#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 1.87 -1.18 1.64 -0.00 -1.26 -5.07 120.64 116.64 1y7h n GLU 3 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.16 56.86 1y7h n GLU 3 Cb 0.00 0.00 0.22 0.00 -0.00 0.00 0.00 31.44 31.66 1y7h n GLU 3 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1y7h s GLY 4 N 0.00 1.59 0.53 -1.84 0.00 -1.16 -5.06 107.32 101.38 1y7h s GLY 4 Ca 0.00 -0.84 -0.09 0.00 0.00 0.00 0.00 44.72 43.79 1y7h s GLY 4 CO 0.00 -0.03 0.67 0.28 0.00 0.00 0.00 173.10 174.02 1y7h n LYS 5 N -4.54 -0.94 -4.09 2.90 4.76 -1.26 -4.75 118.16 110.25 1y7h n LYS 5 Ca 0.11 -1.03 -0.30 0.00 -2.87 0.00 0.00 58.31 54.21 1y7h n LYS 5 Cb 0.59 -0.73 -0.16 0.00 -1.84 0.00 0.00 35.03 32.88 1y7h n LYS 5 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1y7h s HIS 6 N -2.42 2.26 -0.22 2.13 5.65 -1.26 -1.80 115.29 119.64 1y7h s HIS 6 Ca 0.39 -1.27 -0.10 0.00 0.25 0.00 0.00 55.06 54.33 1y7h s HIS 6 Cb -0.01 -1.64 -0.05 0.00 -1.18 0.00 0.00 32.58 29.70 1y7h s HIS 6 CO 0.27 -0.68 0.13 -0.06 -0.65 0.00 0.00 174.74 173.76 1y7h s PHE 7 N 1.40 3.33 -0.29 3.88 0.08 0.38 -0.68 117.98 126.09 1y7h s PHE 7 Ca 0.04 0.22 -0.04 0.00 0.12 0.00 0.00 56.93 57.27 1y7h s PHE 7 Cb -0.13 -2.20 0.03 0.00 -0.57 0.00 0.00 43.02 40.15 1y7h s PHE 7 CO -0.10 0.14 0.02 0.08 -0.10 0.00 0.00 175.22 175.26 1y7h s VAL 8 N 0.73 3.35 -0.23 -0.44 1.01 -0.66 -0.84 120.40 123.32 1y7h s VAL 8 Ca 0.07 -1.04 -0.13 0.00 0.00 0.00 0.00 61.98 60.89 1y7h s VAL 8 Cb -0.12 -2.80 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 1y7h s VAL 8 CO 0.02 0.03 0.26 -0.76 0.00 0.00 0.00 175.10 174.64 1y7h s LEU 9 N 1.37 4.12 -0.27 3.92 1.43 -0.28 -0.99 118.68 127.98 1y7h s LEU 9 Ca -0.01 0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.31 1y7h s LEU 9 Cb -0.18 -2.27 0.02 0.00 0.03 0.00 0.00 46.19 43.79 1y7h s LEU 9 CO -0.01 -0.00 0.00 -0.69 0.23 0.00 0.00 176.35 175.88 1y7h s VAL 10 N 1.23 3.33 0.85 -1.59 1.01 0.17 -3.96 120.40 121.45 1y7h s VAL 10 Ca 0.12 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 1y7h s VAL 10 Cb -0.14 -2.72 0.10 0.00 0.00 0.00 0.00 36.38 33.62 1y7h s VAL 10 CO 0.06 0.12 1.10 -1.38 0.00 0.00 0.00 175.10 175.01 1y7h s HIS 11 N 1.39 2.62 0.00 5.22 -3.43 -1.26 -1.05 115.29 118.79 1y7h s HIS 11 Ca 0.01 1.10 0.00 0.00 -0.80 0.00 0.00 55.06 55.36 1y7h s HIS 11 Cb -0.17 -3.20 0.00 0.00 -1.43 0.00 0.00 32.58 27.78 1y7h s HIS 11 CO -0.01 -2.08 0.00 0.41 -2.00 0.00 0.00 174.74 171.06 1y7h n GLY 12 N -1.89 1.09 3.72 -1.38 0.00 -1.14 -3.72 105.19 101.87 1y7h n GLY 12 Ca 0.07 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 1y7h n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y7h s ALA 13 N -3.21 3.22 0.00 4.61 0.00 -1.26 -3.63 121.76 121.50 1y7h s ALA 13 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1y7h s ALA 13 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1y7h s ALA 13 CO 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 175.76 175.61 1y7h n HIS 15 N -2.00 -2.52 -3.70 0.00 -0.00 -1.24 -1.55 115.22 104.21 1y7h n HIS 15 Ca 0.00 -0.12 -0.08 0.00 -0.00 0.00 0.00 57.72 57.52 1y7h n HIS 15 Cb 0.00 -0.03 0.01 0.00 -0.00 0.00 0.00 29.99 29.97 1y7h n HIS 15 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1y7h n GLY 16 N 4.63 1.56 0.44 -1.41 0.00 -1.26 -3.93 105.19 105.21 1y7h n GLY 16 Ca 0.01 -1.30 0.25 0.00 0.00 0.00 0.00 46.02 44.97 1y7h n GLY 16 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1y7h h GLY 17 N 1.50 0.00 2.00 -0.02 0.00 -1.69 0.15 103.07 105.00 1y7h h GLY 17 Ca -0.24 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 1y7h h GLY 17 CO 0.31 0.00 -0.02 0.11 0.00 0.00 0.00 176.54 176.94 1y7h h TRP 18 N 0.00 0.00 0.00 5.60 5.08 -1.90 -2.28 115.95 122.45 1y7h h TRP 18 Ca 0.33 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.30 1y7h h TRP 18 Cb 1.63 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.79 1y7h h TRP 18 CO 0.00 0.02 0.00 0.66 -1.28 0.00 0.00 178.44 177.84 1y7h h SER 19 N 0.00 0.00 -0.58 0.11 4.64 -1.10 -2.21 113.55 114.40 1y7h h SER 19 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1y7h h SER 19 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1y7h h SER 19 CO 0.00 0.00 0.00 0.79 -0.87 0.00 0.00 176.83 176.75 1y7h n TRP 20 N -2.60 1.35 0.19 4.77 7.02 -0.86 -4.65 117.44 122.67 1y7h n TRP 20 Ca -0.02 -0.63 0.11 0.00 -1.02 0.00 0.00 57.50 55.94 1y7h n TRP 20 Cb 0.08 -0.24 0.65 0.00 -2.42 0.00 0.00 31.31 29.38 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 3.66 0.01 0.00 -5.99 -0.00 -1.57 0.24 116.97 113.32 1y7h h TYR 21 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 58.73 58.49 1y7h h TYR 21 Cb 1.40 -0.00 -0.04 0.00 0.00 0.00 0.00 36.73 38.09 1y7h h TYR 21 CO 0.70 0.01 -1.29 0.87 -0.00 0.00 0.00 178.16 178.44 1y7h h LYS 22 N 0.02 0.00 0.21 0.10 1.57 -1.85 -3.37 116.57 113.24 1y7h h LYS 22 Ca 0.06 -0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.50 1y7h h LYS 22 Cb 0.23 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.57 1y7h h LYS 22 CO -0.00 0.79 -1.59 1.25 -0.57 0.00 0.00 179.45 179.33 1y7h h LEU 23 N 0.00 0.69 -0.69 2.94 5.85 -1.68 -3.37 115.31 119.05 1y7h h LEU 23 Ca -0.12 -0.87 0.15 0.00 0.84 0.00 0.00 57.88 57.88 1y7h h LEU 23 Cb 1.87 -0.22 -0.12 0.00 0.37 0.00 0.00 40.66 42.56 1y7h h LEU 23 CO 0.11 1.70 -0.03 0.50 -0.34 0.00 0.00 178.44 180.39 1y7h h LYS 24 N 0.12 0.08 -0.45 1.25 3.64 -0.72 -2.06 116.57 118.44 1y7h h LYS 24 Ca -0.29 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 58.98 1y7h h LYS 24 Cb 2.12 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.91 1y7h h LYS 24 CO 0.22 0.06 -0.16 -1.35 -2.27 0.00 0.00 179.45 175.94 1y7h h PRO 25 N 0.09 0.86 0.00 1.90 0.11 -1.75 -2.62 132.00 130.59 1y7h h PRO 25 Ca 0.37 -0.33 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 1y7h h PRO 25 Cb 0.61 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 1y7h h PRO 25 CO -0.63 0.96 -0.07 -0.07 -0.21 0.00 0.00 178.00 177.99 1y7h h LEU 26 N 0.76 0.00 0.16 2.35 -0.00 -1.54 -2.15 115.31 114.88 1y7h h LEU 26 Ca 0.11 0.00 -0.35 0.00 -0.00 0.00 0.00 57.88 57.64 1y7h h LEU 26 Cb 0.69 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.35 1y7h h LEU 26 CO 0.05 0.07 -1.81 -0.07 -0.00 0.00 0.00 178.44 176.68 1y7h h LEU 27 N 0.00 0.52 -1.55 1.67 3.38 -1.31 -3.36 115.31 114.67 1y7h h LEU 27 Ca -0.00 -0.88 -0.05 0.00 0.09 0.00 0.00 57.88 57.04 1y7h h LEU 27 Cb 0.28 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1y7h h LEU 27 CO 0.01 1.76 -0.24 -0.33 0.09 0.00 0.00 178.44 179.73 1y7h h GLU 28 N 0.09 0.00 0.00 1.13 5.08 -1.20 -1.82 114.58 117.85 1y7h h GLU 28 Ca -0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 1y7h h GLU 28 Cb 2.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.32 1y7h h GLU 28 CO 0.15 0.24 0.00 0.00 -1.00 0.00 0.00 179.01 178.39 1y7h n ALA 29 N -2.40 1.99 0.36 3.43 0.00 -0.83 -2.07 120.51 120.99 1y7h n ALA 29 Ca -0.02 0.01 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1y7h n ALA 29 Cb 0.32 -1.42 0.27 0.00 0.00 0.00 0.00 19.45 18.61 1y7h n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y7h n ALA 30 N -1.73 2.43 -0.50 0.00 0.00 -0.70 -4.93 120.51 115.08 1y7h n ALA 30 Ca 0.04 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1y7h n ALA 30 Cb 0.32 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 1.42 0.75 3.91 0.00 0.00 -0.88 -4.95 105.19 105.44 1y7h n GLY 31 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.33 3.51 0.34 1.61 3.76 -1.12 -2.97 115.29 118.09 1y7h s HIS 32 Ca 0.00 0.35 -0.13 0.00 -0.15 0.00 0.00 55.06 55.13 1y7h s HIS 32 Cb 0.00 -1.84 -0.08 0.00 1.11 0.00 0.00 32.58 31.78 1y7h s HIS 32 CO 0.00 0.55 0.72 0.21 -0.85 0.00 0.00 174.74 175.38 1y7h s LYS 33 N -2.48 3.90 0.01 1.40 2.20 -0.75 -3.87 119.74 120.15 1y7h s LYS 33 Ca 0.36 0.54 -0.00 0.00 -0.36 0.00 0.00 55.97 56.51 1y7h s LYS 33 Cb -0.13 -2.45 -0.01 0.00 -1.51 0.00 0.00 37.83 33.73 1y7h s LYS 33 CO 0.26 0.11 -0.02 0.08 -0.36 0.00 0.00 175.35 175.43 1y7h s VAL 34 N -2.09 0.07 -0.17 4.02 1.01 -1.26 -0.47 120.40 121.51 1y7h s VAL 34 Ca 0.52 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 1y7h s VAL 34 Cb -0.10 -0.18 0.06 0.00 0.00 0.00 0.00 36.38 36.16 1y7h s VAL 34 CO 0.23 -0.33 0.06 -0.89 0.00 0.00 0.00 175.10 174.16 1y7h s THR 35 N -0.97 0.24 -0.94 3.92 2.01 -0.02 -4.93 115.64 114.95 1y7h s THR 35 Ca -0.11 -0.31 -0.00 0.00 0.31 0.00 0.00 61.69 61.58 1y7h s THR 35 Cb -0.07 -0.77 0.31 0.00 0.01 0.00 0.00 72.50 71.98 1y7h s THR 35 CO -0.01 -0.19 1.46 0.00 -0.69 0.00 0.00 174.62 175.19 1y7h n ALA 36 N 5.16 5.34 -0.63 7.40 0.00 -1.26 -1.12 120.51 135.39 1y7h n ALA 36 Ca -0.08 -4.71 -0.31 0.00 0.00 0.00 0.00 53.44 48.34 1y7h n ALA 36 Cb 0.48 -1.88 0.19 0.00 0.00 0.00 0.00 19.45 18.24 1y7h n ALA 36 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1y7h n LEU 37 N 0.49 1.63 -4.59 0.00 -0.00 -1.25 -4.04 117.00 109.24 1y7h n LEU 37 Ca 0.35 0.25 -0.35 0.00 -0.00 0.00 0.00 56.01 56.27 1y7h n LEU 37 Cb 0.32 -1.38 -0.10 0.00 -0.00 0.00 0.00 43.42 42.25 1y7h n LEU 37 CO 0.55 -2.61 -0.26 -1.81 -0.00 0.00 0.00 177.39 173.26 1y7h s ASP 38 N -2.49 5.48 0.98 1.45 1.01 -1.26 -3.42 116.67 118.42 1y7h s ASP 38 Ca 0.66 0.01 -0.13 0.00 0.71 0.00 0.00 52.55 53.80 1y7h s ASP 38 Cb -0.23 -1.95 0.18 0.00 1.01 0.00 0.00 42.92 41.93 1y7h s ASP 38 CO 0.61 0.13 1.13 -0.76 0.21 0.00 0.00 175.17 176.48 1y7h s LEU 39 N 0.65 1.72 0.40 1.23 1.43 -1.26 -4.81 118.68 118.03 1y7h s LEU 39 Ca 0.03 0.97 -0.27 0.00 -1.03 0.00 0.00 54.13 53.83 1y7h s LEU 39 Cb -0.13 -3.16 -0.10 0.00 0.03 0.00 0.00 46.19 42.83 1y7h s LEU 39 CO 0.02 -2.96 1.36 0.00 0.23 0.00 0.00 176.35 174.99 1y7h n ALA 40 N -4.03 1.69 -1.95 4.21 0.00 -0.85 -1.69 120.51 117.88 1y7h n ALA 40 Ca 0.07 0.31 -0.17 0.00 0.00 0.00 0.00 53.44 53.64 1y7h n ALA 40 Cb 0.59 -2.32 -0.04 0.00 0.00 0.00 0.00 19.45 17.67 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 0.09 -0.47 -2.44 0.00 0.00 -1.25 -4.94 120.51 111.50 1y7h n ALA 41 Ca 0.04 0.21 -0.25 0.00 0.00 0.00 0.00 53.44 53.45 1y7h n ALA 41 Cb 0.39 -1.82 -0.11 0.00 0.00 0.00 0.00 19.45 17.90 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 -2.25 3.26 1.03 0.00 0.01 -0.68 -4.79 113.70 110.28 1y7h s SER 42 Ca 0.00 -0.90 0.00 0.00 1.31 0.00 0.00 55.95 56.36 1y7h s SER 42 Cb 0.00 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 65.99 1y7h s SER 42 CO 0.00 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.32 1y7h n GLY 43 N 0.10 2.95 1.08 3.44 0.00 -1.25 -0.77 105.19 110.74 1y7h n GLY 43 Ca -0.11 0.29 0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 0.59 -1.81 2.61 -2.24 -1.26 -4.91 114.28 107.25 1y7h n THR 44 Ca 0.00 -0.73 -0.42 0.00 -2.27 0.00 0.00 64.05 60.63 1y7h n THR 44 Cb 0.00 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 68.90 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 -1.32 6.51 0.00 3.42 3.68 0.05 -4.87 116.67 124.14 1y7h s ASP 45 Ca 0.39 2.62 0.26 0.00 2.13 0.00 0.00 52.55 57.95 1y7h s ASP 45 Cb 0.22 -2.56 1.34 0.00 -1.45 0.00 0.00 42.92 40.47 1y7h s ASP 45 CO 0.30 -0.96 1.88 0.18 0.13 0.00 0.00 175.17 176.71 1y7h n LEU 46 N 5.91 0.00 -4.77 -1.34 4.77 -1.26 -4.38 117.00 115.93 1y7h n LEU 46 Ca 0.17 0.25 -0.37 0.00 -0.03 0.00 0.00 56.01 56.03 1y7h n LEU 46 Cb 0.40 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1y7h n LEU 46 CO 0.64 -0.04 0.84 -0.13 -1.33 0.00 0.00 177.39 177.38 1y7h s ARG 47 N -2.50 3.56 0.19 3.23 0.52 -1.26 -5.00 118.95 117.69 1y7h s ARG 47 Ca 0.27 1.80 -0.01 0.00 -0.52 0.00 0.00 55.73 57.26 1y7h s ARG 47 Cb 0.17 -2.28 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 1y7h s ARG 47 CO 0.38 -0.73 0.39 0.15 0.02 0.00 0.00 175.30 175.51 1y7h s LYS 48 N -2.88 3.53 0.30 3.54 3.01 -1.26 -3.89 119.74 122.09 1y7h s LYS 48 Ca 0.67 -0.31 -0.02 0.00 -1.01 0.00 0.00 55.97 55.30 1y7h s LYS 48 Cb -0.29 -2.84 0.43 0.00 -1.01 0.00 0.00 37.83 34.12 1y7h s LYS 48 CO 0.34 0.41 1.97 0.97 0.51 0.00 0.00 175.35 179.55 1y7h h ILE 49 N 1.61 1.22 0.00 2.17 6.09 -1.86 -1.51 117.51 125.22 1y7h h ILE 49 Ca -0.48 -0.39 0.00 0.00 -1.37 0.00 0.00 64.86 62.62 1y7h h ILE 49 Cb 1.19 -0.02 0.00 0.00 0.47 0.00 0.00 36.82 38.45 1y7h h ILE 49 CO 0.69 0.21 0.18 -0.33 -3.07 0.00 0.00 178.15 175.83 1y7h h GLU 50 N 1.14 0.00 -0.00 2.19 3.07 -1.94 0.30 114.58 119.34 1y7h h GLU 50 Ca 0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 1y7h h GLU 50 Cb -0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.78 1y7h h GLU 50 CO -0.07 0.00 -0.31 0.39 -1.40 0.00 0.00 179.01 177.62 1y7h n GLU 51 N -2.96 0.21 -3.10 2.33 1.02 -0.57 -4.80 120.64 112.77 1y7h n GLU 51 Ca -0.02 -0.10 -0.42 0.00 -0.02 0.00 0.00 57.16 56.60 1y7h n GLU 51 Cb 0.24 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.10 1y7h n GLU 51 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1y7h s LEU 52 N -2.86 4.22 -0.26 -4.62 1.43 0.11 -4.92 118.68 111.78 1y7h s LEU 52 Ca 0.16 0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 53.42 1y7h s LEU 52 Cb 0.18 -2.81 -0.15 0.00 0.03 0.00 0.00 46.19 43.44 1y7h s LEU 52 CO 0.61 -0.58 -0.25 0.54 0.23 0.00 0.00 176.35 176.90 1y7h n ARG 53 N 6.04 0.63 -4.48 1.70 1.74 -1.26 -5.04 116.66 115.98 1y7h n ARG 53 Ca -0.01 0.21 -0.27 0.00 -0.77 0.00 0.00 57.85 57.02 1y7h n ARG 53 Cb 0.49 -1.52 -0.10 0.00 -1.02 0.00 0.00 32.46 30.30 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 -2.51 2.11 0.37 0.55 -4.23 -1.26 -4.80 115.64 105.87 1y7h s THR 54 Ca -0.36 -1.93 0.31 0.00 -1.18 0.00 0.00 61.69 58.53 1y7h s THR 54 Cb 0.11 -2.97 0.33 0.00 1.34 0.00 0.00 72.50 71.31 1y7h s THR 54 CO 0.56 -0.02 2.08 0.25 -0.54 0.00 0.00 174.62 176.96 1y7h h LEU 55 N 1.70 0.00 -0.33 4.79 5.85 -1.96 -2.30 115.31 123.05 1y7h h LEU 55 Ca -0.44 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.10 1y7h h LEU 55 Cb 1.24 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 1y7h h LEU 55 CO 0.77 0.08 -0.84 0.22 -0.34 0.00 0.00 178.44 178.33 1y7h h TYR 56 N 0.00 0.12 0.00 1.25 5.03 -1.97 -2.42 116.97 118.98 1y7h h TYR 56 Ca -0.00 -0.07 -0.08 0.00 2.58 0.00 0.00 58.73 61.17 1y7h h TYR 56 Cb 0.35 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.61 1y7h h TYR 56 CO 0.00 0.88 -0.36 -0.44 -1.32 0.00 0.00 178.16 176.92 1y7h h ASP 57 N 0.04 0.00 0.28 -2.11 3.45 -1.82 -1.12 116.42 115.14 1y7h h ASP 57 Ca -0.02 0.00 -0.34 0.00 0.43 0.00 0.00 57.03 57.10 1y7h h ASP 57 Cb 1.47 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 40.25 1y7h h ASP 57 CO 0.12 0.36 -1.62 0.22 -1.57 0.00 0.00 179.24 176.74 1y7h h TYR 58 N 0.00 0.73 -0.01 4.55 3.20 -1.47 -3.34 116.97 120.63 1y7h h TYR 58 Ca -0.00 -0.53 0.00 0.00 3.14 0.00 0.00 58.73 61.33 1y7h h TYR 58 Cb 0.77 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.01 1y7h h TYR 58 CO 0.00 1.58 -0.12 2.41 -1.64 0.00 0.00 178.16 180.39 1y7h n THR 59 N -3.59 0.00 -0.32 1.81 -1.04 -0.92 -2.01 114.28 108.21 1y7h n THR 59 Ca -0.21 -0.12 0.05 0.00 -2.04 0.00 0.00 64.05 61.73 1y7h n THR 59 Cb 1.08 0.17 0.14 0.00 -1.82 0.00 0.00 70.33 69.89 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 1.15 -0.78 -1.49 -4.42 5.85 -1.33 0.83 115.31 115.12 1y7h h LEU 60 Ca 0.00 0.27 0.05 0.00 0.84 0.00 0.00 57.88 59.04 1y7h h LEU 60 Cb 0.41 0.54 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 1y7h h LEU 60 CO 0.00 -0.30 0.40 -0.65 -0.34 0.00 0.00 178.44 177.56 1y7h h PRO 61 N 0.01 0.61 -1.37 5.25 0.11 -1.87 -1.04 132.00 133.69 1y7h h PRO 61 Ca 0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1y7h h PRO 61 Cb 0.71 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1y7h h PRO 61 CO -0.91 0.41 0.00 -0.11 -0.21 0.00 0.00 178.00 177.17 1y7h n LEU 62 N -4.47 2.02 0.00 2.35 7.94 0.28 -2.13 117.00 122.99 1y7h n LEU 62 Ca 0.08 -1.00 0.00 0.00 -1.11 0.00 0.00 56.01 53.98 1y7h n LEU 62 Cb 0.20 -0.34 0.00 0.00 0.53 0.00 0.00 43.42 43.81 1y7h n LEU 62 CO 0.34 0.34 0.00 -0.62 -1.11 0.00 0.00 177.39 176.34 1y7h n GLU 64 N 0.71 0.00 0.00 1.96 1.02 -0.40 -4.56 120.64 119.37 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 0.33 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.75 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 0.20 0.00 -4.62 7.94 -0.91 -1.56 117.00 118.06 1y7h n LEU 65 Ca 0.00 -0.10 0.00 0.00 -1.11 0.00 0.00 56.01 54.80 1y7h n LEU 65 Cb 0.00 -0.10 0.00 0.00 0.53 0.00 0.00 43.42 43.85 1y7h n LEU 65 CO 0.00 0.05 0.00 1.21 -1.11 0.00 0.00 177.39 177.54 1y7h n GLU 67 N 0.19 0.00 0.22 1.96 4.07 -1.26 -1.90 120.64 123.92 1y7h n GLU 67 Ca 0.00 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.22 1y7h n GLU 67 Cb 0.05 0.00 0.29 0.00 -0.06 0.00 0.00 31.44 31.72 1y7h n GLU 67 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1y7h h SER 68 N 0.00 0.00 -3.91 4.31 0.02 -1.68 -3.46 113.55 108.83 1y7h h SER 68 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 1y7h h SER 68 Cb 0.00 0.00 0.14 0.00 0.14 0.00 0.00 62.40 62.68 1y7h h SER 68 CO 0.00 0.08 0.58 0.18 -1.14 0.00 0.00 176.83 176.53 1y7h n LEU 69 N -3.14 5.10 0.00 5.07 4.77 -0.80 -5.01 117.00 123.00 1y7h n LEU 69 Ca 0.03 1.02 -0.07 0.00 -0.03 0.00 0.00 56.01 56.95 1y7h n LEU 69 Cb 0.50 -1.56 0.06 0.00 -2.33 0.00 0.00 43.42 40.09 1y7h n LEU 69 CO 0.33 -0.57 0.15 -1.20 -1.33 0.00 0.00 177.39 174.78 1y7h n SER 70 N -0.61 -1.30 -0.03 -1.43 7.64 -1.26 -4.95 113.62 111.68 1y7h n SER 70 Ca 0.09 -0.65 -0.14 0.00 1.01 0.00 0.00 58.87 59.18 1y7h n SER 70 Cb 0.43 -0.25 -0.10 0.00 -1.01 0.00 0.00 64.21 63.29 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 -2.18 0.06 -0.57 -0.43 0.00 -2.01 -3.30 119.26 110.83 1y7h h ALA 71 Ca -0.10 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 1y7h h ALA 71 Cb 0.31 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1y7h h ALA 71 CO 0.07 -0.05 0.08 -0.40 0.00 0.00 0.00 179.25 178.95 1y7h n ASP 72 N -4.66 5.09 -4.27 0.00 3.85 -1.26 -4.81 116.55 110.50 1y7h n ASP 72 Ca -0.08 -3.07 -0.43 0.00 -0.71 0.00 0.00 54.79 50.50 1y7h n ASP 72 Cb 0.37 -0.68 -0.03 0.00 -1.35 0.00 0.00 41.12 39.43 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 -2.87 3.61 0.17 0.11 2.12 -1.24 -5.05 118.70 115.54 1y7h s GLU 73 Ca 0.53 -2.84 -0.06 0.00 0.36 0.00 0.00 54.97 52.96 1y7h s GLU 73 Cb 0.41 -4.31 -0.06 0.00 0.26 0.00 0.00 34.13 30.44 1y7h s GLU 73 CO 0.14 -1.26 0.43 0.15 -0.54 0.00 0.00 175.26 174.18 1y7h s LYS 74 N -0.55 3.68 0.20 4.30 1.02 -1.26 -4.52 119.74 122.61 1y7h s LYS 74 Ca 0.23 0.04 0.03 0.00 0.02 0.00 0.00 55.97 56.29 1y7h s LYS 74 Cb -0.11 -2.79 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 1y7h s LYS 74 CO -0.08 0.42 -0.02 0.14 -0.92 0.00 0.00 175.35 174.89 1y7h s VAL 75 N -1.70 0.94 -0.33 3.17 -7.23 -1.14 -4.27 120.40 109.83 1y7h s VAL 75 Ca 0.43 -2.02 -0.10 0.00 -1.81 0.00 0.00 61.98 58.48 1y7h s VAL 75 Cb -0.12 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.63 1y7h s VAL 75 CO 0.23 -0.43 0.16 -0.63 -0.31 0.00 0.00 175.10 174.12 1y7h s ILE 76 N -3.48 4.50 0.29 -0.62 1.01 0.15 -1.95 121.20 121.10 1y7h s ILE 76 Ca 0.25 -0.62 -0.25 0.00 0.00 0.00 0.00 60.65 60.03 1y7h s ILE 76 Cb 0.05 -3.38 -0.09 0.00 0.01 0.00 0.00 42.46 39.04 1y7h s ILE 76 CO 0.06 -0.05 0.90 -0.76 0.00 0.00 0.00 174.94 175.09 1y7h s LEU 77 N 1.57 4.37 -0.23 2.97 1.43 -1.11 -1.65 118.68 126.04 1y7h s LEU 77 Ca 0.03 1.76 -0.02 0.00 -1.03 0.00 0.00 54.13 54.87 1y7h s LEU 77 Cb -0.18 -3.88 0.07 0.00 0.03 0.00 0.00 46.19 42.23 1y7h s LEU 77 CO 0.06 -0.02 0.05 -0.69 0.23 0.00 0.00 176.35 175.98 1y7h s VAL 78 N -1.55 0.59 -0.23 -1.59 1.01 -0.16 -0.94 120.40 117.53 1y7h s VAL 78 Ca 0.48 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.62 1y7h s VAL 78 Cb -0.19 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 1y7h s VAL 78 CO 0.24 -0.34 0.06 -0.83 0.00 0.00 0.00 175.10 174.24 1y7h s GLY 79 N 1.81 1.79 -0.17 4.51 0.00 0.33 0.42 107.32 116.01 1y7h s GLY 79 Ca 0.02 -1.04 -0.06 0.00 0.00 0.00 0.00 44.72 43.64 1y7h s GLY 79 CO -0.13 0.40 0.04 -1.58 0.00 0.00 0.00 173.10 171.83 1y7h s HIS 80 N 1.30 3.22 0.00 1.90 2.46 -0.21 -0.15 115.29 123.81 1y7h s HIS 80 Ca 0.05 0.04 0.00 0.00 0.47 0.00 0.00 55.06 55.62 1y7h s HIS 80 Cb -0.15 -2.02 0.00 0.00 -0.13 0.00 0.00 32.58 30.28 1y7h s HIS 80 CO 0.03 0.18 0.00 0.45 -2.47 0.00 0.00 174.74 172.93 1y7h n SER 81 N 3.34 0.00 0.10 9.88 2.88 -1.05 0.42 113.62 129.20 1y7h n SER 81 Ca -0.17 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.48 1y7h n SER 81 Cb 0.52 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 64.44 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 0.55 0.05 2.46 7.94 -1.26 -0.52 117.00 126.23 1y7h n LEU 82 Ca 0.00 0.63 0.19 0.00 -1.11 0.00 0.00 56.01 55.72 1y7h n LEU 82 Cb 0.00 -0.54 0.70 0.00 0.53 0.00 0.00 43.42 44.11 1y7h n LEU 82 CO 0.00 -0.47 1.17 1.23 -1.11 0.00 0.00 177.39 178.21 1y7h h GLY 83 N 2.49 0.00 -2.08 -3.96 0.00 -0.11 -3.23 103.07 96.18 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 -1.60 0.00 1.26 4.60 0.00 -1.08 -0.84 105.19 107.53 1y7h n GLY 84 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 0.96 0.00 0.14 1.61 4.13 -1.22 -2.51 115.26 118.37 1y7h n ASN 86 Ca 0.00 0.00 0.19 0.00 1.68 0.00 0.00 54.58 56.45 1y7h n ASN 86 Cb 0.00 0.00 0.78 0.00 -1.54 0.00 0.00 39.78 39.02 1y7h n ASN 86 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1y7h h LEU 87 N 0.00 0.00 0.47 3.41 4.07 -1.32 -2.71 115.31 119.23 1y7h h LEU 87 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 1y7h h LEU 87 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1y7h h LEU 87 CO 0.00 0.00 -0.22 1.23 -1.08 0.00 0.00 178.44 178.37 1y7h h GLY 88 N 0.00 -0.65 0.17 0.83 0.00 -1.76 -3.21 103.07 98.45 1y7h h GLY 88 Ca 0.15 0.24 0.18 0.00 0.00 0.00 0.00 47.33 47.90 1y7h h GLY 88 CO -0.00 -0.24 0.61 1.41 0.00 0.00 0.00 176.54 178.32 1y7h h LEU 89 N -0.95 0.79 -1.42 3.11 4.07 -1.82 0.31 115.31 119.41 1y7h h LEU 89 Ca -0.06 0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1y7h h LEU 89 Cb 0.58 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1y7h h LEU 89 CO 0.11 0.30 0.00 0.00 -1.08 0.00 0.00 178.44 177.77 1y7h n ALA 90 N -2.34 1.74 0.00 1.53 0.00 -1.21 -0.64 120.51 119.59 1y7h n ALA 90 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1y7h n ALA 90 Cb 0.54 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 0.50 0.00 -0.00 0.00 4.07 0.11 -0.49 120.64 124.83 1y7h n GLU 92 Ca 0.00 0.00 -0.13 0.00 -0.06 0.00 0.00 57.16 56.97 1y7h n GLU 92 Cb 0.14 0.00 -0.10 0.00 -0.06 0.00 0.00 31.44 31.43 1y7h n GLU 92 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1y7h h LYS 93 N 0.00 -0.05 -2.27 5.31 1.63 -1.12 -3.39 116.57 116.67 1y7h h LYS 93 Ca 0.00 0.00 -0.62 0.00 -0.85 0.00 0.00 60.65 59.19 1y7h h LYS 93 Cb 0.00 0.01 -0.41 0.00 -0.60 0.00 0.00 32.23 31.24 1y7h h LYS 93 CO 0.00 0.48 -0.47 0.66 -3.45 0.00 0.00 179.45 176.68 1y7h n TYR 94 N -4.85 3.74 0.01 1.91 4.01 0.36 -4.88 117.16 117.46 1y7h n TYR 94 Ca -0.09 -3.93 -0.08 0.00 -0.16 0.00 0.00 57.90 53.65 1y7h n TYR 94 Cb 0.28 -0.59 0.09 0.00 -0.31 0.00 0.00 39.34 38.81 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 3.68 0.53 0.00 -0.72 0.13 -1.76 -3.03 132.00 130.84 1y7h h PRO 95 Ca 0.18 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1y7h h PRO 95 Cb 0.57 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.71 1y7h h PRO 95 CO 0.87 0.89 0.00 0.00 -0.23 0.00 0.00 178.00 179.53 1y7h n GLN 96 N -4.00 0.58 -0.99 0.86 0.00 -1.26 -3.10 117.38 109.47 1y7h n GLN 96 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 57.00 57.00 1y7h n GLN 96 Cb 0.55 -1.29 0.15 0.00 0.00 0.00 0.00 30.24 29.65 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 -0.79 1.56 -3.66 2.61 5.02 -1.14 -5.00 118.16 116.75 1y7h n LYS 97 Ca 0.08 -3.19 -0.21 0.00 -2.02 0.00 0.00 58.31 52.97 1y7h n LYS 97 Cb 0.04 -1.42 -0.18 0.00 -0.02 0.00 0.00 35.03 33.45 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 -2.86 -0.10 0.38 -0.18 1.01 -1.18 -2.88 121.20 115.40 1y7h s ILE 98 Ca 0.39 0.31 0.08 0.00 0.00 0.00 0.00 60.65 61.42 1y7h s ILE 98 Cb 0.38 -0.24 0.19 0.00 0.01 0.00 0.00 42.46 42.80 1y7h s ILE 98 CO -0.07 0.09 1.95 1.88 0.00 0.00 0.00 174.94 178.79 1y7h h TYR 99 N 8.43 0.39 0.00 3.97 -1.99 -1.73 -3.46 116.97 122.58 1y7h h TYR 99 Ca -0.13 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.58 1y7h h TYR 99 Cb 1.13 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 39.74 1y7h h TYR 99 CO 0.41 0.39 0.00 0.00 -0.00 0.00 0.00 178.16 178.96 1y7h n ALA 100 N -2.49 0.00 -2.89 3.88 0.00 -1.26 -4.61 120.51 113.14 1y7h n ALA 100 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.11 1y7h n ALA 100 Cb 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.53 1y7h n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y7h s ALA 101 N -2.00 3.06 -0.29 0.00 0.00 0.10 -2.76 121.76 119.87 1y7h s ALA 101 Ca 0.00 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 1y7h s ALA 101 Cb 0.00 -1.55 0.03 0.00 0.00 0.00 0.00 23.12 21.59 1y7h s ALA 101 CO 0.00 0.27 0.02 0.08 0.00 0.00 0.00 175.76 176.14 1y7h s VAL 102 N 0.16 3.41 -0.79 0.00 1.01 -0.12 0.44 120.40 124.52 1y7h s VAL 102 Ca -0.01 -0.99 -0.16 0.00 0.00 0.00 0.00 61.98 60.82 1y7h s VAL 102 Cb -0.14 -2.81 0.18 0.00 0.00 0.00 0.00 36.38 33.61 1y7h s VAL 102 CO 0.03 0.05 0.80 -0.36 0.00 0.00 0.00 175.10 175.62 1y7h s PHE 103 N 1.38 3.47 -0.81 5.22 0.40 0.35 0.12 117.98 128.12 1y7h s PHE 103 Ca -0.00 -1.65 -0.26 0.00 -0.60 0.00 0.00 56.93 54.42 1y7h s PHE 103 Cb -0.18 -3.94 0.02 0.00 0.51 0.00 0.00 43.02 39.43 1y7h s PHE 103 CO -0.00 -1.14 1.50 -1.17 0.70 0.00 0.00 175.22 175.11 1y7h s LEU 104 N 1.18 3.27 -1.47 -0.37 2.96 0.79 -2.36 118.68 122.69 1y7h s LEU 104 Ca 0.18 -0.60 -0.06 0.00 -0.22 0.00 0.00 54.13 53.44 1y7h s LEU 104 Cb -0.13 -2.56 0.01 0.00 0.50 0.00 0.00 46.19 44.01 1y7h s LEU 104 CO -0.06 -1.95 0.19 0.00 -1.32 0.00 0.00 176.35 173.21 1y7h n ALA 105 N 10.37 -2.11 -2.53 5.97 0.00 -0.49 -2.53 120.51 129.19 1y7h n ALA 105 Ca 0.18 -0.42 -0.29 0.00 0.00 0.00 0.00 53.44 52.92 1y7h n ALA 105 Cb 0.50 -1.24 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 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 -4.17 4.21 0.67 0.00 0.00 -1.25 -2.96 121.76 118.26 1y7h s ALA 106 Ca 0.08 -1.04 -0.00 0.00 0.00 0.00 0.00 51.96 51.00 1y7h s ALA 106 Cb -0.04 -0.41 0.10 0.00 0.00 0.00 0.00 23.12 22.77 1y7h s ALA 106 CO 0.97 -0.25 0.93 -0.06 0.00 0.00 0.00 175.76 177.35 1y7h s PHE 107 N -2.79 1.94 0.36 0.00 2.99 0.32 -4.84 117.98 115.97 1y7h s PHE 107 Ca 0.24 -0.20 -0.06 0.00 0.00 0.00 0.00 56.93 56.92 1y7h s PHE 107 Cb -0.00 -2.91 0.02 0.00 0.00 0.00 0.00 43.02 40.12 1y7h s PHE 107 CO 0.15 -1.47 0.56 -1.25 -0.00 0.00 0.00 175.22 173.20 1y7h s PRO 109 N -5.04 2.01 0.22 0.24 0.04 -1.26 -4.14 135.00 127.07 1y7h s PRO 109 Ca 0.64 -1.69 -0.01 0.00 0.04 0.00 0.00 61.00 59.98 1y7h s PRO 109 Cb -0.07 0.49 -0.04 0.00 0.04 0.00 0.00 34.50 34.93 1y7h s PRO 109 CO 0.43 -0.86 0.17 0.16 0.04 0.00 0.00 177.00 176.93 1y7h s ASP 110 N -3.20 0.27 -0.61 6.66 1.47 -1.26 -5.04 116.67 114.95 1y7h s ASP 110 Ca 0.27 -1.39 0.01 0.00 1.18 0.00 0.00 52.55 52.62 1y7h s ASP 110 Cb -0.02 0.41 0.41 0.00 -0.34 0.00 0.00 42.92 43.39 1y7h s ASP 110 CO 0.18 -0.88 1.69 -1.54 0.68 0.00 0.00 175.17 175.30 1y7h n SER 111 N -0.39 6.52 0.00 2.11 3.41 -1.26 -4.47 113.62 119.54 1y7h n SER 111 Ca 0.02 -3.78 0.00 0.00 -0.26 0.00 0.00 58.87 54.85 1y7h n SER 111 Cb 0.65 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 1y7h n SER 111 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1y7h n VAL 112 N -0.66 0.00 -4.16 -3.33 0.31 -1.26 -4.42 118.33 104.81 1y7h n VAL 112 Ca 0.51 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.66 1y7h n VAL 112 Cb 0.57 -0.39 -0.02 0.00 -0.91 0.00 0.00 33.84 33.09 1y7h n VAL 112 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1y7h n HIS 113 N -1.34 0.03 -0.89 3.52 8.25 -1.26 -5.11 115.22 118.42 1y7h n HIS 113 Ca 0.00 -1.49 -0.31 0.00 -0.26 0.00 0.00 57.72 55.66 1y7h n HIS 113 Cb 0.22 -0.23 0.14 0.00 1.12 0.00 0.00 29.99 31.24 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 -2.82 3.46 0.60 0.41 0.02 -1.26 -4.89 114.94 110.46 1y7h s ASN 114 Ca 0.08 2.07 0.37 0.00 -1.02 0.00 0.00 52.86 54.35 1y7h s ASN 114 Cb -0.01 -2.55 1.90 0.00 0.02 0.00 0.00 41.25 40.61 1y7h s ASN 114 CO 0.05 -2.74 2.20 0.28 0.02 0.00 0.00 177.10 176.91 1y7h h SER 115 N -1.62 0.00 -0.57 -1.22 0.02 -1.60 -2.12 113.55 106.44 1y7h h SER 115 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1y7h h SER 115 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1y7h h SER 115 CO 0.45 0.03 0.00 -1.54 -1.14 0.00 0.00 176.83 174.63 1y7h n SER 116 N -3.30 3.51 0.08 3.07 3.41 -1.20 -4.63 113.62 114.55 1y7h n SER 116 Ca -0.02 -2.15 -0.08 0.00 -0.26 0.00 0.00 58.87 56.36 1y7h n SER 116 Cb 0.16 -0.45 -0.05 0.00 -0.26 0.00 0.00 64.21 63.62 1y7h n SER 116 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1y7h h PHE 117 N 3.42 -0.73 -0.99 7.33 3.57 -1.73 -1.67 116.94 126.13 1y7h h PHE 117 Ca 0.00 0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.71 1y7h h PHE 117 Cb 0.98 0.30 -0.10 0.00 2.79 0.00 0.00 35.95 39.92 1y7h h PHE 117 CO 0.50 -0.30 0.61 -0.39 -2.23 0.00 0.00 178.31 176.50 1y7h h VAL 118 N -0.40 0.69 -0.37 1.41 -1.51 -1.84 -1.47 116.25 112.76 1y7h h VAL 118 Ca -0.01 -0.24 -0.12 0.00 -1.23 0.00 0.00 66.70 65.11 1y7h h VAL 118 Cb 0.39 -0.05 -0.01 0.00 -2.13 0.00 0.00 31.29 29.48 1y7h h VAL 118 CO -0.11 0.13 -0.22 -0.07 -1.23 0.00 0.00 177.57 176.06 1y7h h LEU 119 N 0.69 0.84 -0.48 4.19 3.38 -1.86 -1.52 115.31 120.54 1y7h h LEU 119 Ca 0.56 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1y7h h LEU 119 Cb 0.98 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 1y7h h LEU 119 CO -0.34 1.08 0.29 -0.33 0.09 0.00 0.00 178.44 179.23 1y7h h GLU 120 N 0.60 0.57 -0.41 1.13 5.08 -0.32 0.67 114.58 121.89 1y7h h GLU 120 Ca 0.08 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1y7h h GLU 120 Cb 0.78 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1y7h h GLU 120 CO 0.06 0.38 0.16 1.96 -1.00 0.00 0.00 179.01 180.57 1y7h h GLN 121 N 0.58 0.59 -0.38 2.33 1.08 -1.18 -0.59 115.11 117.55 1y7h h GLN 121 Ca 0.19 -0.08 -0.08 0.00 -1.45 0.00 0.00 58.65 57.23 1y7h h GLN 121 Cb -0.00 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 1y7h h GLN 121 CO -0.08 0.49 -0.08 -0.92 -0.95 0.00 0.00 178.83 177.30 1y7h h TYR 122 N 0.58 0.80 -0.59 2.96 3.20 -0.41 -2.91 116.97 120.61 1y7h h TYR 122 Ca 0.14 -0.17 -0.05 0.00 3.14 0.00 0.00 58.73 61.80 1y7h h TYR 122 Cb 0.13 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 1y7h h TYR 122 CO 0.01 0.85 0.18 -0.91 -1.64 0.00 0.00 178.16 176.65 1y7h h ASN 123 N 0.52 0.86 0.49 -2.11 4.21 0.07 -2.13 115.58 117.50 1y7h h ASN 123 Ca 0.10 -0.21 0.00 0.00 1.21 0.00 0.00 56.30 57.40 1y7h h ASN 123 Cb 0.59 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.56 1y7h h ASN 123 CO 0.03 0.84 0.00 -0.62 -1.29 0.00 0.00 177.43 176.40 1y7h n GLU 124 N -4.41 0.09 -0.18 0.81 1.02 -0.32 -2.32 120.64 115.34 1y7h n GLU 124 Ca 0.03 0.39 0.07 0.00 -0.02 0.00 0.00 57.16 57.63 1y7h n GLU 124 Cb 0.21 -1.70 0.15 0.00 -0.02 0.00 0.00 31.44 30.08 1y7h n GLU 124 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1y7h n ARG 125 N -1.88 2.32 -3.43 3.49 1.74 -0.85 -4.93 116.66 113.13 1y7h n ARG 125 Ca 0.02 -2.35 -0.16 0.00 -0.77 0.00 0.00 57.85 54.58 1y7h n ARG 125 Cb 0.16 -1.46 -0.11 0.00 -1.02 0.00 0.00 32.46 30.04 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 -2.21 -0.40 0.45 0.55 2.01 -0.93 -5.03 115.64 110.07 1y7h s THR 126 Ca 0.27 -0.26 -0.25 0.00 0.31 0.00 0.00 61.69 61.76 1y7h s THR 126 Cb 0.22 -0.83 -0.08 0.00 0.01 0.00 0.00 72.50 71.82 1y7h s THR 126 CO 0.06 -0.30 1.36 -2.16 -0.69 0.00 0.00 174.62 172.89 1y7h s PRO 127 N 2.38 3.73 0.42 4.92 0.04 -1.26 -4.82 135.00 140.41 1y7h s PRO 127 Ca 0.09 2.27 0.29 0.00 0.04 0.00 0.00 61.00 63.68 1y7h s PRO 127 Cb -0.15 -2.63 1.42 0.00 0.04 0.00 0.00 34.50 33.17 1y7h s PRO 127 CO -0.21 -0.73 1.61 0.00 0.04 0.00 0.00 177.00 177.71 1y7h h ALA 128 N 2.34 2.64 -0.07 8.56 0.00 -2.01 0.46 119.26 131.18 1y7h h ALA 128 Ca -0.50 0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.57 1y7h h ALA 128 Cb 1.26 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.28 1y7h h ALA 128 CO 0.61 -1.32 0.06 1.05 0.00 0.00 0.00 179.25 179.65 1y7h h GLU 129 N 0.06 0.00 0.00 0.00 4.11 -1.95 -1.91 114.58 114.89 1y7h h GLU 129 Ca 0.84 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 60.26 1y7h h GLU 129 Cb 2.56 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.81 1y7h h GLU 129 CO -0.49 0.00 -0.02 -0.91 0.07 0.00 0.00 179.01 177.65 1y7h h ASN 130 N 0.00 0.00 0.10 3.06 -0.26 -1.25 -1.69 115.58 115.54 1y7h h ASN 130 Ca 0.03 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.77 1y7h h ASN 130 Cb 0.14 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.40 1y7h h ASN 130 CO -0.00 0.02 -0.00 0.79 -1.06 0.00 0.00 177.43 177.18 1y7h n TRP 131 N -3.30 0.00 0.00 1.19 7.02 -0.72 -4.95 117.44 116.68 1y7h n TRP 131 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1y7h n TRP 131 Cb 0.15 -0.05 0.00 0.00 -2.42 0.00 0.00 31.31 28.99 1y7h n TRP 131 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1y7h n LEU 132 N -1.01 0.00 -0.99 -0.99 4.77 -0.64 -0.49 117.00 117.65 1y7h n LEU 132 Ca 0.22 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.27 1y7h n LEU 132 Cb 0.14 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.45 1y7h n LEU 132 CO 0.19 0.00 0.67 -0.90 -1.33 0.00 0.00 177.39 176.02 1y7h n ASP 133 N 2.56 2.88 -4.72 -1.43 3.85 -1.26 -4.96 116.55 113.47 1y7h n ASP 133 Ca 0.00 -2.15 -0.40 0.00 -0.71 0.00 0.00 54.79 51.54 1y7h n ASP 133 Cb 0.00 -0.39 0.03 0.00 -1.35 0.00 0.00 41.12 39.41 1y7h n ASP 133 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 1y7h n THR 134 N 0.75 3.16 -3.67 2.12 -1.04 0.36 -4.17 114.28 111.79 1y7h n THR 134 Ca 0.16 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.05 61.30 1y7h n THR 134 Cb 0.51 -1.60 -0.11 0.00 -1.82 0.00 0.00 70.33 67.31 1y7h n THR 134 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1y7h s GLN 135 N -2.53 3.85 -0.30 -2.82 -1.52 0.25 -4.90 119.66 111.68 1y7h s GLN 135 Ca 0.66 -0.37 -0.02 0.00 -1.95 0.00 0.00 55.36 53.68 1y7h s GLN 135 Cb -0.46 -3.52 0.05 0.00 -0.22 0.00 0.00 33.01 28.87 1y7h s GLN 135 CO 0.54 -0.15 0.01 -0.06 -0.25 0.00 0.00 175.29 175.37 1y7h s PHE 136 N 1.62 3.28 0.06 0.91 0.08 -1.26 -0.40 117.98 122.27 1y7h s PHE 136 Ca 0.07 -1.88 0.06 0.00 0.12 0.00 0.00 56.93 55.30 1y7h s PHE 136 Cb -0.15 -2.15 -0.03 0.00 -0.57 0.00 0.00 43.02 40.12 1y7h s PHE 136 CO 0.08 -0.81 -0.17 -0.51 -0.10 0.00 0.00 175.22 173.71 1y7h s LEU 137 N 1.25 2.22 0.36 -0.37 1.43 -0.40 -4.95 118.68 118.22 1y7h s LEU 137 Ca -0.05 -0.55 -0.22 0.00 -1.03 0.00 0.00 54.13 52.29 1y7h s LEU 137 Cb -0.20 -0.71 -0.10 0.00 0.03 0.00 0.00 46.19 45.21 1y7h s LEU 137 CO -0.01 0.04 0.89 -2.16 0.23 0.00 0.00 176.35 175.34 1y7h s PRO 138 N -1.43 4.31 0.00 1.29 0.04 -1.26 -0.07 135.00 137.88 1y7h s PRO 138 Ca 0.03 1.09 0.04 0.00 0.04 0.00 0.00 61.00 62.19 1y7h s PRO 138 Cb -0.09 -2.49 0.06 0.00 0.04 0.00 0.00 34.50 32.02 1y7h s PRO 138 CO 0.02 0.14 0.86 2.48 0.04 0.00 0.00 177.00 180.54 1y7h n TYR 139 N -0.07 0.00 -3.03 0.56 4.11 0.38 -4.89 117.16 114.23 1y7h n TYR 139 Ca 0.04 -0.12 0.00 0.00 -0.00 0.00 0.00 57.90 57.82 1y7h n TYR 139 Cb 0.52 0.10 0.00 0.00 -0.00 0.00 0.00 39.34 39.96 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 0.07 3.66 4.02 -7.48 0.00 -1.20 -4.75 105.19 99.51 1y7h n GLY 140 Ca -0.02 -2.11 -0.20 0.00 0.00 0.00 0.00 46.02 43.69 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 -0.61 5.03 0.24 1.61 1.04 0.11 -4.79 113.70 116.33 1y7h s SER 141 Ca 0.00 -0.67 -0.05 0.00 0.48 0.00 0.00 55.95 55.71 1y7h s SER 141 Cb 0.00 0.08 0.25 0.00 0.10 0.00 0.00 66.02 66.45 1y7h s SER 141 CO 0.00 -1.36 1.78 1.55 0.98 0.00 0.00 173.24 176.19 1y7h h PRO 142 N 0.10 1.02 0.00 4.02 0.13 -2.01 -3.01 132.00 132.24 1y7h h PRO 142 Ca -0.33 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 1y7h h PRO 142 Cb 1.28 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1y7h h PRO 142 CO 0.41 0.88 -1.21 -0.85 -0.23 0.00 0.00 178.00 177.01 1y7h n GLU 143 N -4.26 0.39 -3.63 0.86 0.28 -1.26 -4.58 120.64 108.44 1y7h n GLU 143 Ca 0.05 -0.02 -0.27 0.00 -0.16 0.00 0.00 57.16 56.76 1y7h n GLU 143 Cb 0.23 -1.61 -0.10 0.00 1.43 0.00 0.00 31.44 31.39 1y7h n GLU 143 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1y7h n GLU 144 N -2.10 1.73 -2.00 3.44 2.13 -1.15 -5.11 120.64 117.59 1y7h n GLU 144 Ca 0.01 -4.27 -0.41 0.00 0.66 0.00 0.00 57.16 53.15 1y7h n GLU 144 Cb 0.47 -2.11 -0.02 0.00 0.27 0.00 0.00 31.44 30.05 1y7h n GLU 144 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1y7h s PRO 145 N -1.55 4.26 -0.04 5.31 0.04 -1.17 0.06 135.00 141.91 1y7h s PRO 145 Ca 0.31 2.32 -0.01 0.00 0.04 0.00 0.00 61.00 63.66 1y7h s PRO 145 Cb 0.04 -3.10 0.03 0.00 0.04 0.00 0.00 34.50 31.51 1y7h s PRO 145 CO -0.12 -0.43 0.04 -0.51 0.04 0.00 0.00 177.00 176.01 1y7h s LEU 146 N -0.43 0.49 -0.14 -3.56 1.43 -1.26 -4.83 118.68 110.38 1y7h s LEU 146 Ca 0.59 0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.70 1y7h s LEU 146 Cb -0.42 -0.19 -0.02 0.00 0.03 0.00 0.00 46.19 45.58 1y7h s LEU 146 CO 0.44 -0.20 -0.07 -0.89 0.23 0.00 0.00 176.35 175.85 1y7h s THR 147 N 1.83 3.60 0.00 5.49 2.01 -1.26 0.15 115.64 127.44 1y7h s THR 147 Ca 0.01 -0.47 0.00 0.00 0.31 0.00 0.00 61.69 61.54 1y7h s THR 147 Cb -0.12 -2.55 0.00 0.00 0.01 0.00 0.00 72.50 69.84 1y7h s THR 147 CO -0.03 0.51 0.00 -1.54 -0.69 0.00 0.00 174.62 172.87 1y7h n SER 148 N 3.42 0.63 0.00 3.53 3.41 0.90 -4.50 113.62 121.01 1y7h n SER 148 Ca -0.18 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 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 -0.58 0.00 -1.63 7.33 7.35 0.46 -1.27 117.46 129.12 1y7h n PHE 150 Ca 0.00 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.26 1y7h n PHE 150 Cb 0.00 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 39.82 1y7h n PHE 150 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1y7h n PHE 151 N 0.00 1.66 -3.55 -5.13 3.72 -1.26 -0.59 117.46 112.31 1y7h n PHE 151 Ca 0.00 0.63 -0.19 0.00 -0.05 0.00 0.00 57.45 57.84 1y7h n PHE 151 Cb 0.00 -2.31 -0.01 0.00 -0.94 0.00 0.00 39.48 36.22 1y7h n PHE 151 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1y7h s GLY 152 N -0.48 1.53 0.33 1.37 0.00 -1.26 -4.82 107.32 104.00 1y7h s GLY 152 Ca 0.58 -1.42 0.02 0.00 0.00 0.00 0.00 44.72 43.89 1y7h s GLY 152 CO 0.61 -1.36 1.92 -0.56 0.00 0.00 0.00 173.10 173.72 1y7h h PRO 153 N 0.94 0.75 -0.16 2.90 0.13 -1.95 -1.11 132.00 133.51 1y7h h PRO 153 Ca -0.47 -0.10 -0.08 0.00 -0.87 0.00 0.00 66.00 64.48 1y7h h PRO 153 Cb 1.25 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1y7h h PRO 153 CO 0.54 0.60 -0.22 0.87 -0.23 0.00 0.00 178.00 179.56 1y7h h LYS 154 N 0.75 0.43 0.00 0.86 1.79 -1.96 -1.64 116.57 116.80 1y7h h LYS 154 Ca 0.18 -0.25 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1y7h h LYS 154 Cb 0.12 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1y7h h LYS 154 CO -0.02 0.84 0.00 0.34 -1.08 0.00 0.00 179.45 179.53 1y7h n PHE 155 N -4.46 0.10 0.01 -1.35 -0.00 -1.12 -1.19 117.46 109.45 1y7h n PHE 155 Ca -0.06 0.04 -0.21 0.00 -0.00 0.00 0.00 57.45 57.21 1y7h n PHE 155 Cb 0.42 -0.56 -0.14 0.00 -0.00 0.00 0.00 39.48 39.20 1y7h n PHE 155 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1y7h h LEU 156 N 0.00 0.43 0.00 -2.13 5.85 -0.88 -3.25 115.31 115.32 1y7h h LEU 156 Ca 0.00 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 57.80 1y7h h LEU 156 Cb 0.28 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1y7h h LEU 156 CO 0.00 1.82 -0.89 0.00 -0.34 0.00 0.00 178.44 179.02 1y7h h ALA 157 N 0.12 0.53 0.00 1.25 0.00 -1.03 -1.59 119.26 118.54 1y7h h ALA 157 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1y7h h ALA 157 Cb 2.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.83 1y7h h ALA 157 CO 0.10 0.00 -1.25 0.72 0.00 0.00 0.00 179.25 178.82 1y7h n HIS 158 N -2.56 0.00 0.00 0.00 8.25 -0.34 -3.21 115.22 117.36 1y7h n HIS 158 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1y7h n HIS 158 Cb 0.52 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.46 1y7h n HIS 158 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1y7h n LYS 159 N -1.71 4.74 0.00 -0.41 4.76 -1.23 -4.77 118.16 119.54 1y7h n LYS 159 Ca 0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 1y7h n LYS 159 Cb 0.36 -0.38 0.00 0.00 -1.84 0.00 0.00 35.03 33.17 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 -0.73 1.79 -0.82 -0.35 4.77 -1.19 -1.22 117.00 119.25 1y7h n LEU 160 Ca 0.00 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.05 1y7h n LEU 160 Cb 0.00 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.30 1y7h n LEU 160 CO 0.00 0.27 0.67 -1.22 -1.33 0.00 0.00 177.39 175.79 1y7h n TYR 161 N -2.34 0.72 -0.24 -1.77 4.02 -0.60 -3.53 117.16 113.42 1y7h n TYR 161 Ca 0.00 -0.64 0.24 0.00 -0.01 0.00 0.00 57.90 57.49 1y7h n TYR 161 Cb 0.36 -0.14 0.59 0.00 -0.02 0.00 0.00 39.34 40.13 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 2.16 0.25 -0.61 -0.72 -0.00 -1.78 0.59 115.11 114.99 1y7h h GLN 162 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1y7h h GLN 162 Cb 1.04 -0.06 0.00 0.00 -0.00 0.00 0.00 27.48 28.46 1y7h h GLN 162 CO 0.10 0.16 0.00 1.28 -0.00 0.00 0.00 178.83 180.37 1y7h n LEU 163 N -4.44 3.78 -4.97 0.06 4.77 -1.26 -4.95 117.00 109.99 1y7h n LEU 163 Ca 0.21 -1.84 -0.22 0.00 -0.03 0.00 0.00 56.01 54.13 1y7h n LEU 163 Cb 0.85 -0.41 0.03 0.00 -2.33 0.00 0.00 43.42 41.56 1y7h n LEU 163 CO 0.33 0.91 0.33 0.00 -1.33 0.00 0.00 177.39 177.62 1y7h s SER 165 N -4.34 6.12 0.39 0.00 1.04 -1.26 -4.93 113.70 110.72 1y7h s SER 165 Ca 0.54 1.37 0.11 0.00 0.48 0.00 0.00 55.95 58.45 1y7h s SER 165 Cb -0.10 -2.39 0.78 0.00 0.10 0.00 0.00 66.02 64.41 1y7h s SER 165 CO 0.38 -0.93 1.89 1.55 0.98 0.00 0.00 173.24 177.10 1y7h h PRO 166 N -0.36 0.12 0.25 4.02 0.13 -1.98 -1.58 132.00 132.60 1y7h h PRO 166 Ca -0.44 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1y7h h PRO 166 Cb 1.20 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1y7h h PRO 166 CO 0.62 0.36 -0.12 0.93 -0.23 0.00 0.00 178.00 179.56 1y7h h GLU 167 N 0.11 -0.33 0.00 0.86 3.07 -1.99 0.41 114.58 116.72 1y7h h GLU 167 Ca 0.02 0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.89 1y7h h GLU 167 Cb 0.49 0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1y7h h GLU 167 CO 0.03 -0.20 -0.07 -0.44 -1.40 0.00 0.00 179.01 176.93 1y7h h ASP 168 N -0.35 0.00 0.08 1.42 3.45 -1.88 0.00 116.42 119.13 1y7h h ASP 168 Ca -0.03 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.42 1y7h h ASP 168 Cb 0.27 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.04 1y7h h ASP 168 CO 0.06 0.07 -0.04 0.25 -1.57 0.00 0.00 179.24 178.01 1y7h h LEU 169 N 0.00 -0.09 -0.73 1.55 5.85 -0.28 -2.77 115.31 118.85 1y7h h LEU 169 Ca -0.00 -0.48 0.12 0.00 0.84 0.00 0.00 57.88 58.35 1y7h h LEU 169 Cb 0.23 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.20 1y7h h LEU 169 CO 0.01 0.59 0.32 0.00 -0.34 0.00 0.00 178.44 179.02 1y7h h ALA 170 N -0.32 1.01 -0.29 1.25 0.00 0.10 0.51 119.26 121.53 1y7h h ALA 170 Ca -0.01 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1y7h h ALA 170 Cb 0.56 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1y7h h ALA 170 CO 0.02 -0.13 -0.04 1.25 0.00 0.00 0.00 179.25 180.35 1y7h h LEU 171 N 0.52 -0.20 -0.95 0.00 5.85 -1.08 -2.05 115.31 117.40 1y7h h LEU 171 Ca 0.38 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 59.13 1y7h h LEU 171 Cb 0.49 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 1y7h h LEU 171 CO -0.33 -0.06 0.25 0.00 -0.34 0.00 0.00 178.44 177.95 1y7h h ALA 172 N 1.27 1.16 -0.42 1.25 0.00 -0.93 -2.23 119.26 119.37 1y7h h ALA 172 Ca 0.14 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1y7h h ALA 172 Cb 0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1y7h h ALA 172 CO -0.27 0.60 0.28 0.77 0.00 0.00 0.00 179.25 180.63 1y7h h SER 173 N 0.98 0.33 0.36 0.00 0.02 -0.23 -1.08 113.55 113.94 1y7h h SER 173 Ca 0.23 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1y7h h SER 173 Cb 0.22 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1y7h h SER 173 CO -0.02 0.22 -0.46 -1.54 -1.14 0.00 0.00 176.83 173.90 1y7h n SER 174 N -4.48 0.75 -0.00 3.07 3.41 -0.86 -4.32 113.62 111.19 1y7h n SER 174 Ca 0.05 -0.54 0.04 0.00 -0.26 0.00 0.00 58.87 58.16 1y7h n SER 174 Cb 0.20 0.28 -0.07 0.00 -0.26 0.00 0.00 64.21 64.37 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 -1.19 0.06 -4.68 1.04 4.77 -0.76 -5.00 117.00 111.24 1y7h n LEU 175 Ca 0.08 -0.07 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1y7h n LEU 175 Cb 0.34 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.40 1y7h n LEU 175 CO 0.33 0.01 1.52 0.68 -1.33 0.00 0.00 177.39 178.60 1y7h s VAL 176 N -2.50 2.75 0.29 4.08 -7.23 -0.48 -4.77 120.40 112.53 1y7h s VAL 176 Ca -0.02 0.05 0.10 0.00 -1.81 0.00 0.00 61.98 60.30 1y7h s VAL 176 Cb 0.06 -3.03 -0.05 0.00 0.56 0.00 0.00 36.38 33.92 1y7h s VAL 176 CO 0.36 -0.00 -0.07 -0.13 -0.31 0.00 0.00 175.10 174.95 1y7h s ARG 177 N 3.46 2.03 0.38 4.82 0.52 -0.59 -5.02 118.95 124.53 1y7h s ARG 177 Ca 0.84 -1.61 -0.26 0.00 -0.52 0.00 0.00 55.73 54.17 1y7h s ARG 177 Cb -0.44 -1.97 -0.09 0.00 0.52 0.00 0.00 34.95 32.96 1y7h s ARG 177 CO 0.38 0.31 1.22 -1.25 0.02 0.00 0.00 175.30 175.98 1y7h s PRO 178 N -3.62 4.15 0.00 3.54 0.04 -1.26 -4.07 135.00 133.78 1y7h s PRO 178 Ca 0.32 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.33 1y7h s PRO 178 Cb -0.05 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.67 1y7h s PRO 178 CO 0.18 -0.28 0.00 0.45 0.04 0.00 0.00 177.00 177.39 1y7h n SER 179 N 0.34 0.55 -3.54 6.66 2.88 -1.26 -4.73 113.62 114.52 1y7h n SER 179 Ca 0.03 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.39 1y7h n SER 179 Cb 0.45 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.85 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 -0.63 0.10 -3.46 0.15 -1.26 -4.48 113.70 105.13 1y7h s SER 180 Ca 0.00 0.66 0.25 0.00 0.70 0.00 0.00 55.95 57.56 1y7h s SER 180 Cb 0.00 0.52 0.44 0.00 -1.71 0.00 0.00 66.02 65.27 1y7h s SER 180 CO 0.00 -0.60 1.39 0.18 1.20 0.00 0.00 173.24 175.40 1y7h n LEU 181 N 0.91 0.65 -2.63 3.45 4.77 -1.26 -5.02 117.00 117.87 1y7h n LEU 181 Ca -0.19 0.23 -0.04 0.00 -0.03 0.00 0.00 56.01 55.98 1y7h n LEU 181 Cb 0.57 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 1y7h n LEU 181 CO 0.24 -0.03 -0.51 0.49 -1.33 0.00 0.00 177.39 176.25 1y7h n PHE 182 N -2.00 -3.61 0.00 -1.77 3.72 -1.26 -4.87 117.46 107.67 1y7h n PHE 182 Ca 0.04 2.11 0.00 0.00 -0.05 0.00 0.00 57.45 59.55 1y7h n PHE 182 Cb 0.42 -3.29 0.00 0.00 -0.94 0.00 0.00 39.48 35.67 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 1.91 0.00 -0.08 -1.08 4.71 -1.26 -0.34 120.64 124.50 1y7h n GLU 184 Ca -0.28 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 56.76 1y7h n GLU 184 Cb 0.43 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.79 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 0.00 -0.66 1.62 3.58 -1.93 -3.36 116.42 115.67 1y7h h ASP 185 Ca 0.00 -0.33 0.09 0.00 0.42 0.00 0.00 57.03 57.21 1y7h h ASP 185 Cb 0.00 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 1y7h h ASP 185 CO 0.00 1.04 0.44 -0.07 -2.88 0.00 0.00 179.24 177.77 1y7h h LEU 186 N -1.00 0.49 -1.45 2.28 3.38 -1.02 -2.21 115.31 115.78 1y7h h LEU 186 Ca -0.14 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1y7h h LEU 186 Cb 0.82 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1y7h h LEU 186 CO -0.08 0.30 -0.23 0.77 0.09 0.00 0.00 178.44 179.29 1y7h h SER 187 N 0.55 0.00 -0.92 -0.43 4.64 -1.81 -3.09 113.55 112.49 1y7h h SER 187 Ca 0.30 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 61.02 1y7h h SER 187 Cb 0.46 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.17 1y7h h SER 187 CO -0.10 0.23 -0.17 0.29 -0.87 0.00 0.00 176.83 176.21 1y7h n LYS 188 N -3.65 3.26 -3.57 4.77 5.02 -0.84 -4.89 118.16 118.27 1y7h n LYS 188 Ca -0.01 -3.87 -0.14 0.00 -2.02 0.00 0.00 58.31 52.27 1y7h n LYS 188 Cb 0.36 -2.28 -0.06 0.00 -0.02 0.00 0.00 35.03 33.03 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 -3.69 -1.85 -0.54 7.82 0.00 -1.17 -5.03 121.76 117.30 1y7h s ALA 189 Ca 0.56 1.60 0.00 0.00 0.00 0.00 0.00 51.96 54.12 1y7h s ALA 189 Cb 0.44 -0.61 0.14 0.00 0.00 0.00 0.00 23.12 23.09 1y7h s ALA 189 CO -0.01 -0.33 0.32 0.21 0.00 0.00 0.00 175.76 175.95 1y7h s LYS 190 N -0.69 2.20 0.08 0.00 2.47 -1.26 -3.06 119.74 119.49 1y7h s LYS 190 Ca -0.04 -2.45 -0.15 0.00 -1.56 0.00 0.00 55.97 51.77 1y7h s LYS 190 Cb -0.02 -3.52 -0.18 0.00 -1.46 0.00 0.00 37.83 32.66 1y7h s LYS 190 CO 0.04 -1.12 1.26 1.88 0.16 0.00 0.00 175.35 177.57 1y7h h TYR 191 N 6.97 0.95 -2.06 4.03 0.05 -1.94 -3.47 116.97 121.49 1y7h h TYR 191 Ca -0.05 -0.43 -0.53 0.00 0.05 0.00 0.00 58.73 57.76 1y7h h TYR 191 Cb 0.94 -0.14 -0.07 0.00 1.01 0.00 0.00 36.73 38.47 1y7h h TYR 191 CO 0.60 1.25 -0.56 -0.06 -1.05 0.00 0.00 178.16 178.34 1y7h s PHE 192 N -3.66 2.81 0.29 4.88 0.08 -1.26 -4.96 117.98 116.17 1y7h s PHE 192 Ca -0.11 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 56.69 1y7h s PHE 192 Cb 0.07 -1.45 -0.02 0.00 -0.57 0.00 0.00 43.02 41.05 1y7h s PHE 192 CO 0.88 0.46 0.31 0.95 -0.10 0.00 0.00 175.22 177.72 1y7h s THR 193 N -2.31 0.00 0.21 0.64 -4.23 -1.26 -4.76 115.64 103.93 1y7h s THR 193 Ca 0.35 -1.85 0.09 0.00 -1.18 0.00 0.00 61.69 59.10 1y7h s THR 193 Cb -0.05 -2.51 -0.10 0.00 1.34 0.00 0.00 72.50 71.17 1y7h s THR 193 CO 0.23 0.00 1.48 0.44 -0.54 0.00 0.00 174.62 176.22 1y7h h ASP 194 N 2.26 0.00 -0.43 3.99 5.19 -1.95 -0.04 116.42 125.44 1y7h h ASP 194 Ca -0.29 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.03 1y7h h ASP 194 Cb 1.24 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.74 1y7h h ASP 194 CO 0.41 0.77 -0.10 -0.08 -3.12 0.00 0.00 179.24 177.12 1y7h h GLU 195 N 0.00 0.83 0.00 3.56 4.57 -1.97 -3.24 114.58 118.34 1y7h h GLU 195 Ca -0.01 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 1y7h h GLU 195 Cb 1.37 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.91 1y7h h GLU 195 CO 0.10 0.94 0.00 0.54 -1.18 0.00 0.00 179.01 179.41 1y7h n ARG 196 N -4.29 0.00 0.08 1.92 1.74 -1.25 -4.35 116.66 110.51 1y7h n ARG 196 Ca -0.01 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 1y7h n ARG 196 Cb 0.37 -0.35 -0.08 0.00 -1.02 0.00 0.00 32.46 31.38 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 -1.35 0.00 -1.55 3.57 -1.74 -0.90 116.94 114.98 1y7h h PHE 197 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1y7h h PHE 197 Cb 0.00 0.58 0.00 0.00 2.79 0.00 0.00 35.95 39.32 1y7h h PHE 197 CO 0.00 -0.54 0.00 0.41 -2.23 0.00 0.00 178.31 175.95 1y7h n GLY 198 N -1.47 -0.08 1.19 2.40 0.00 -0.05 -1.91 105.19 105.29 1y7h n GLY 198 Ca -0.07 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.04 3.50 -4.43 1.61 3.41 -0.34 -4.88 113.62 111.46 1y7h n SER 199 Ca 0.01 -1.98 -0.35 0.00 -0.26 0.00 0.00 58.87 56.29 1y7h n SER 199 Cb 0.00 -0.36 -0.13 0.00 -0.26 0.00 0.00 64.21 63.47 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 -1.28 3.89 -0.09 -3.33 1.01 -0.80 -5.02 120.40 114.78 1y7h s VAL 200 Ca 0.43 -0.33 -0.36 0.00 0.00 0.00 0.00 61.98 61.71 1y7h s VAL 200 Cb 0.23 -2.76 -0.14 0.00 0.00 0.00 0.00 36.38 33.71 1y7h s VAL 200 CO 0.31 0.42 1.76 0.29 0.00 0.00 0.00 175.10 177.89 1y7h n LYS 201 N 4.32 1.81 -3.72 2.72 5.02 -1.26 -4.77 118.16 122.27 1y7h n LYS 201 Ca -0.17 0.66 -0.37 0.00 -2.02 0.00 0.00 58.31 56.41 1y7h n LYS 201 Cb 0.52 -2.43 -0.10 0.00 -0.02 0.00 0.00 35.03 32.99 1y7h n LYS 201 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1y7h s ARG 202 N 3.20 3.95 -0.08 1.97 0.52 -1.26 -0.72 118.95 126.53 1y7h s ARG 202 Ca 0.92 -0.33 0.02 0.00 -0.52 0.00 0.00 55.73 55.81 1y7h s ARG 202 Cb -0.82 -3.48 -0.02 0.00 0.52 0.00 0.00 34.95 31.15 1y7h s ARG 202 CO 0.53 -0.01 -0.12 0.08 0.02 0.00 0.00 175.30 175.80 1y7h s VAL 203 N 1.22 3.23 -0.12 3.52 1.01 0.17 -1.83 120.40 127.60 1y7h s VAL 203 Ca 0.06 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1y7h s VAL 203 Cb -0.14 -2.31 0.02 0.00 0.00 0.00 0.00 36.38 33.95 1y7h s VAL 203 CO 0.05 0.57 -0.15 -0.47 0.00 0.00 0.00 175.10 175.10 1y7h s TYR 204 N -0.42 2.04 -0.25 5.22 6.14 -1.03 -0.49 117.35 128.55 1y7h s TYR 204 Ca 0.05 -0.99 -0.07 0.00 0.64 0.00 0.00 57.07 56.70 1y7h s TYR 204 Cb -0.12 -1.47 -0.02 0.00 0.42 0.00 0.00 41.96 40.77 1y7h s TYR 204 CO 0.02 -0.51 0.05 0.42 0.64 0.00 0.00 175.55 176.17 1y7h s ILE 205 N 1.05 4.09 0.02 3.14 1.01 -0.99 -1.29 121.20 128.23 1y7h s ILE 205 Ca -0.05 -0.31 -0.18 0.00 0.00 0.00 0.00 60.65 60.11 1y7h s ILE 205 Cb -0.15 -2.94 -0.06 0.00 0.01 0.00 0.00 42.46 39.33 1y7h s ILE 205 CO -0.03 0.31 0.50 -0.69 0.00 0.00 0.00 174.94 175.03 1y7h s VAL 206 N 1.57 4.91 -0.49 2.92 1.01 0.03 -1.40 120.40 128.95 1y7h s VAL 206 Ca 0.06 1.05 -0.04 0.00 0.00 0.00 0.00 61.98 63.04 1y7h s VAL 206 Cb -0.15 -3.82 0.13 0.00 0.00 0.00 0.00 36.38 32.53 1y7h s VAL 206 CO 0.02 0.53 0.31 0.00 0.00 0.00 0.00 175.10 175.96 1y7h h THR 208 N 5.98 0.42 -0.23 0.00 1.35 -1.55 -0.14 112.91 118.74 1y7h h THR 208 Ca -0.11 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 1y7h h THR 208 Cb 1.03 0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.49 1y7h h THR 208 CO 0.74 0.06 0.00 -0.62 -0.25 0.00 0.00 175.52 175.45 1y7h n GLU 209 N -4.72 2.13 -1.62 4.72 -0.58 -0.19 -4.55 120.64 115.83 1y7h n GLU 209 Ca 0.29 -1.69 -0.49 0.00 -0.42 0.00 0.00 57.16 54.85 1y7h n GLU 209 Cb 0.98 -1.46 -0.05 0.00 -0.57 0.00 0.00 31.44 30.34 1y7h n GLU 209 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1y7h n ASP 210 N 0.93 2.13 -0.07 1.62 -0.08 -0.06 -4.61 116.55 116.40 1y7h n ASP 210 Ca 0.17 1.11 0.04 0.00 -1.51 0.00 0.00 54.79 54.61 1y7h n ASP 210 Cb 0.48 -1.28 -0.03 0.00 2.34 0.00 0.00 41.12 42.62 1y7h n ASP 210 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1y7h n LYS 211 N 2.66 3.38 -0.01 -0.67 5.02 -1.19 -3.84 118.16 123.50 1y7h n LYS 211 Ca 0.17 -0.20 -0.18 0.00 -2.02 0.00 0.00 58.31 56.09 1y7h n LYS 211 Cb 0.24 -0.97 -0.14 0.00 -0.02 0.00 0.00 35.03 34.13 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 2.11 0.18 -6.88 0.72 0.00 -1.51 -3.40 103.07 94.30 1y7h h GLY 212 Ca 0.00 -0.46 -0.61 0.00 0.00 0.00 0.00 47.33 46.26 1y7h h GLY 212 CO 0.00 0.41 -0.75 -0.42 0.00 0.00 0.00 176.54 175.77 1y7h s ILE 213 N -2.34 1.45 0.35 2.60 1.01 -1.26 -5.11 121.20 117.89 1y7h s ILE 213 Ca -0.17 -2.86 -0.27 0.00 0.00 0.00 0.00 60.65 57.35 1y7h s ILE 213 Cb -0.00 -2.00 -0.12 0.00 0.01 0.00 0.00 42.46 40.35 1y7h s ILE 213 CO 0.76 -0.98 1.06 -0.81 0.00 0.00 0.00 174.94 174.97 1y7h n PRO 214 N 3.14 1.51 -0.34 2.79 -0.04 -1.25 -4.65 135.00 136.16 1y7h n PRO 214 Ca 0.15 0.53 0.32 0.00 -0.04 0.00 0.00 63.50 64.46 1y7h n PRO 214 Cb 0.37 -2.01 0.57 0.00 -0.04 0.00 0.00 33.50 32.39 1y7h n PRO 214 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1y7h n GLU 215 N 0.48 -0.05 -0.11 0.54 2.13 -1.26 -0.17 120.64 122.20 1y7h n GLU 215 Ca 0.08 1.23 -0.06 0.00 0.66 0.00 0.00 57.16 59.07 1y7h n GLU 215 Cb 0.35 -2.28 -0.00 0.00 0.27 0.00 0.00 31.44 29.78 1y7h n GLU 215 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1y7h h GLU 216 N 0.00 -0.18 -0.04 5.31 3.07 -1.95 0.39 114.58 121.17 1y7h h GLU 216 Ca 0.79 0.01 -0.11 0.00 -0.50 0.00 0.00 59.36 59.55 1y7h h GLU 216 Cb 2.26 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 30.20 1y7h h GLU 216 CO -0.61 -0.12 -0.50 0.35 -1.40 0.00 0.00 179.01 176.73 1y7h h PHE 217 N -0.19 0.12 -0.57 4.33 3.57 -0.89 -1.61 116.94 121.71 1y7h h PHE 217 Ca 0.18 -0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.54 1y7h h PHE 217 Cb 0.48 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 1y7h h PHE 217 CO -0.47 0.58 -0.06 1.96 -2.23 0.00 0.00 178.31 178.08 1y7h h GLN 218 N 0.08 1.04 0.00 1.11 4.20 -0.87 -2.03 115.11 118.64 1y7h h GLN 218 Ca 0.00 -0.36 -0.10 0.00 0.06 0.00 0.00 58.65 58.25 1y7h h GLN 218 Cb 0.91 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 1y7h h GLN 218 CO 0.07 1.05 -0.49 0.00 -0.67 0.00 0.00 178.83 178.80 1y7h h ARG 219 N 0.93 0.00 -0.47 1.46 2.47 -0.12 -2.92 114.38 115.72 1y7h h ARG 219 Ca 0.15 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.85 1y7h h ARG 219 Cb 0.62 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.92 1y7h h ARG 219 CO 0.04 0.49 0.21 2.35 0.56 0.00 0.00 179.97 183.62 1y7h h TRP 220 N 0.00 0.70 -0.59 3.04 7.01 -0.80 -1.69 115.95 123.62 1y7h h TRP 220 Ca -0.00 -0.04 -0.06 0.00 2.11 0.00 0.00 58.89 60.89 1y7h h TRP 220 Cb 0.94 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.77 1y7h h TRP 220 CO 0.00 0.57 0.13 1.96 -2.79 0.00 0.00 178.44 178.31 1y7h h GLN 221 N 0.62 0.96 -0.82 2.65 4.20 -1.22 -0.19 115.11 121.30 1y7h h GLN 221 Ca 0.16 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1y7h h GLN 221 Cb 0.15 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.77 1y7h h GLN 221 CO -0.02 0.89 0.47 0.82 -0.67 0.00 0.00 178.83 180.32 1y7h h ILE 222 N 0.86 1.24 -0.10 2.54 2.04 -1.33 0.26 117.51 123.02 1y7h h ILE 222 Ca 0.18 -0.56 -0.15 0.00 1.00 0.00 0.00 64.86 65.33 1y7h h ILE 222 Cb 0.38 0.11 0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1y7h h ILE 222 CO 0.01 0.26 -0.54 0.44 0.00 0.00 0.00 178.15 178.32 1y7h h ASP 223 N 1.14 0.64 0.00 1.72 3.45 -1.11 -1.78 116.42 120.48 1y7h h ASP 223 Ca 0.29 -0.65 0.00 0.00 0.43 0.00 0.00 57.03 57.10 1y7h h ASP 223 Cb -0.00 -0.19 0.00 0.00 -0.56 0.00 0.00 39.33 38.58 1y7h h ASP 223 CO -0.05 1.19 -0.01 0.78 -1.57 0.00 0.00 179.24 179.58 1y7h h ASN 224 N 0.13 0.00 -0.58 6.45 2.35 -0.91 -3.38 115.58 119.65 1y7h h ASN 224 Ca -0.04 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 1y7h h ASN 224 Cb 1.19 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.53 1y7h h ASN 224 CO 0.11 0.10 0.22 0.40 -1.65 0.00 0.00 177.43 176.61 1y7h h ILE 225 N -0.18 1.23 0.00 2.81 5.03 -0.72 -3.49 117.51 122.18 1y7h h ILE 225 Ca 0.00 -0.72 0.00 0.00 -0.12 0.00 0.00 64.86 64.02 1y7h h ILE 225 Cb 0.01 0.62 0.00 0.00 -3.03 0.00 0.00 36.82 34.42 1y7h h ILE 225 CO 0.00 0.28 0.00 0.61 -0.68 0.00 0.00 178.15 178.36 1y7h n GLY 226 N -0.80 0.03 3.13 5.37 0.00 -0.67 -5.02 105.19 107.24 1y7h n GLY 226 Ca 0.03 -1.59 -0.12 0.00 0.00 0.00 0.00 46.02 44.34 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 -2.91 0.04 0.17 1.61 -7.23 -1.25 -4.86 120.40 105.97 1y7h s VAL 227 Ca 0.00 -0.32 -0.13 0.00 -1.81 0.00 0.00 61.98 59.72 1y7h s VAL 227 Cb 0.00 -0.41 0.07 0.00 0.56 0.00 0.00 36.38 36.60 1y7h s VAL 227 CO 0.00 -0.17 1.77 0.74 -0.31 0.00 0.00 175.10 177.12 1y7h h THR 228 N 4.45 1.20 -3.77 5.32 2.02 -1.76 -3.45 112.91 116.93 1y7h h THR 228 Ca -0.28 -0.52 -0.14 0.00 0.77 0.00 0.00 66.41 66.23 1y7h h THR 228 Cb 1.19 0.52 -0.19 0.00 -1.74 0.00 0.00 68.15 67.93 1y7h h THR 228 CO 0.38 0.22 -0.56 -0.70 0.37 0.00 0.00 175.52 175.23 1y7h s GLU 229 N -5.78 0.50 -0.05 6.66 2.12 -1.19 -5.06 118.70 115.90 1y7h s GLU 229 Ca -0.13 -0.64 -0.02 0.00 0.36 0.00 0.00 54.97 54.54 1y7h s GLU 229 Cb 0.12 0.20 0.03 0.00 0.26 0.00 0.00 34.13 34.74 1y7h s GLU 229 CO 0.77 -0.12 0.07 0.00 -0.54 0.00 0.00 175.26 175.44 1y7h s ALA 230 N -2.06 0.19 0.11 6.30 0.00 -1.26 -2.47 121.76 122.57 1y7h s ALA 230 Ca -0.10 0.22 0.09 0.00 0.00 0.00 0.00 51.96 52.18 1y7h s ALA 230 Cb -0.05 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 1y7h s ALA 230 CO -0.02 -0.51 -0.20 0.42 0.00 0.00 0.00 175.76 175.45 1y7h s ILE 231 N 2.18 2.70 0.19 0.00 -1.09 -0.41 -4.99 121.20 119.78 1y7h s ILE 231 Ca 0.05 -1.54 0.09 0.00 -2.23 0.00 0.00 60.65 57.02 1y7h s ILE 231 Cb -0.12 -2.22 -0.04 0.00 -1.58 0.00 0.00 42.46 38.50 1y7h s ILE 231 CO -0.03 0.12 -0.18 -1.83 -1.23 0.00 0.00 174.94 171.78 1y7h s GLU 232 N -2.07 1.37 -0.11 2.79 -1.05 -1.26 -0.79 118.70 117.58 1y7h s GLU 232 Ca 0.17 -1.51 0.01 0.00 -0.15 0.00 0.00 54.97 53.48 1y7h s GLU 232 Cb -0.10 -1.41 0.02 0.00 -0.44 0.00 0.00 34.13 32.20 1y7h s GLU 232 CO 0.09 0.27 -0.11 0.42 0.95 0.00 0.00 175.26 176.89 1y7h s ILE 233 N -2.27 1.20 0.29 1.83 1.01 -0.22 -4.90 121.20 118.15 1y7h s ILE 233 Ca 0.20 -0.43 -0.20 0.00 0.00 0.00 0.00 60.65 60.21 1y7h s ILE 233 Cb -0.05 -1.16 -0.09 0.00 0.01 0.00 0.00 42.46 41.17 1y7h s ILE 233 CO 0.08 0.39 0.80 -0.75 0.00 0.00 0.00 174.94 175.46 1y7h s LYS 234 N 1.35 4.27 0.00 2.79 2.47 -1.26 -2.67 119.74 126.68 1y7h s LYS 234 Ca -0.01 0.96 0.00 0.00 -1.56 0.00 0.00 55.97 55.36 1y7h s LYS 234 Cb -0.14 -2.67 0.00 0.00 -1.46 0.00 0.00 37.83 33.56 1y7h s LYS 234 CO -0.05 0.26 0.00 0.41 0.16 0.00 0.00 175.35 176.13 1y7h n GLY 235 N 0.27 0.53 3.74 5.54 0.00 -1.26 -4.97 105.19 109.05 1y7h n GLY 235 Ca 0.01 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 -2.57 3.49 0.62 4.61 0.00 -1.25 -4.82 121.76 121.84 1y7h s ALA 236 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1y7h s ALA 236 Cb 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 23.12 20.46 1y7h s ALA 236 CO 0.00 0.06 0.00 -0.40 0.00 0.00 0.00 175.76 175.42 1y7h n ASP 237 N 3.36 0.00 -2.06 0.00 3.85 -1.26 -1.02 116.55 119.42 1y7h n ASP 237 Ca -0.07 0.00 -0.04 0.00 -0.71 0.00 0.00 54.79 53.97 1y7h n ASP 237 Cb 0.52 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 40.23 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 0.00 0.00 0.00 2.11 -0.00 -1.23 -4.32 115.22 111.78 1y7h n HIS 238 Ca 0.00 -0.69 0.00 0.00 -0.00 0.00 0.00 57.72 57.03 1y7h n HIS 238 Cb 0.00 -0.80 0.00 0.00 -0.00 0.00 0.00 29.99 29.19 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 2.38 0.00 0.00 1.57 0.00 -1.26 -4.98 120.51 118.22 1y7h n ALA 240 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1y7h n ALA 240 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 0.08 0.00 4.77 -1.26 -0.43 117.00 120.15 1y7h n LEU 242 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.10 1y7h n LEU 242 Cb 0.00 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.18 1y7h n LEU 242 CO 0.00 0.00 0.18 0.00 -1.33 0.00 0.00 177.39 176.24 1y7h n GLU 244 N -2.32 1.11 -0.33 0.00 -0.58 0.43 -5.00 120.64 113.94 1y7h n GLU 244 Ca 0.02 -2.71 -0.01 0.00 -0.42 0.00 0.00 57.16 54.03 1y7h n GLU 244 Cb 0.48 -0.98 0.12 0.00 -0.57 0.00 0.00 31.44 30.49 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 2.73 1.08 -0.18 3.49 0.13 -1.77 -1.47 132.00 136.01 1y7h h PRO 245 Ca -0.11 -0.06 -0.13 0.00 -0.87 0.00 0.00 66.00 64.83 1y7h h PRO 245 Cb 1.16 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 1y7h h PRO 245 CO 0.30 0.71 -0.43 1.96 -0.23 0.00 0.00 178.00 180.31 1y7h h GLN 246 N 1.11 0.43 -0.41 0.86 4.20 -1.92 0.62 115.11 120.00 1y7h h GLN 246 Ca 0.36 -0.23 -0.12 0.00 0.06 0.00 0.00 58.65 58.72 1y7h h GLN 246 Cb 0.01 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1y7h h GLN 246 CO -0.12 0.79 -0.23 0.87 -0.67 0.00 0.00 178.83 179.46 1y7h h LYS 247 N 0.36 0.84 -0.15 1.46 1.57 -1.84 0.13 116.57 118.93 1y7h h LYS 247 Ca 0.03 -0.35 -0.04 0.00 -1.87 0.00 0.00 60.65 58.41 1y7h h LYS 247 Cb 0.91 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.18 1y7h h LYS 247 CO 0.08 0.99 -0.07 1.25 -0.57 0.00 0.00 179.45 181.12 1y7h h LEU 248 N 0.73 0.33 -0.90 2.94 6.46 -0.92 -0.35 115.31 123.59 1y7h h LEU 248 Ca 0.10 -0.41 0.05 0.00 -0.12 0.00 0.00 57.88 57.50 1y7h h LEU 248 Cb 0.77 -0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 40.55 1y7h h LEU 248 CO 0.06 0.66 0.57 0.00 -0.62 0.00 0.00 178.44 179.12 1y7h h ALA 250 N 1.40 0.57 0.00 0.00 0.00 -0.58 0.13 119.26 120.77 1y7h h ALA 250 Ca 0.38 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1y7h h ALA 250 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1y7h h ALA 250 CO -0.15 0.55 -0.40 1.03 0.00 0.00 0.00 179.25 180.28 1y7h h SER 251 N 0.68 0.00 0.44 0.00 0.87 -0.37 -2.68 113.55 112.49 1y7h h SER 251 Ca 0.09 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 60.36 1y7h h SER 251 Cb 0.79 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.77 1y7h h SER 251 CO 0.06 0.40 -1.28 -0.07 -0.53 0.00 0.00 176.83 175.42 1y7h h LEU 252 N 0.00 0.61 -0.73 2.23 3.38 0.35 -3.11 115.31 118.04 1y7h h LEU 252 Ca -0.00 -0.63 -0.13 0.00 0.09 0.00 0.00 57.88 57.21 1y7h h LEU 252 Cb 0.86 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1y7h h LEU 252 CO 0.05 1.47 -0.49 -0.07 0.09 0.00 0.00 178.44 179.50 1y7h h LEU 253 N 0.14 0.38 0.16 1.67 3.38 -0.90 -2.61 115.31 117.53 1y7h h LEU 253 Ca -0.17 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 1y7h h LEU 253 Cb 1.98 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.63 1y7h h LEU 253 CO 0.23 0.81 -0.08 -0.08 0.09 0.00 0.00 178.44 179.41 1y7h h GLU 254 N 0.28 -0.21 -0.76 1.13 4.81 -1.57 -1.90 114.58 116.37 1y7h h GLU 254 Ca 0.01 0.01 0.17 0.00 -0.13 0.00 0.00 59.36 59.43 1y7h h GLU 254 Cb 0.97 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.35 1y7h h GLU 254 CO 0.08 -0.07 0.52 0.82 -0.73 0.00 0.00 179.01 179.62 1y7h h ILE 255 N -0.30 0.73 -0.19 2.32 2.04 -1.44 0.66 117.51 121.33 1y7h h ILE 255 Ca -0.02 -0.10 -0.21 0.00 1.00 0.00 0.00 64.86 65.53 1y7h h ILE 255 Cb 0.23 0.43 0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1y7h h ILE 255 CO 0.04 0.05 -0.70 0.00 0.00 0.00 0.00 178.15 177.54 1y7h h ALA 256 N 1.65 0.39 -0.08 1.87 0.00 -1.07 -3.06 119.26 118.96 1y7h h ALA 256 Ca 0.37 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1y7h h ALA 256 Cb 1.05 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1y7h h ALA 256 CO -0.09 0.69 -0.13 1.25 0.00 0.00 0.00 179.25 180.97 1y7h h HIS 257 N 0.56 0.28 0.00 0.00 -0.00 -0.28 -3.39 115.15 112.32 1y7h h HIS 257 Ca -0.03 -0.10 0.00 0.00 -0.00 0.00 0.00 60.37 60.24 1y7h h HIS 257 Cb 1.32 -0.05 0.00 0.00 -0.00 0.00 0.00 27.41 28.67 1y7h h HIS 257 CO 0.08 0.72 0.00 1.17 -0.00 0.00 0.00 177.93 179.90 1y7h n LYS 258 N -4.62 0.00 -1.69 5.26 0.00 0.05 -4.43 118.16 112.72 1y7h n LYS 258 Ca -0.07 0.43 -0.22 0.00 0.00 0.00 0.00 58.31 58.44 1y7h n LYS 258 Cb 0.36 -1.40 -0.06 0.00 0.00 0.00 0.00 35.03 33.93 1y7h n LYS 258 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1y7h s TYR 259 N -2.61 1.29 0.00 5.64 2.02 -1.16 -5.11 117.35 117.42 1y7h s TYR 259 Ca 0.00 1.57 0.00 0.00 -0.37 0.00 0.00 57.07 58.27 1y7h s TYR 259 Cb 0.00 -3.62 0.00 0.00 -0.40 0.00 0.00 41.96 37.94 1y7h s TYR 259 CO 0.00 -1.84 0.00 -1.71 -1.57 0.00 0.00 175.55 170.43