 0.00 0.00 179.24 178.12 1y7h h LEU 169 N 0.81 -0.44 -1.19 1.55 5.85 -1.17 -1.18 115.31 119.53 1y7h h LEU 169 Ca 0.41 -0.12 0.17 0.00 0.84 0.00 0.00 57.88 59.18 1y7h h LEU 169 Cb 0.49 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 1y7h h LEU 169 CO -0.18 -0.11 0.60 0.00 -0.34 0.00 0.00 178.44 178.42 1y7h h ALA 170 N -0.32 1.80 -0.30 1.25 0.00 -0.00 0.50 119.26 122.18 1y7h h ALA 170 Ca -0.05 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1y7h h ALA 170 Cb 0.53 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1y7h h ALA 170 CO 0.09 -0.10 0.12 1.25 0.00 0.00 0.00 179.25 180.61 1y7h h LEU 171 N 0.71 0.41 0.66 0.00 5.85 -0.83 -3.05 115.31 119.07 1y7h h LEU 171 Ca 0.50 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 59.03 1y7h h LEU 171 Cb 0.83 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 1y7h h LEU 171 CO -0.27 0.47 -0.38 0.00 -0.34 0.00 0.00 178.44 177.92 1y7h h ALA 172 N 0.96 -0.99 0.00 1.25 0.00 0.32 -0.98 119.26 119.82 1y7h h ALA 172 Ca 0.10 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1y7h h ALA 172 Cb 0.18 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1y7h h ALA 172 CO -0.01 -1.07 0.17 -1.13 0.00 0.00 0.00 179.25 177.21 1y7h n SER 173 N -5.53 0.32 -0.88 0.00 3.41 -0.49 0.14 113.62 110.60 1y7h n SER 173 Ca -0.13 0.58 0.11 0.00 -0.26 0.00 0.00 58.87 59.16 1y7h n SER 173 Cb 0.41 -0.57 0.09 0.00 -0.26 0.00 0.00 64.21 63.88 1y7h n SER 173 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1y7h n SER 174 N -1.95 2.84 0.00 4.04 3.41 -0.40 -4.62 113.62 116.94 1y7h n SER 174 Ca -0.01 -1.92 0.00 0.00 -0.26 0.00 0.00 58.87 56.68 1y7h n SER 174 Cb 0.19 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1y7h n SER 174 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1y7h n LEU 175 N 1.22 0.62 -4.55 1.04 4.77 0.12 -5.07 117.00 115.15 1y7h n LEU 175 Ca 0.13 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.66 1y7h n LEU 175 Cb 0.56 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.63 1y7h n LEU 175 CO 0.14 0.10 0.43 1.33 -1.33 0.00 0.00 177.39 178.07 1y7h n VAL 176 N -1.86 2.00 -4.19 4.08 0.24 -0.66 -4.78 118.33 113.16 1y7h n VAL 176 Ca 0.00 -0.50 -0.15 0.00 -2.04 0.00 0.00 64.34 61.65 1y7h n VAL 176 Cb 0.40 -0.81 -0.11 0.00 -1.47 0.00 0.00 33.84 31.86 1y7h n VAL 176 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1y7h s ARG 177 N -1.50 0.88 0.52 7.34 0.52 -1.03 -5.03 118.95 120.65 1y7h s ARG 177 Ca 0.60 -1.19 -0.23 0.00 -0.52 0.00 0.00 55.73 54.40 1y7h s ARG 177 Cb -0.72 -0.59 -0.06 0.00 0.52 0.00 0.00 34.95 34.10 1y7h s ARG 177 CO 0.59 0.09 1.35 -1.25 0.02 0.00 0.00 175.30 176.10 1y7h s PRO 178 N -2.83 3.31 0.00 3.54 0.04 -1.26 -3.96 135.00 133.84 1y7h s PRO 178 Ca 0.07 2.22 0.00 0.00 0.04 0.00 0.00 61.00 63.32 1y7h s PRO 178 Cb -0.03 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1y7h s PRO 178 CO 0.00 -1.05 0.00 0.45 0.04 0.00 0.00 177.00 176.45 1y7h n SER 179 N -0.81 0.31 -3.59 6.66 2.88 -1.26 -4.77 113.62 113.04 1y7h n SER 179 Ca 0.09 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.56 1y7h n SER 179 Cb 0.45 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.89 1y7h n SER 179 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1y7h s SER 180 N 1.00 -0.30 0.00 -3.46 0.15 -1.26 -4.37 113.70 105.46 1y7h s SER 180 Ca 0.00 -0.14 0.15 0.00 0.70 0.00 0.00 55.95 56.66 1y7h s SER 180 Cb 0.00 0.42 0.01 0.00 -1.71 0.00 0.00 66.02 64.74 1y7h s SER 180 CO 0.00 -0.72 0.83 0.18 1.20 0.00 0.00 173.24 174.73 1y7h n LEU 181 N -0.33 1.62 -2.06 3.45 4.77 -1.26 -5.00 117.00 118.20 1y7h n LEU 181 Ca -0.08 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 1y7h n LEU 181 Cb 0.61 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1y7h n LEU 181 CO 0.12 0.31 -0.20 0.49 -1.33 0.00 0.00 177.39 176.78 1y7h n PHE 182 N -0.03 -1.95 0.00 -1.77 3.72 -1.26 -4.88 117.46 111.28 1y7h n PHE 182 Ca 0.06 1.16 0.00 0.00 -0.05 0.00 0.00 57.45 58.63 1y7h n PHE 182 Cb 0.32 -2.06 0.00 0.00 -0.94 0.00 0.00 39.48 36.80 1y7h n PHE 182 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1y7h n GLU 184 N 1.89 0.00 -0.16 -1.08 4.71 -1.26 -1.45 120.64 123.29 1y7h n GLU 184 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.04 1y7h n GLU 184 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1y7h n GLU 184 CO 0.00 0.00 0.00 0.22 0.09 0.00 0.00 177.13 177.44 1y7h h ASP 185 N 0.00 0.92 1.51 1.62 3.58 -1.92 -3.04 116.42 119.09 1y7h h ASP 185 Ca 0.00 -0.36 0.00 0.00 0.42 0.00 0.00 57.03 57.09 1y7h h ASP 185 Cb 0.00 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 40.80 1y7h h ASP 185 CO 0.00 1.07 0.00 -0.07 -2.88 0.00 0.00 179.24 177.36 1y7h h LEU 186 N 0.76 0.00 0.00 2.28 3.38 -1.59 -3.08 115.31 117.06 1y7h h LEU 186 Ca 0.12 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1y7h h LEU 186 Cb 0.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1y7h h LEU 186 CO 0.05 0.00 -0.40 0.77 0.09 0.00 0.00 178.44 178.94 1y7h h SER 187 N 0.00 0.00 -1.24 -0.43 4.64 -1.79 -2.81 113.55 111.93 1y7h h SER 187 Ca 0.00 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 1y7h h SER 187 Cb 0.76 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.53 1y7h h SER 187 CO 0.00 0.33 0.50 0.29 -0.87 0.00 0.00 176.83 177.08 1y7h n LYS 188 N -3.15 2.93 -3.62 4.77 5.02 -1.16 -4.96 118.16 117.98 1y7h n LYS 188 Ca 0.02 -3.60 -0.04 0.00 -2.02 0.00 0.00 58.31 52.68 1y7h n LYS 188 Cb 0.67 -2.28 -0.03 0.00 -0.02 0.00 0.00 35.03 33.37 1y7h n LYS 188 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y7h s ALA 189 N -3.83 -2.10 -0.78 7.82 0.00 -1.25 -5.05 121.76 116.57 1y7h s ALA 189 Ca 0.58 1.77 0.03 0.00 0.00 0.00 0.00 51.96 54.34 1y7h s ALA 189 Cb 0.47 -0.78 0.26 0.00 0.00 0.00 0.00 23.12 23.06 1y7h s ALA 189 CO -0.11 -0.42 0.91 1.17 0.00 0.00 0.00 175.76 177.31 1y7h n LYS 190 N 0.25 2.97 0.00 0.00 3.00 -1.26 -3.07 118.16 120.04 1y7h n LYS 190 Ca 0.00 -4.61 0.05 0.00 -0.00 0.00 0.00 58.31 53.75 1y7h n LYS 190 Cb 0.58 -2.34 0.25 0.00 0.00 0.00 0.00 35.03 33.52 1y7h n LYS 190 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1y7h n TYR 191 N 1.21 0.00 -4.95 5.64 4.01 -1.26 -4.70 117.16 117.10 1y7h n TYR 191 Ca 0.27 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.75 1y7h n TYR 191 Cb 0.38 -0.42 -0.15 0.00 -0.31 0.00 0.00 39.34 38.84 1y7h n TYR 191 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1y7h s PHE 192 N -2.83 1.81 0.24 -0.72 0.08 -1.26 -4.88 117.98 110.41 1y7h s PHE 192 Ca 0.07 -0.34 0.07 0.00 0.12 0.00 0.00 56.93 56.85 1y7h s PHE 192 Cb 0.07 -1.16 -0.05 0.00 -0.57 0.00 0.00 43.02 41.31 1y7h s PHE 192 CO 0.19 -0.02 -0.09 0.95 -0.10 0.00 0.00 175.22 176.14 1y7h s THR 193 N -0.50 1.61 0.17 0.64 -4.23 -1.26 -4.60 115.64 107.46 1y7h s THR 193 Ca 0.08 -2.15 -0.05 0.00 -1.18 0.00 0.00 61.69 58.39 1y7h s THR 193 Cb -0.08 -2.24 -0.08 0.00 1.34 0.00 0.00 72.50 71.44 1y7h s THR 193 CO -0.01 -0.45 1.45 0.44 -0.54 0.00 0.00 174.62 175.52 1y7h h ASP 194 N 2.44 0.66 0.43 3.99 5.19 -1.96 -2.07 116.42 125.10 1y7h h ASP 194 Ca -0.39 -0.38 -0.09 0.00 -0.62 0.00 0.00 57.03 55.55 1y7h h ASP 194 Cb 1.23 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 40.53 1y7h h ASP 194 CO 0.64 1.12 -0.43 -0.33 -3.12 0.00 0.00 179.24 177.12 1y7h h GLU 195 N 0.43 0.01 0.00 3.56 3.07 -1.96 -3.18 114.58 116.50 1y7h h GLU 195 Ca -0.01 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1y7h h GLU 195 Cb 1.20 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.11 1y7h h GLU 195 CO 0.12 0.44 0.00 0.54 -1.40 0.00 0.00 179.01 178.71 1y7h n ARG 196 N -4.02 0.00 -0.37 2.33 1.74 -1.23 -4.51 116.66 110.60 1y7h n ARG 196 Ca -0.02 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.04 1y7h n ARG 196 Cb 0.46 -0.34 0.10 0.00 -1.02 0.00 0.00 32.46 31.66 1y7h n ARG 196 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1y7h h PHE 197 N 0.00 1.25 0.00 -1.55 3.57 -1.68 -2.81 116.94 115.72 1y7h h PHE 197 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1y7h h PHE 197 Cb 0.00 -0.42 0.00 0.00 2.79 0.00 0.00 35.95 38.32 1y7h h PHE 197 CO 0.00 0.80 0.00 0.41 -2.23 0.00 0.00 178.31 177.29 1y7h n GLY 198 N -1.33 -1.32 0.41 2.40 0.00 -0.82 -3.16 105.19 101.38 1y7h n GLY 198 Ca 0.11 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1y7h n GLY 198 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y7h n SER 199 N -1.39 1.22 -4.74 1.61 3.41 -1.06 -4.85 113.62 107.82 1y7h n SER 199 Ca 0.10 -1.71 -0.36 0.00 -0.26 0.00 0.00 58.87 56.63 1y7h n SER 199 Cb 0.27 -0.10 -0.07 0.00 -0.26 0.00 0.00 64.21 64.05 1y7h n SER 199 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1y7h s VAL 200 N -1.81 5.31 -0.18 -3.33 1.01 -1.19 -5.02 120.40 115.19 1y7h s VAL 200 Ca 0.28 0.51 -0.31 0.00 0.00 0.00 0.00 61.98 62.45 1y7h s VAL 200 Cb 0.14 -3.60 -0.08 0.00 0.00 0.00 0.00 36.38 32.84 1y7h s VAL 200 CO 0.22 0.42 2.12 0.29 0.00 0.00 0.00 175.10 178.15 1y7h n LYS 201 N 3.36 1.95 -3.61 2.72 4.76 -1.26 -4.86 118.16 121.22 1y7h n LYS 201 Ca -0.13 0.61 -0.37 0.00 -2.87 0.00 0.00 58.31 55.55 1y7h n LYS 201 Cb 0.52 -2.94 -0.09 0.00 -1.84 0.00 0.00 35.03 30.68 1y7h n LYS 201 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1y7h s ARG 202 N 5.65 4.13 -0.03 1.97 0.52 -1.26 -0.46 118.95 129.47 1y7h s ARG 202 Ca 1.00 -0.14 0.07 0.00 -0.52 0.00 0.00 55.73 56.14 1y7h s ARG 202 Cb -0.52 -3.51 -0.02 0.00 0.52 0.00 0.00 34.95 31.43 1y7h s ARG 202 CO 0.42 0.10 -0.24 0.08 0.02 0.00 0.00 175.30 175.69 1y7h s VAL 203 N 0.92 1.87 -0.15 3.52 1.01 0.14 -0.73 120.40 126.99 1y7h s VAL 203 Ca 0.11 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1y7h s VAL 203 Cb -0.13 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.71 1y7h s VAL 203 CO 0.04 0.53 -0.14 -0.47 0.00 0.00 0.00 175.10 175.05 1y7h s TYR 204 N -0.46 2.16 -0.21 5.22 6.14 0.30 -0.50 117.35 129.99 1y7h s TYR 204 Ca 0.06 -1.20 -0.13 0.00 0.64 0.00 0.00 57.07 56.44 1y7h s TYR 204 Cb -0.10 -1.59 -0.04 0.00 0.42 0.00 0.00 41.96 40.65 1y7h s TYR 204 CO -0.00 -0.66 0.29 0.42 0.64 0.00 0.00 175.55 176.24 1y7h s ILE 205 N 1.44 5.28 -0.14 3.14 1.01 -0.39 0.50 121.20 132.03 1y7h s ILE 205 Ca 0.04 0.47 -0.10 0.00 0.00 0.00 0.00 60.65 61.06 1y7h s ILE 205 Cb -0.13 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 1y7h s ILE 205 CO -0.10 0.30 0.19 -0.69 0.00 0.00 0.00 174.94 174.64 1y7h s VAL 206 N 1.13 5.39 -0.31 2.92 1.01 0.25 -1.64 120.40 129.16 1y7h s VAL 206 Ca 0.14 0.32 -0.06 0.00 0.00 0.00 0.00 61.98 62.39 1y7h s VAL 206 Cb -0.14 -3.49 0.03 0.00 0.00 0.00 0.00 36.38 32.77 1y7h s VAL 206 CO 0.06 0.51 0.07 0.00 0.00 0.00 0.00 175.10 175.74 1y7h h THR 208 N 6.09 1.33 -0.03 0.00 1.35 -1.61 -3.03 112.91 117.00 1y7h h THR 208 Ca -0.27 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 64.17 1y7h h THR 208 Cb 1.10 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1y7h h THR 208 CO 0.59 0.44 0.00 -0.62 -0.25 0.00 0.00 175.52 175.68 1y7h n GLU 209 N -4.39 1.15 -2.17 4.72 -0.58 -0.58 -4.43 120.64 114.37 1y7h n GLU 209 Ca -0.05 -0.15 -0.42 0.00 -0.42 0.00 0.00 57.16 56.12 1y7h n GLU 209 Cb 0.43 -1.32 -0.03 0.00 -0.57 0.00 0.00 31.44 29.95 1y7h n GLU 209 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1y7h s ASP 210 N -0.45 6.83 -0.06 1.62 -1.08 -1.15 -4.42 116.67 117.97 1y7h s ASP 210 Ca 0.03 2.38 0.10 0.00 -0.52 0.00 0.00 52.55 54.54 1y7h s ASP 210 Cb 0.02 -2.60 -0.14 0.00 -1.46 0.00 0.00 42.92 38.74 1y7h s ASP 210 CO 0.01 -0.62 0.13 0.29 0.52 0.00 0.00 175.17 175.50 1y7h n LYS 211 N 3.39 1.44 0.16 4.34 5.02 -1.23 -3.97 118.16 127.31 1y7h n LYS 211 Ca 0.09 -0.05 -0.14 0.00 -2.02 0.00 0.00 58.31 56.20 1y7h n LYS 211 Cb 0.42 -1.26 -0.08 0.00 -0.02 0.00 0.00 35.03 34.09 1y7h n LYS 211 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1y7h h GLY 212 N 1.99 -0.41 -7.53 0.72 0.00 -1.75 -3.36 103.07 92.72 1y7h h GLY 212 Ca -0.15 0.15 -0.67 0.00 0.00 0.00 0.00 47.33 46.67 1y7h h GLY 212 CO 0.01 -0.15 -0.60 -0.42 0.00 0.00 0.00 176.54 175.38 1y7h s ILE 213 N -5.03 2.84 0.46 2.60 1.01 -1.26 -5.09 121.20 116.73 1y7h s ILE 213 Ca -0.15 -2.66 -0.23 0.00 0.00 0.00 0.00 60.65 57.62 1y7h s ILE 213 Cb 0.03 -2.97 -0.09 0.00 0.01 0.00 0.00 42.46 39.43 1y7h s ILE 213 CO 0.58 -0.72 0.97 -0.81 0.00 0.00 0.00 174.94 174.95 1y7h n PRO 214 N 3.88 1.21 -0.32 2.79 -0.04 -1.25 -4.67 135.00 136.59 1y7h n PRO 214 Ca 0.04 0.44 0.22 0.00 -0.04 0.00 0.00 63.50 64.16 1y7h n PRO 214 Cb 0.38 -2.04 0.50 0.00 -0.04 0.00 0.00 33.50 32.30 1y7h n PRO 214 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1y7h h GLU 215 N 1.26 0.40 -0.02 0.54 4.81 -1.78 -1.08 114.58 118.71 1y7h h GLU 215 Ca -0.45 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 58.78 1y7h h GLU 215 Cb 1.35 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.60 1y7h h GLU 215 CO 0.55 0.26 -0.15 0.93 -0.73 0.00 0.00 179.01 179.87 1y7h h GLU 216 N 0.41 -0.24 -0.24 1.92 3.07 -1.94 -1.15 114.58 116.41 1y7h h GLU 216 Ca 0.59 0.02 -0.10 0.00 -0.50 0.00 0.00 59.36 59.37 1y7h h GLU 216 Cb 1.47 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.42 1y7h h GLU 216 CO -0.30 -0.16 -0.29 0.35 -1.40 0.00 0.00 179.01 177.20 1y7h h PHE 217 N -0.25 0.54 -0.27 4.33 3.57 -1.57 -0.90 116.94 122.38 1y7h h PHE 217 Ca 0.06 -0.12 0.04 0.00 3.53 0.00 0.00 57.97 61.47 1y7h h PHE 217 Cb 0.32 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 1y7h h PHE 217 CO -0.22 0.72 0.04 1.96 -2.23 0.00 0.00 178.31 178.59 1y7h h GLN 218 N 0.41 0.14 0.00 1.11 4.20 -0.78 -0.86 115.11 119.32 1y7h h GLN 218 Ca 0.05 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.70 1y7h h GLN 218 Cb 0.72 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 1y7h h GLN 218 CO 0.06 0.09 -0.29 0.00 -0.67 0.00 0.00 178.83 178.02 1y7h h ARG 219 N 0.14 0.00 -0.20 1.46 3.08 -0.89 -2.84 114.38 115.13 1y7h h ARG 219 Ca 0.13 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 1y7h h ARG 219 Cb 0.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1y7h h ARG 219 CO -0.18 0.29 0.10 2.35 -1.07 0.00 0.00 179.97 181.46 1y7h h TRP 220 N 0.00 0.28 -0.69 3.04 7.01 0.19 -1.77 115.95 124.00 1y7h h TRP 220 Ca -0.00 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.00 1y7h h TRP 220 Cb 0.59 -0.09 -0.04 0.00 -2.10 0.00 0.00 29.16 27.52 1y7h h TRP 220 CO 0.00 0.27 0.45 1.96 -2.79 0.00 0.00 178.44 178.34 1y7h h GLN 221 N 0.20 0.88 -0.04 2.65 4.20 -1.09 0.23 115.11 122.14 1y7h h GLN 221 Ca 0.07 -0.05 0.04 0.00 0.06 0.00 0.00 58.65 58.76 1y7h h GLN 221 Cb 0.09 -0.20 -0.05 0.00 0.30 0.00 0.00 27.48 27.62 1y7h h GLN 221 CO -0.01 0.58 -0.29 0.82 -0.67 0.00 0.00 178.83 179.26 1y7h h ILE 222 N 0.91 0.34 0.00 2.54 2.04 -1.30 -1.12 117.51 120.91 1y7h h ILE 222 Ca 0.26 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.12 1y7h h ILE 222 Cb -0.07 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 1y7h h ILE 222 CO -0.07 0.00 0.00 0.44 0.00 0.00 0.00 178.15 178.52 1y7h h ASP 223 N -0.42 0.00 0.70 1.72 3.45 -1.07 1.55 116.42 122.35 1y7h h ASP 223 Ca 0.07 0.00 -0.26 0.00 0.43 0.00 0.00 57.03 57.27 1y7h h ASP 223 Cb 0.52 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.28 1y7h h ASP 223 CO -0.28 0.00 -1.27 -1.13 -1.57 0.00 0.00 179.24 175.00 1y7h h ASN 224 N 0.00 0.25 0.00 6.45 -0.73 0.24 -3.40 115.58 118.40 1y7h h ASN 224 Ca 0.00 -0.30 -0.08 0.00 1.87 0.00 0.00 56.30 57.79 1y7h h ASN 224 Cb 0.42 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.91 1y7h h ASN 224 CO 0.00 1.24 -1.29 -0.38 -0.37 0.00 0.00 177.43 176.63 1y7h n ILE 225 N -3.42 0.29 0.00 2.57 -0.00 -0.69 -5.08 119.36 113.03 1y7h n ILE 225 Ca -0.08 -0.12 0.00 0.00 -0.00 0.00 0.00 62.75 62.54 1y7h n ILE 225 Cb 1.00 -0.72 0.00 0.00 -0.00 0.00 0.00 39.64 39.92 1y7h n ILE 225 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1y7h n GLY 226 N 3.17 0.84 3.13 7.39 0.00 0.53 -5.09 105.19 115.15 1y7h n GLY 226 Ca -0.09 -1.68 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 1y7h n GLY 226 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y7h s VAL 227 N -2.74 0.13 0.15 1.61 -7.23 -1.26 -4.92 120.40 106.16 1y7h s VAL 227 Ca 0.00 -1.10 0.17 0.00 -1.81 0.00 0.00 61.98 59.23 1y7h s VAL 227 Cb 0.00 -0.94 0.09 0.00 0.56 0.00 0.00 36.38 36.09 1y7h s VAL 227 CO 0.00 -0.61 1.67 0.74 -0.31 0.00 0.00 175.10 176.60 1y7h h THR 228 N 3.57 1.00 -2.48 5.32 2.02 -1.31 -3.44 112.91 117.58 1y7h h THR 228 Ca -0.33 -1.74 -0.09 0.00 0.77 0.00 0.00 66.41 65.03 1y7h h THR 228 Cb 1.18 2.03 -0.24 0.00 -1.74 0.00 0.00 68.15 69.39 1y7h h THR 228 CO 0.51 0.44 -0.14 -1.61 0.37 0.00 0.00 175.52 175.08 1y7h s GLU 229 N -3.52 0.56 -0.39 6.66 0.41 -1.21 -5.05 118.70 116.16 1y7h s GLU 229 Ca 0.00 0.78 0.03 0.00 -0.41 0.00 0.00 54.97 55.38 1y7h s GLU 229 Cb 0.11 0.21 0.11 0.00 -1.78 0.00 0.00 34.13 32.78 1y7h s GLU 229 CO 0.71 -0.10 0.13 0.00 -0.49 0.00 0.00 175.26 175.51 1y7h s ALA 230 N 0.67 2.70 0.35 5.21 0.00 -1.26 -0.54 121.76 128.88 1y7h s ALA 230 Ca -0.03 -2.58 -0.09 0.00 0.00 0.00 0.00 51.96 49.26 1y7h s ALA 230 Cb -0.05 -1.95 -0.06 0.00 0.00 0.00 0.00 23.12 21.06 1y7h s ALA 230 CO -0.04 -1.80 0.68 0.42 0.00 0.00 0.00 175.76 175.01 1y7h s ILE 231 N 0.68 4.86 -0.04 0.00 -1.09 0.18 -4.95 121.20 120.83 1y7h s ILE 231 Ca 0.13 0.48 0.00 0.00 -2.23 0.00 0.00 60.65 59.03 1y7h s ILE 231 Cb -0.21 -3.71 0.02 0.00 -1.58 0.00 0.00 42.46 36.99 1y7h s ILE 231 CO -0.08 -0.38 -0.02 -0.70 -1.23 0.00 0.00 174.94 172.53 1y7h s GLU 232 N -3.57 0.62 -0.43 2.79 2.12 -1.26 0.86 118.70 119.83 1y7h s GLU 232 Ca 0.49 -0.01 -0.08 0.00 0.36 0.00 0.00 54.97 55.73 1y7h s GLU 232 Cb -0.10 -0.75 0.10 0.00 0.26 0.00 0.00 34.13 33.64 1y7h s GLU 232 CO 0.28 -0.14 0.27 0.42 -0.54 0.00 0.00 175.26 175.55 1y7h s ILE 233 N 1.13 3.97 0.20 -3.70 1.01 0.14 -4.88 121.20 119.07 1y7h s ILE 233 Ca -0.08 -1.67 -0.30 0.00 0.00 0.00 0.00 60.65 58.60 1y7h s ILE 233 Cb -0.14 -3.54 -0.08 0.00 0.01 0.00 0.00 42.46 38.71 1y7h s ILE 233 CO -0.01 -0.62 1.01 -0.75 0.00 0.00 0.00 174.94 174.57 1y7h s LYS 234 N 1.34 4.72 0.00 2.79 2.47 -1.26 -3.48 119.74 126.31 1y7h s LYS 234 Ca 0.05 1.58 0.00 0.00 -1.56 0.00 0.00 55.97 56.04 1y7h s LYS 234 Cb -0.24 -3.29 0.00 0.00 -1.46 0.00 0.00 37.83 32.84 1y7h s LYS 234 CO -0.00 0.28 0.00 0.41 0.16 0.00 0.00 175.35 176.20 1y7h n GLY 235 N 1.78 0.82 3.81 5.54 0.00 -1.26 -4.99 105.19 110.90 1y7h n GLY 235 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1y7h n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y7h s ALA 236 N -2.32 3.65 0.54 4.61 0.00 -1.23 -4.80 121.76 122.21 1y7h s ALA 236 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1y7h s ALA 236 Cb 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 23.12 20.68 1y7h s ALA 236 CO 0.00 0.38 0.00 -0.40 0.00 0.00 0.00 175.76 175.74 1y7h n ASP 237 N 2.23 0.00 -2.20 0.00 3.85 -1.26 -1.52 116.55 117.65 1y7h n ASP 237 Ca -0.13 -0.66 0.00 0.00 -0.71 0.00 0.00 54.79 53.29 1y7h n ASP 237 Cb 0.52 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.29 1y7h n ASP 237 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.20 177.76 1y7h n HIS 238 N -1.03 0.00 0.00 2.11 -0.00 -1.25 -4.61 115.22 110.45 1y7h n HIS 238 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1y7h n HIS 238 Cb 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 29.99 29.84 1y7h n HIS 238 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1y7h n ALA 240 N 1.49 0.00 0.00 1.57 0.00 -1.26 -4.99 120.51 117.31 1y7h n ALA 240 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1y7h n ALA 240 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1y7h n ALA 240 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1y7h n LEU 242 N 0.00 0.00 0.01 0.00 4.77 -1.26 -1.67 117.00 118.85 1y7h n LEU 242 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 1y7h n LEU 242 Cb 0.00 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 1y7h n LEU 242 CO 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 177.39 175.65 1y7h n GLU 244 N -2.86 1.80 -0.25 0.00 -0.58 -0.67 -4.95 120.64 113.13 1y7h n GLU 244 Ca -0.12 -3.59 -0.04 0.00 -0.42 0.00 0.00 57.16 53.00 1y7h n GLU 244 Cb 0.88 -1.54 0.07 0.00 -0.57 0.00 0.00 31.44 30.28 1y7h n GLU 244 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1y7h h PRO 245 N 2.83 0.85 -0.63 3.49 0.13 -1.76 -1.68 132.00 135.23 1y7h h PRO 245 Ca -0.00 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.11 1y7h h PRO 245 Cb 1.15 -0.19 -0.04 0.00 0.13 0.00 0.00 31.00 32.05 1y7h h PRO 245 CO 0.55 0.56 0.38 1.96 -0.23 0.00 0.00 178.00 181.23 1y7h h GLN 246 N 0.88 0.73 -0.30 0.86 4.20 -1.92 0.02 115.11 119.58 1y7h h GLN 246 Ca 0.28 -0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.81 1y7h h GLN 246 Cb -0.00 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.61 1y7h h GLN 246 CO -0.10 0.48 -0.35 0.87 -0.67 0.00 0.00 178.83 179.07 1y7h h LYS 247 N 0.75 0.76 -0.50 1.46 1.57 -1.89 -2.35 116.57 116.37 1y7h h LYS 247 Ca 0.26 -0.42 0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1y7h h LYS 247 Cb 0.04 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1y7h h LYS 247 CO -0.11 1.05 0.31 1.25 -0.57 0.00 0.00 179.45 181.38 1y7h h LEU 248 N 0.52 0.51 -0.24 2.94 6.46 -1.04 0.07 115.31 124.53 1y7h h LEU 248 Ca 0.04 -0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.83 1y7h h LEU 248 Cb 0.93 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.72 1y7h h LEU 248 CO 0.08 0.36 0.05 0.00 -0.62 0.00 0.00 178.44 178.32 1y7h h ALA 250 N 1.17 0.87 -0.05 0.00 0.00 -0.91 -0.06 119.26 120.29 1y7h h ALA 250 Ca 0.11 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1y7h h ALA 250 Cb 0.10 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1y7h h ALA 250 CO -0.14 0.28 -0.01 0.77 0.00 0.00 0.00 179.25 180.15 1y7h h SER 251 N 0.92 -0.05 -0.94 0.00 0.02 -0.51 -1.72 113.55 111.26 1y7h h SER 251 Ca 0.25 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.25 1y7h h SER 251 Cb -0.09 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.43 1y7h h SER 251 CO -0.06 -0.02 0.62 -0.07 -1.14 0.00 0.00 176.83 176.15 1y7h h LEU 252 N -0.00 1.03 -0.51 5.07 3.38 -0.52 0.72 115.31 124.48 1y7h h LEU 252 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1y7h h LEU 252 Cb 0.04 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1y7h h LEU 252 CO -0.05 0.72 0.00 0.18 0.09 0.00 0.00 178.44 179.37 1y7h n LEU 253 N -4.48 0.39 0.07 1.67 4.77 -0.09 -1.16 117.00 118.17 1y7h n LEU 253 Ca 0.12 0.61 -0.22 0.00 -0.03 0.00 0.00 56.01 56.49 1y7h n LEU 253 Cb 0.08 -0.58 -0.15 0.00 -2.33 0.00 0.00 43.42 40.44 1y7h n LEU 253 CO 0.35 -0.51 -0.51 -0.33 -1.33 0.00 0.00 177.39 175.06 1y7h h GLU 254 N 0.00 0.37 0.00 3.23 5.08 0.02 -3.33 114.58 119.96 1y7h h GLU 254 Ca 0.00 -0.64 -0.12 0.00 -1.00 0.00 0.00 59.36 57.60 1y7h h GLU 254 Cb 0.25 0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1y7h h GLU 254 CO 0.00 1.29 -0.59 0.82 -1.00 0.00 0.00 179.01 179.53 1y7h h ILE 255 N 0.10 1.35 0.00 3.13 2.04 -0.70 -2.03 117.51 121.40 1y7h h ILE 255 Ca -0.33 -2.07 0.00 0.00 1.00 0.00 0.00 64.86 63.46 1y7h h ILE 255 Cb 2.09 2.14 0.00 0.00 -0.74 0.00 0.00 36.82 40.31 1y7h h ILE 255 CO 0.18 0.58 0.00 0.00 0.00 0.00 0.00 178.15 178.91 1y7h n ALA 256 N -2.40 2.86 0.00 1.87 0.00 -0.31 -3.38 120.51 119.15 1y7h n ALA 256 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1y7h n ALA 256 Cb 0.61 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1y7h n ALA 256 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1y7h n HIS 257 N 1.15 0.00 0.36 0.00 1.44 -1.23 -5.01 115.22 111.93 1y7h n HIS 257 Ca 0.00 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.54 1y7h n HIS 257 Cb 0.38 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.40 1y7h n HIS 257 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 1y7h h LYS 258 N 0.00 -0.87 0.00 -1.40 3.64 -1.37 -3.52 116.57 113.04 1y7h h LYS 258 Ca 0.00 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1y7h h LYS 258 Cb 0.00 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1y7h h LYS 258 CO 0.00 -0.55 0.00 0.98 -2.27 0.00 0.00 179.45 177.61