#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 6yas s PHE 3 N 0.00 3.08 0.28 0.00 0.08 -1.26 -4.61 117.98 115.55 6yas s PHE 3 Ca 0.00 0.03 0.04 0.00 0.12 0.00 0.00 56.93 57.12 6yas s PHE 3 Cb 0.00 -1.59 -0.03 0.00 -0.57 0.00 0.00 43.02 40.83 6yas s PHE 3 CO 0.00 0.49 0.23 0.00 -0.10 0.00 0.00 175.22 175.85 6yas s ALA 4 N -1.31 1.54 -0.33 5.36 0.00 -1.26 -5.02 121.76 120.75 6yas s ALA 4 Ca 0.26 -1.90 -0.00 0.00 0.00 0.00 0.00 51.96 50.32 6yas s ALA 4 Cb -0.12 1.43 0.08 0.00 0.00 0.00 0.00 23.12 24.51 6yas s ALA 4 CO 0.18 -0.64 0.04 -1.58 0.00 0.00 0.00 175.76 173.76 6yas s HIS 5 N -3.71 3.45 -0.02 0.00 2.46 -1.26 -1.20 115.29 115.00 6yas s HIS 5 Ca 0.40 -2.32 -0.20 0.00 0.47 0.00 0.00 55.06 53.41 6yas s HIS 5 Cb 0.04 -2.52 -0.05 0.00 -0.13 0.00 0.00 32.58 29.92 6yas s HIS 5 CO 0.21 -0.89 0.57 -0.06 -2.47 0.00 0.00 174.74 172.10 6yas s PHE 6 N 1.13 3.66 -0.25 3.88 0.08 -0.27 -1.09 117.98 125.12 6yas s PHE 6 Ca 0.01 1.15 0.00 0.00 0.12 0.00 0.00 56.93 58.20 6yas s PHE 6 Cb -0.20 -2.59 0.04 0.00 -0.57 0.00 0.00 43.02 39.70 6yas s PHE 6 CO -0.04 0.34 -0.09 0.08 -0.10 0.00 0.00 175.22 175.41 6yas s VAL 7 N -0.11 2.57 -0.19 -0.44 1.01 -0.18 -0.85 120.40 122.20 6yas s VAL 7 Ca 0.30 -1.23 -0.15 0.00 0.00 0.00 0.00 61.98 60.90 6yas s VAL 7 Cb -0.18 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 6yas s VAL 7 CO 0.16 0.15 0.34 -0.76 0.00 0.00 0.00 175.10 174.98 6yas s LEU 8 N 1.25 4.18 -0.20 3.92 1.43 -0.51 -0.61 118.68 128.13 6yas s LEU 8 Ca -0.02 0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.56 6yas s LEU 8 Cb -0.17 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 43.66 6yas s LEU 8 CO -0.05 -0.00 -0.15 -0.63 0.23 0.00 0.00 176.35 175.74 6yas s ILE 9 N 0.99 1.95 0.98 -0.59 1.01 0.21 -3.16 121.20 122.59 6yas s ILE 9 Ca 0.17 -1.09 -0.15 0.00 0.00 0.00 0.00 60.65 59.58 6yas s ILE 9 Cb -0.14 -1.89 0.19 0.00 0.01 0.00 0.00 42.46 40.63 6yas s ILE 9 CO 0.06 0.32 1.22 -1.38 0.00 0.00 0.00 174.94 175.16 6yas s HIS 10 N 1.29 1.73 0.56 3.97 -3.43 -1.26 -2.06 115.29 116.09 6yas s HIS 10 Ca 0.00 0.53 0.05 0.00 -0.80 0.00 0.00 55.06 54.84 6yas s HIS 10 Cb -0.15 -3.74 0.06 0.00 -1.43 0.00 0.00 32.58 27.32 6yas s HIS 10 CO -0.10 -2.75 0.77 -0.08 -2.00 0.00 0.00 174.74 170.59 6yas s THR 11 N -3.53 2.51 0.64 -5.38 -1.32 -1.25 -4.25 115.64 103.07 6yas s THR 11 Ca 0.70 -0.83 -0.18 0.00 -1.21 0.00 0.00 61.69 60.17 6yas s THR 11 Cb -0.08 -2.69 -0.02 0.00 -1.51 0.00 0.00 72.50 68.20 6yas s THR 11 CO 0.53 0.00 1.23 2.30 -2.21 0.00 0.00 174.62 176.47 6yas n ILE 12 N -2.29 4.70 -0.71 5.08 -5.35 -1.26 -2.13 119.36 117.39 6yas n ILE 12 Ca 0.11 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 6yas n ILE 12 Cb 0.60 -1.42 0.00 0.00 -1.74 0.00 0.00 39.64 37.08 6yas n ILE 12 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 6yas n HIS 14 N -2.02 -0.44 -3.82 0.00 8.25 -0.91 -1.88 115.22 114.39 6yas n HIS 14 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 6yas n HIS 14 Cb 0.02 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.14 6yas n HIS 14 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 6yas n GLY 15 N 5.00 1.38 0.41 -1.41 0.00 -1.26 -3.00 105.19 106.31 6yas n GLY 15 Ca 0.00 -1.35 0.22 0.00 0.00 0.00 0.00 46.02 44.89 6yas n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 6yas h ALA 16 N 2.00 2.33 -0.12 4.61 0.00 -1.88 -2.43 119.26 123.78 6yas h ALA 16 Ca -0.30 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.63 6yas h ALA 16 Cb 1.14 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 6yas h ALA 16 CO 0.38 -0.79 0.21 0.11 0.00 0.00 0.00 179.25 179.16 6yas h TRP 17 N 0.00 0.00 0.00 0.00 5.08 -1.94 -1.22 115.95 117.87 6yas h TRP 17 Ca 0.26 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.23 6yas h TRP 17 Cb 1.28 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.44 6yas h TRP 17 CO 0.00 0.00 0.00 0.97 -1.28 0.00 0.00 178.44 178.13 6yas h ILE 18 N 0.00 0.00 -0.64 0.12 6.09 -1.86 -2.14 117.51 119.07 6yas h ILE 18 Ca 0.06 -0.21 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 6yas h ILE 18 Cb 0.47 0.98 0.00 0.00 0.47 0.00 0.00 36.82 38.74 6yas h ILE 18 CO -0.00 0.00 0.00 0.79 -3.07 0.00 0.00 178.15 175.87 6yas n TRP 19 N -2.56 1.44 0.30 2.19 7.02 -0.46 -4.63 117.44 120.73 6yas n TRP 19 Ca 0.00 -0.58 0.18 0.00 -1.02 0.00 0.00 57.50 56.09 6yas n TRP 19 Cb 0.18 -0.23 0.87 0.00 -2.42 0.00 0.00 31.31 29.71 6yas n TRP 19 CO 0.00 0.00 0.00 1.12 -2.02 0.00 0.00 177.69 176.79 6yas h HIS 20 N 4.04 0.00 0.12 -5.99 2.07 -1.55 -1.50 115.15 112.35 6yas h HIS 20 Ca 0.00 0.00 -0.36 0.00 -2.85 0.00 0.00 60.37 57.16 6yas h HIS 20 Cb 1.41 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.37 6yas h HIS 20 CO 0.75 0.03 -1.93 0.87 -3.07 0.00 0.00 177.93 174.58 6yas h LYS 21 N 0.00 0.26 -0.17 5.12 1.57 -1.84 -3.41 116.57 118.10 6yas h LYS 21 Ca -0.00 -0.45 -0.18 0.00 -1.87 0.00 0.00 60.65 58.15 6yas h LYS 21 Cb 0.32 0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.80 6yas h LYS 21 CO 0.00 1.22 -0.59 1.25 -0.57 0.00 0.00 179.45 180.76 6yas h LEU 22 N 0.01 0.81 -0.21 2.94 5.85 -1.67 -3.32 115.31 119.71 6yas h LEU 22 Ca -0.41 -0.60 0.05 0.00 0.84 0.00 0.00 57.88 57.76 6yas h LEU 22 Cb 2.00 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 42.73 6yas h LEU 22 CO 0.08 1.27 -0.15 0.50 -0.34 0.00 0.00 178.44 179.81 6yas h LYS 23 N 0.39 -0.14 -0.70 1.25 3.64 -1.51 -2.04 116.57 117.46 6yas h LYS 23 Ca -0.03 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.42 6yas h LYS 23 Cb 1.22 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 33.03 6yas h LYS 23 CO 0.12 -0.09 0.46 -1.35 -2.27 0.00 0.00 179.45 176.32 6yas h PRO 24 N -0.14 0.71 -0.43 1.90 0.11 -1.79 -2.44 132.00 129.91 6yas h PRO 24 Ca 0.12 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.11 6yas h PRO 24 Cb 0.33 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 6yas h PRO 24 CO -0.30 0.47 -0.04 1.25 -0.21 0.00 0.00 178.00 179.16 6yas h LEU 25 N 0.73 0.78 -0.76 2.35 5.85 -1.51 -1.59 115.31 121.17 6yas h LEU 25 Ca 0.30 -0.33 -0.13 0.00 0.84 0.00 0.00 57.88 58.56 6yas h LEU 25 Cb 0.25 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 6yas h LEU 25 CO -0.10 0.93 -0.46 -0.07 -0.34 0.00 0.00 178.44 178.40 6yas h LEU 26 N 0.62 0.40 -0.90 2.25 3.38 -1.03 -2.79 115.31 117.24 6yas h LEU 26 Ca 0.12 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 6yas h LEU 26 Cb 0.55 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 6yas h LEU 26 CO 0.03 0.80 -0.48 -0.33 0.09 0.00 0.00 178.44 178.56 6yas h GLU 27 N 0.30 0.17 0.00 1.13 5.08 -1.37 -1.98 114.58 117.91 6yas h GLU 27 Ca 0.02 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 6yas h GLU 27 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 6yas h GLU 27 CO 0.08 0.61 0.00 0.00 -1.00 0.00 0.00 179.01 178.70 6yas h ALA 28 N 1.38 1.00 -0.07 3.43 0.00 -1.01 -1.42 119.26 122.56 6yas h ALA 28 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 6yas h ALA 28 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 6yas h ALA 28 CO 0.07 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.60 6yas n LEU 29 N -2.67 2.20 0.00 0.00 4.77 -0.95 -4.94 117.00 115.42 6yas n LEU 29 Ca 0.01 -0.78 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 6yas n LEU 29 Cb 0.26 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 6yas n LEU 29 CO 0.23 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 6yas n GLY 30 N 1.26 0.74 3.86 -0.72 0.00 -0.53 -4.98 105.19 104.82 6yas n GLY 30 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 6yas n GLY 30 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 6yas s HIS 31 N -2.00 3.44 0.03 1.61 3.76 -0.79 -4.76 115.29 116.58 6yas s HIS 31 Ca 0.00 1.15 -0.21 0.00 -0.15 0.00 0.00 55.06 55.85 6yas s HIS 31 Cb 0.00 -2.52 -0.06 0.00 1.11 0.00 0.00 32.58 31.12 6yas s HIS 31 CO 0.00 -0.08 0.61 0.21 -0.85 0.00 0.00 174.74 174.64 6yas s LYS 32 N -3.60 4.31 -0.07 1.40 2.20 -0.35 -4.11 119.74 119.52 6yas s LYS 32 Ca 0.53 0.79 0.00 0.00 -0.36 0.00 0.00 55.97 56.93 6yas s LYS 32 Cb -0.10 -3.31 0.02 0.00 -1.51 0.00 0.00 37.83 32.93 6yas s LYS 32 CO 0.27 0.45 -0.04 0.08 -0.36 0.00 0.00 175.35 175.75 6yas s VAL 33 N -0.51 0.63 -0.21 4.02 1.01 -1.26 -1.11 120.40 122.97 6yas s VAL 33 Ca 0.31 -0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.15 6yas s VAL 33 Cb -0.19 -0.69 -0.01 0.00 0.00 0.00 0.00 36.38 35.49 6yas s VAL 33 CO 0.19 0.28 -0.04 -0.89 0.00 0.00 0.00 175.10 174.63 6yas s THR 34 N 1.41 3.39 -0.30 3.92 2.01 -0.03 -4.99 115.64 121.06 6yas s THR 34 Ca -0.03 -0.49 -0.03 0.00 0.31 0.00 0.00 61.69 61.45 6yas s THR 34 Cb -0.13 -2.54 0.04 0.00 0.01 0.00 0.00 72.50 69.88 6yas s THR 34 CO -0.03 0.43 0.02 0.00 -0.69 0.00 0.00 174.62 174.35 6yas s ALA 35 N 1.39 2.87 0.12 7.40 0.00 -1.26 -1.43 121.76 130.85 6yas s ALA 35 Ca 0.05 -1.66 -0.10 0.00 0.00 0.00 0.00 51.96 50.25 6yas s ALA 35 Cb -0.14 -1.99 -0.06 0.00 0.00 0.00 0.00 23.12 20.93 6yas s ALA 35 CO -0.03 -1.16 0.44 -0.51 0.00 0.00 0.00 175.76 174.50 6yas s LEU 36 N 1.33 4.31 -0.14 0.00 1.43 -1.19 -4.82 118.68 119.61 6yas s LEU 36 Ca -0.03 0.82 -0.16 0.00 -1.03 0.00 0.00 54.13 53.73 6yas s LEU 36 Cb -0.19 -3.16 -0.04 0.00 0.03 0.00 0.00 46.19 42.83 6yas s LEU 36 CO -0.00 0.11 0.38 -1.81 0.23 0.00 0.00 176.35 175.26 6yas s ASP 37 N -1.93 6.56 0.89 2.29 1.01 -1.26 -3.68 116.67 120.55 6yas s ASP 37 Ca 0.37 0.66 -0.10 0.00 0.71 0.00 0.00 52.55 54.18 6yas s ASP 37 Cb -0.13 -2.23 0.18 0.00 1.01 0.00 0.00 42.92 41.75 6yas s ASP 37 CO 0.20 0.05 1.21 -0.76 0.21 0.00 0.00 175.17 176.08 6yas s LEU 38 N 0.54 2.82 0.42 1.23 1.43 -1.26 -4.79 118.68 119.07 6yas s LEU 38 Ca 0.21 -0.03 -0.26 0.00 -1.03 0.00 0.00 54.13 53.02 6yas s LEU 38 Cb -0.14 -2.07 -0.09 0.00 0.03 0.00 0.00 46.19 43.92 6yas s LEU 38 CO 0.07 -2.48 1.43 0.00 0.23 0.00 0.00 176.35 175.60 6yas s ALA 39 N -3.64 3.35 -1.26 4.21 0.00 -0.81 -2.51 121.76 121.11 6yas s ALA 39 Ca 0.72 1.48 0.00 0.00 0.00 0.00 0.00 51.96 54.16 6yas s ALA 39 Cb -0.04 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.50 6yas s ALA 39 CO 0.50 -1.12 0.00 0.00 0.00 0.00 0.00 175.76 175.15 6yas n ALA 40 N 0.05 -0.71 -2.61 0.00 0.00 -1.25 -4.95 120.51 111.04 6yas n ALA 40 Ca 0.04 0.12 -0.21 0.00 0.00 0.00 0.00 53.44 53.39 6yas n ALA 40 Cb 0.41 -1.67 -0.13 0.00 0.00 0.00 0.00 19.45 18.07 6yas n ALA 40 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 6yas s SER 41 N -2.05 2.07 1.96 0.00 0.01 -1.04 -4.67 113.70 109.98 6yas s SER 41 Ca 0.00 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 56.66 6yas s SER 41 Cb 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.12 6yas s SER 41 CO 0.00 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.28 6yas n GLY 42 N 1.40 3.95 1.66 3.44 0.00 -1.16 -1.61 105.19 112.87 6yas n GLY 42 Ca -0.19 0.02 0.08 0.00 0.00 0.00 0.00 46.02 45.92 6yas n GLY 42 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 6yas n VAL 43 N 0.00 2.61 -2.22 1.61 0.24 -1.26 -4.95 118.33 114.36 6yas n VAL 43 Ca 0.00 -1.49 -0.41 0.00 -2.04 0.00 0.00 64.34 60.39 6yas n VAL 43 Cb 0.00 -0.24 -0.03 0.00 -1.47 0.00 0.00 33.84 32.10 6yas n VAL 43 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 6yas s ASP 44 N -1.04 6.89 0.43 -1.34 2.15 -0.63 -4.94 116.67 118.19 6yas s ASP 44 Ca 0.52 2.40 0.21 0.00 0.43 0.00 0.00 52.55 56.11 6yas s ASP 44 Cb 0.40 -2.61 0.95 0.00 -0.30 0.00 0.00 42.92 41.35 6yas s ASP 44 CO 0.15 -0.53 1.86 1.55 -0.17 0.00 0.00 175.17 178.03 6yas h PRO 45 N 5.38 0.00 -7.14 4.34 0.13 -1.92 -3.41 132.00 129.38 6yas h PRO 45 Ca -0.45 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.18 6yas h PRO 45 Cb 1.21 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.44 6yas h PRO 45 CO 0.77 0.27 0.41 1.03 -0.23 0.00 0.00 178.00 180.25 6yas s ARG 46 N -3.85 3.03 0.16 0.86 0.52 -1.26 -5.00 118.95 113.41 6yas s ARG 46 Ca -0.01 1.53 0.03 0.00 -0.52 0.00 0.00 55.73 56.76 6yas s ARG 46 Cb 0.12 -1.97 -0.03 0.00 0.52 0.00 0.00 34.95 33.58 6yas s ARG 46 CO 0.65 -1.09 0.28 -0.65 0.02 0.00 0.00 175.30 174.51 6yas s GLN 47 N -3.68 3.38 0.59 3.54 -1.52 -1.26 -3.97 119.66 116.74 6yas s GLN 47 Ca 0.70 -0.65 0.36 0.00 -1.95 0.00 0.00 55.36 53.83 6yas s GLN 47 Cb -0.23 -2.92 1.85 0.00 -0.22 0.00 0.00 33.01 31.49 6yas s GLN 47 CO 0.35 0.51 2.18 0.97 -0.25 0.00 0.00 175.29 179.04 6yas h ILE 48 N 1.62 0.17 0.00 1.08 6.09 -1.83 -2.48 117.51 122.16 6yas h ILE 48 Ca -0.49 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 62.72 6yas h ILE 48 Cb 1.20 1.23 0.00 0.00 0.47 0.00 0.00 36.82 39.72 6yas h ILE 48 CO 0.67 0.03 0.00 -0.62 -3.07 0.00 0.00 178.15 175.16 6yas n GLU 49 N -3.27 0.10 0.00 2.19 4.71 -1.26 -1.40 120.64 121.71 6yas n GLU 49 Ca -0.02 0.33 0.12 0.00 -0.01 0.00 0.00 57.16 57.59 6yas n GLU 49 Cb 0.18 -1.68 0.27 0.00 -1.01 0.00 0.00 31.44 29.20 6yas n GLU 49 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 6yas n GLU 50 N -1.86 0.73 -4.37 3.49 1.02 -0.93 -4.84 120.64 113.88 6yas n GLU 50 Ca 0.03 -0.47 -0.34 0.00 -0.02 0.00 0.00 57.16 56.36 6yas n GLU 50 Cb 0.20 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 30.01 6yas n GLU 50 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 6yas s ILE 51 N -2.60 3.98 -1.09 -3.67 -1.09 -0.49 -5.00 121.20 111.25 6yas s ILE 51 Ca 0.21 -0.33 0.09 0.00 -2.23 0.00 0.00 60.65 58.39 6yas s ILE 51 Cb 0.19 -2.75 0.06 0.00 -1.58 0.00 0.00 42.46 38.37 6yas s ILE 51 CO 0.57 0.49 0.75 0.61 -1.23 0.00 0.00 174.94 176.13 6yas n GLY 52 N 3.51 -0.45 3.60 6.18 0.00 -1.26 -4.96 105.19 111.81 6yas n GLY 52 Ca -0.17 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 6yas n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 6yas s SER 53 N -0.88 -0.40 0.38 1.61 1.04 -1.26 -4.99 113.70 109.18 6yas s SER 53 Ca 0.10 -0.22 0.11 0.00 0.48 0.00 0.00 55.95 56.42 6yas s SER 53 Cb 0.08 0.59 0.74 0.00 0.10 0.00 0.00 66.02 67.53 6yas s SER 53 CO 0.14 -1.02 1.86 0.15 0.98 0.00 0.00 173.24 175.35 6yas h PHE 54 N 2.00 0.12 -0.45 5.02 3.04 -1.90 -0.38 116.94 124.38 6yas h PHE 54 Ca -0.27 -0.02 -0.08 0.00 3.98 0.00 0.00 57.97 61.58 6yas h PHE 54 Cb 1.27 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 39.74 6yas h PHE 54 CO 0.31 0.38 -0.05 -0.44 -2.02 0.00 0.00 178.31 176.49 6yas h ASP 55 N 0.10 0.81 -0.57 0.41 5.19 -1.98 -1.60 116.42 118.79 6yas h ASP 55 Ca 0.01 -0.33 -0.06 0.00 -0.62 0.00 0.00 57.03 56.03 6yas h ASP 55 Cb 0.55 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.81 6yas h ASP 55 CO 0.04 0.95 0.15 -0.33 -3.12 0.00 0.00 179.24 176.94 6yas h GLU 56 N 0.66 0.95 -0.57 3.56 5.08 -1.82 -2.74 114.58 119.70 6yas h GLU 56 Ca 0.12 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 6yas h GLU 56 Cb 0.57 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 6yas h GLU 56 CO 0.03 0.84 0.33 -0.92 -1.00 0.00 0.00 179.01 178.29 6yas h TYR 57 N 0.91 0.75 0.00 4.33 3.20 -0.86 -2.30 116.97 122.99 6yas h TYR 57 Ca 0.20 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.07 6yas h TYR 57 Cb 0.32 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.34 6yas h TYR 57 CO 0.02 0.51 0.00 0.43 -1.64 0.00 0.00 178.16 177.48 6yas n SER 58 N -4.41 0.00 -0.19 -2.11 7.64 -0.62 -1.92 113.62 112.01 6yas n SER 58 Ca 0.05 -0.91 -0.01 0.00 1.01 0.00 0.00 58.87 59.01 6yas n SER 58 Cb 0.08 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.36 6yas n SER 58 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 6yas h GLU 59 N 0.00 0.05 -0.66 1.43 4.22 -1.41 -1.23 114.58 116.99 6yas h GLU 59 Ca 0.00 -0.00 0.09 0.00 0.08 0.00 0.00 59.36 59.53 6yas h GLU 59 Cb 0.00 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 6yas h GLU 59 CO 0.00 0.04 0.44 -1.35 -2.18 0.00 0.00 179.01 175.95 6yas h PRO 60 N 0.06 0.53 -0.16 0.92 0.11 -1.86 -0.71 132.00 130.88 6yas h PRO 60 Ca 0.29 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.26 6yas h PRO 60 Cb 0.46 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.45 6yas h PRO 60 CO -0.54 0.35 -0.31 1.25 -0.21 0.00 0.00 178.00 178.54 6yas h LEU 61 N 0.54 0.55 -0.44 2.35 5.85 -1.57 -1.47 115.31 121.11 6yas h LEU 61 Ca 0.30 -0.55 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 6yas h LEU 61 Cb 0.46 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 6yas h LEU 61 CO -0.09 1.00 0.21 -0.07 -0.34 0.00 0.00 178.44 179.14 6yas h LEU 62 N 0.13 0.58 -0.79 2.25 3.38 -1.05 -1.04 115.31 118.76 6yas h LEU 62 Ca 0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 6yas h LEU 62 Cb 0.90 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 6yas h LEU 62 CO 0.07 0.54 0.46 0.74 0.09 0.00 0.00 178.44 180.34 6yas h THR 63 N 0.58 1.23 -0.31 0.22 2.02 -1.18 -0.03 112.91 115.43 6yas h THR 63 Ca 0.15 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 6yas h THR 63 Cb 0.12 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 6yas h THR 63 CO -0.02 0.25 0.14 0.15 0.37 0.00 0.00 175.52 176.41 6yas h PHE 64 N 1.10 0.45 0.00 3.16 3.57 -1.03 -2.70 116.94 121.49 6yas h PHE 64 Ca 0.28 -0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.67 6yas h PHE 64 Cb -0.00 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 6yas h PHE 64 CO -0.00 0.42 -0.41 -0.07 -2.23 0.00 0.00 178.31 176.02 6yas h LEU 65 N 0.35 0.00 -1.18 0.59 3.38 -0.74 -2.44 115.31 115.27 6yas h LEU 65 Ca 0.10 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 6yas h LEU 65 Cb 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 6yas h LEU 65 CO -0.01 0.41 -0.05 -0.08 0.09 0.00 0.00 178.44 178.79 6yas h GLU 66 N 0.00 0.50 0.00 1.13 4.57 -0.81 -3.00 114.58 116.98 6yas h GLU 66 Ca -0.00 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 6yas h GLU 66 Cb 0.78 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.30 6yas h GLU 66 CO 0.05 0.57 0.00 0.00 -1.18 0.00 0.00 179.01 178.45 6yas n ALA 67 N -2.48 2.29 -1.97 2.92 0.00 -0.93 -4.86 120.51 115.48 6yas n ALA 67 Ca 0.01 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 52.94 6yas n ALA 67 Cb 0.28 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 6yas n ALA 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 6yas s LEU 68 N -2.94 4.45 0.39 0.00 1.43 -1.14 -4.99 118.68 115.88 6yas s LEU 68 Ca 0.15 2.33 -0.27 0.00 -1.03 0.00 0.00 54.13 55.31 6yas s LEU 68 Cb 0.18 -3.61 -0.10 0.00 0.03 0.00 0.00 46.19 42.69 6yas s LEU 68 CO 0.50 -0.41 1.43 -2.84 0.23 0.00 0.00 176.35 175.26 6yas s PRO 69 N -0.50 4.01 0.13 1.29 0.02 -1.26 -4.92 135.00 133.76 6yas s PRO 69 Ca 0.53 2.45 -0.35 0.00 0.02 0.00 0.00 61.00 63.65 6yas s PRO 69 Cb -0.34 -2.88 -0.16 0.00 0.02 0.00 0.00 34.50 31.13 6yas s PRO 69 CO 0.39 -0.56 1.21 -2.30 -0.33 0.00 0.00 177.00 175.41 6yas n PRO 70 N 0.30 1.03 -0.36 5.54 -0.02 -1.26 -2.01 135.00 138.22 6yas n PRO 70 Ca 0.02 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 6yas n PRO 70 Cb 0.41 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 6yas n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 6yas n GLY 71 N 2.17 0.92 3.70 -1.23 0.00 -1.26 -5.05 105.19 104.45 6yas n GLY 71 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 6yas n GLY 71 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 6yas s GLU 72 N -0.51 4.19 0.08 1.61 2.12 -0.85 -5.09 118.70 120.24 6yas s GLU 72 Ca 0.00 -0.05 0.08 0.00 0.36 0.00 0.00 54.97 55.37 6yas s GLU 72 Cb 0.00 -3.47 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 6yas s GLU 72 CO 0.00 0.17 -0.20 0.15 -0.54 0.00 0.00 175.26 174.84 6yas s LYS 73 N 0.71 1.87 0.24 4.30 1.02 -1.26 -4.73 119.74 121.89 6yas s LYS 73 Ca 0.13 -1.10 0.10 0.00 0.02 0.00 0.00 55.97 55.11 6yas s LYS 73 Cb -0.13 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 35.03 6yas s LYS 73 CO 0.03 0.51 -0.17 0.14 -0.92 0.00 0.00 175.35 174.94 6yas s VAL 74 N -0.99 2.08 -0.26 3.17 -7.23 -0.23 -4.52 120.40 112.41 6yas s VAL 74 Ca 0.15 -2.30 -0.08 0.00 -1.81 0.00 0.00 61.98 57.94 6yas s VAL 74 Cb -0.10 -2.17 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 6yas s VAL 74 CO 0.06 -0.50 0.08 -0.63 -0.31 0.00 0.00 175.10 173.80 6yas s ILE 75 N -2.76 4.31 0.10 -0.62 1.01 -0.25 -0.59 121.20 122.40 6yas s ILE 75 Ca 0.26 -0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.40 6yas s ILE 75 Cb -0.03 -3.06 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 6yas s ILE 75 CO 0.11 0.28 0.79 -0.76 0.00 0.00 0.00 174.94 175.36 6yas s LEU 76 N 1.60 4.51 -0.23 2.97 1.43 -0.67 -1.02 118.68 127.28 6yas s LEU 76 Ca 0.06 1.57 -0.02 0.00 -1.03 0.00 0.00 54.13 54.71 6yas s LEU 76 Cb -0.16 -3.30 0.07 0.00 0.03 0.00 0.00 46.19 42.83 6yas s LEU 76 CO 0.04 0.08 0.03 -0.69 0.23 0.00 0.00 176.35 176.04 6yas s VAL 77 N -0.47 0.85 -0.05 -1.59 1.01 0.21 -0.08 120.40 120.29 6yas s VAL 77 Ca 0.38 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.50 6yas s VAL 77 Cb -0.22 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 6yas s VAL 77 CO 0.25 -0.29 -0.15 -0.83 0.00 0.00 0.00 175.10 174.08 6yas s GLY 78 N 1.69 1.51 0.01 4.51 0.00 -0.56 -0.62 107.32 113.86 6yas s GLY 78 Ca 0.00 -0.99 0.02 0.00 0.00 0.00 0.00 44.72 43.75 6yas s GLY 78 CO -0.11 -0.78 0.01 -1.83 0.00 0.00 0.00 173.10 170.39 6yas s GLU 79 N -0.74 2.80 4.08 2.90 -1.05 -0.87 -1.32 118.70 124.50 6yas s GLU 79 Ca 0.11 -0.63 0.00 0.00 -0.15 0.00 0.00 54.97 54.31 6yas s GLU 79 Cb -0.11 -2.68 0.00 0.00 -0.44 0.00 0.00 34.13 30.91 6yas s GLU 79 CO 0.00 0.61 0.00 0.45 0.95 0.00 0.00 175.26 177.28 6yas n SER 80 N 1.22 0.00 0.00 0.83 2.88 -0.95 -1.32 113.62 116.28 6yas n SER 80 Ca -0.14 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.49 6yas n SER 80 Cb 0.53 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 64.42 6yas n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 6yas h GLY 82 N 2.94 0.00 2.00 0.00 0.00 -1.38 -1.15 103.07 105.48 6yas h GLY 82 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 6yas h GLY 82 CO 0.00 0.00 -0.11 -1.33 0.00 0.00 0.00 176.54 175.10 6yas h GLY 83 N 0.00 0.00 1.66 4.60 0.00 -1.74 -1.35 103.07 106.23 6yas h GLY 83 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.25 6yas h GLY 83 CO -0.00 0.00 -0.50 1.41 0.00 0.00 0.00 176.54 177.45 6yas h LEU 84 N 0.00 0.40 -0.97 3.11 3.38 -1.45 -2.48 115.31 117.30 6yas h LEU 84 Ca -0.00 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.67 6yas h LEU 84 Cb 0.21 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 6yas h LEU 84 CO 0.01 0.83 -0.48 0.78 0.09 0.00 0.00 178.44 179.68 6yas h ASN 85 N 0.29 0.09 -0.48 -0.43 2.35 -1.40 -2.60 115.58 113.40 6yas h ASN 85 Ca 0.01 -0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.64 6yas h ASN 85 Cb 0.98 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 39.31 6yas h ASN 85 CO 0.08 0.56 -0.01 0.40 -1.65 0.00 0.00 177.43 176.80 6yas h ILE 86 N 0.07 1.26 -0.58 2.81 2.04 -1.23 -2.08 117.51 119.80 6yas h ILE 86 Ca 0.00 -1.09 -0.03 0.00 1.00 0.00 0.00 64.86 64.75 6yas h ILE 86 Cb 0.87 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 6yas h ILE 86 CO 0.07 0.38 0.26 0.00 0.00 0.00 0.00 178.15 178.86 6yas h ALA 87 N 0.92 0.75 -0.23 1.87 0.00 -1.16 -0.44 119.26 120.96 6yas h ALA 87 Ca 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 6yas h ALA 87 Cb 0.53 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 6yas h ALA 87 CO 0.03 0.33 0.09 0.82 0.00 0.00 0.00 179.25 180.52 6yas h ILE 88 N 0.79 1.17 -0.24 0.00 2.04 -1.49 -2.75 117.51 117.01 6yas h ILE 88 Ca 0.20 -0.52 -0.12 0.00 1.00 0.00 0.00 64.86 65.42 6yas h ILE 88 Cb 0.15 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 6yas h ILE 88 CO -0.02 0.17 -0.35 0.00 0.00 0.00 0.00 178.15 177.95 6yas h ALA 89 N 0.93 0.95 0.00 1.87 0.00 -1.22 -3.15 119.26 118.64 6yas h ALA 89 Ca 0.08 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 6yas h ALA 89 Cb 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 6yas h ALA 89 CO -0.01 0.62 -0.28 0.00 0.00 0.00 0.00 179.25 179.58 6yas h ALA 90 N 1.18 1.01 0.00 0.00 0.00 -1.02 0.91 119.26 121.34 6yas h ALA 90 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.70 6yas h ALA 90 Cb 0.82 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.56 6yas h ALA 90 CO 0.07 0.35 0.00 -0.44 0.00 0.00 0.00 179.25 179.23 6yas h ASP 91 N 0.00 0.00 0.00 0.00 3.32 -1.44 -2.57 116.42 115.73 6yas h ASP 91 Ca -0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 6yas h ASP 91 Cb 0.82 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.33 6yas h ASP 91 CO 0.04 0.00 -1.71 1.17 -1.72 0.00 0.00 179.24 177.01 6yas n LYS 92 N -2.84 1.98 -2.33 3.56 4.81 -0.88 -4.79 118.16 117.67 6yas n LYS 92 Ca 0.02 0.01 -0.07 0.00 -0.87 0.00 0.00 58.31 57.40 6yas n LYS 92 Cb 0.33 -1.26 0.05 0.00 0.02 0.00 0.00 35.03 34.16 6yas n LYS 92 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 6yas n TYR 93 N -2.47 1.54 0.25 5.64 4.01 0.26 -4.89 117.16 121.51 6yas n TYR 93 Ca -0.18 -1.97 0.17 0.00 -0.16 0.00 0.00 57.90 55.75 6yas n TYR 93 Cb 0.82 -0.26 0.88 0.00 -0.31 0.00 0.00 39.34 40.47 6yas n TYR 93 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 6yas h GLU 95 N 0.00 0.00 -0.00 0.00 3.07 -1.90 -2.66 114.58 113.09 6yas h GLU 95 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 6yas h GLU 95 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 6yas h GLU 95 CO -0.00 0.23 -0.26 1.63 -1.40 0.00 0.00 179.01 179.21 6yas n LYS 96 N -3.68 0.47 -3.74 2.33 5.02 -0.05 -4.85 118.16 113.66 6yas n LYS 96 Ca -0.01 -0.23 -0.37 0.00 -2.02 0.00 0.00 58.31 55.68 6yas n LYS 96 Cb 0.35 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.74 6yas n LYS 96 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 6yas s ILE 97 N -2.69 4.12 0.24 -0.18 1.01 -1.00 -1.07 121.20 121.62 6yas s ILE 97 Ca 0.21 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 60.27 6yas s ILE 97 Cb 0.19 -3.10 -0.01 0.00 0.01 0.00 0.00 42.46 39.55 6yas s ILE 97 CO 0.56 0.10 1.60 0.00 0.00 0.00 0.00 174.94 177.19 6yas h ALA 98 N 8.26 0.88 -1.28 9.38 0.00 -1.14 -3.47 119.26 131.89 6yas h ALA 98 Ca -0.32 -0.46 0.30 0.00 0.00 0.00 0.00 54.91 54.42 6yas h ALA 98 Cb 1.13 -0.10 -0.19 0.00 0.00 0.00 0.00 17.79 18.64 6yas h ALA 98 CO 0.60 0.65 0.89 0.00 0.00 0.00 0.00 179.25 181.40 6yas s ALA 99 N -4.09 -2.15 0.01 0.00 0.00 -1.25 -4.42 121.76 109.85 6yas s ALA 99 Ca -0.06 1.65 0.07 0.00 0.00 0.00 0.00 51.96 53.62 6yas s ALA 99 Cb 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 6yas s ALA 99 CO 0.81 -0.62 -0.22 0.00 0.00 0.00 0.00 175.76 175.73 6yas s ALA 100 N -2.25 1.84 -0.17 0.00 0.00 -0.67 -1.67 121.76 118.84 6yas s ALA 100 Ca 0.11 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.07 6yas s ALA 100 Cb -0.00 -0.43 0.01 0.00 0.00 0.00 0.00 23.12 22.70 6yas s ALA 100 CO -0.04 0.44 -0.18 0.08 0.00 0.00 0.00 175.76 176.06 6yas s VAL 101 N -0.62 2.27 -0.35 0.00 1.01 0.89 -1.30 120.40 122.30 6yas s VAL 101 Ca 0.08 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 61.01 6yas s VAL 101 Cb -0.09 -1.96 -0.00 0.00 0.00 0.00 0.00 36.38 34.33 6yas s VAL 101 CO 0.00 0.53 0.47 -0.36 0.00 0.00 0.00 175.10 175.73 6yas s PHE 102 N 1.15 3.19 -0.38 5.22 0.40 0.36 -1.50 117.98 126.41 6yas s PHE 102 Ca 0.01 0.09 -0.05 0.00 -0.60 0.00 0.00 56.93 56.38 6yas s PHE 102 Cb -0.14 -2.85 0.08 0.00 0.51 0.00 0.00 43.02 40.62 6yas s PHE 102 CO -0.08 -0.52 0.17 -1.58 0.70 0.00 0.00 175.22 173.91 6yas s HIS 103 N 2.27 3.40 -1.45 0.36 5.65 -0.43 -0.42 115.29 124.67 6yas s HIS 103 Ca 0.16 -1.89 -0.02 0.00 0.25 0.00 0.00 55.06 53.56 6yas s HIS 103 Cb -0.16 -2.81 0.00 0.00 -1.18 0.00 0.00 32.58 28.43 6yas s HIS 103 CO 0.13 -0.87 0.04 0.09 -0.65 0.00 0.00 174.74 173.48 6yas n ASN 104 N 4.74 0.59 -4.49 9.88 3.02 -0.71 -2.23 115.26 126.05 6yas n ASN 104 Ca -0.08 -1.22 -0.26 0.00 -0.03 0.00 0.00 54.58 52.99 6yas n ASN 104 Cb 0.43 -1.51 -0.10 0.00 -0.61 0.00 0.00 39.78 37.98 6yas n ASN 104 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 6yas s SER 105 N -4.27 3.77 0.49 6.41 0.15 -1.26 -2.48 113.70 116.50 6yas s SER 105 Ca 0.03 -0.80 -0.23 0.00 0.70 0.00 0.00 55.95 55.65 6yas s SER 105 Cb -0.02 -0.44 -0.07 0.00 -1.71 0.00 0.00 66.02 63.79 6yas s SER 105 CO 0.95 0.09 1.26 0.68 1.20 0.00 0.00 173.24 177.42 6yas s VAL 106 N -1.90 2.63 -0.47 4.45 -7.23 -0.51 -4.90 120.40 112.48 6yas s VAL 106 Ca 0.25 0.49 0.03 0.00 -1.81 0.00 0.00 61.98 60.93 6yas s VAL 106 Cb -0.07 -3.25 0.14 0.00 0.56 0.00 0.00 36.38 33.75 6yas s VAL 106 CO 0.13 0.00 0.25 -0.22 -0.31 0.00 0.00 175.10 174.96 6yas s LEU 107 N -3.15 3.15 0.79 1.32 2.96 -1.26 -4.30 118.68 118.18 6yas s LEU 107 Ca 0.66 -2.78 -0.14 0.00 -0.22 0.00 0.00 54.13 51.66 6yas s LEU 107 Cb -0.34 -1.20 0.07 0.00 0.50 0.00 0.00 46.19 45.22 6yas s LEU 107 CO 0.42 -0.25 1.21 -2.84 -1.32 0.00 0.00 176.35 173.57 6yas s PRO 108 N 0.12 1.78 0.07 0.98 0.02 -1.26 -4.93 135.00 131.78 6yas s PRO 108 Ca 0.18 1.76 0.00 0.00 0.02 0.00 0.00 61.00 62.96 6yas s PRO 108 Cb -0.23 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.50 6yas s PRO 108 CO -0.01 -2.11 0.00 -0.40 -0.33 0.00 0.00 177.00 174.15 6yas n ASP 109 N -3.13 2.14 -0.62 2.53 5.68 -1.26 -5.05 116.55 116.84 6yas n ASP 109 Ca 0.13 -1.31 0.06 0.00 -0.50 0.00 0.00 54.79 53.18 6yas n ASP 109 Cb 0.50 0.05 0.12 0.00 -1.14 0.00 0.00 41.12 40.65 6yas n ASP 109 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 6yas n THR 110 N -0.21 0.59 -0.09 2.12 -2.24 -1.26 -4.40 114.28 108.80 6yas n THR 110 Ca -0.03 -0.80 -0.09 0.00 -2.27 0.00 0.00 64.05 60.86 6yas n THR 110 Cb 0.09 0.81 -0.12 0.00 -2.10 0.00 0.00 70.33 69.00 6yas n THR 110 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 6yas n GLU 111 N 0.65 1.16 -4.51 -0.78 4.07 -1.26 -4.80 120.64 115.16 6yas n GLU 111 Ca 0.11 0.02 -0.30 0.00 -0.06 0.00 0.00 57.16 56.93 6yas n GLU 111 Cb 0.39 -1.42 -0.07 0.00 -0.06 0.00 0.00 31.44 30.27 6yas n GLU 111 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 6yas s HIS 112 N -2.40 2.11 0.70 4.31 3.76 -1.26 -5.13 115.29 117.37 6yas s HIS 112 Ca -0.12 -0.81 -0.13 0.00 -0.15 0.00 0.00 55.06 53.84 6yas s HIS 112 Cb 0.05 -1.75 0.02 0.00 1.11 0.00 0.00 32.58 32.02 6yas s HIS 112 CO 0.64 0.18 1.10 0.00 -0.85 0.00 0.00 174.74 175.82 6yas h PRO 114 N -0.35 0.00 0.00 0.00 0.11 -1.80 -2.17 132.00 127.79 6yas h PRO 114 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 6yas h PRO 114 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 6yas h PRO 114 CO 0.53 0.00 -0.35 -1.13 -0.21 0.00 0.00 178.00 176.84 6yas n SER 115 N -3.53 0.35 -0.37 -2.05 3.41 -1.25 -4.58 113.62 105.61 6yas n SER 115 Ca 0.02 -0.01 -0.09 0.00 -0.26 0.00 0.00 58.87 58.53 6yas n SER 115 Cb 0.41 0.02 -0.07 0.00 -0.26 0.00 0.00 64.21 64.31 6yas n SER 115 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 6yas h TYR 116 N 0.00 -1.67 -0.11 7.33 3.20 -1.74 0.89 116.97 124.87 6yas h TYR 116 Ca 0.00 0.12 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 6yas h TYR 116 Cb 0.51 0.85 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 6yas h TYR 116 CO 0.00 -0.39 -0.11 0.28 -1.64 0.00 0.00 178.16 176.30 6yas h VAL 117 N -0.06 1.14 0.03 1.81 2.07 -1.83 -1.49 116.25 117.92 6yas h VAL 117 Ca 0.19 -0.63 -0.23 0.00 0.82 0.00 0.00 66.70 66.85 6yas h VAL 117 Cb 0.48 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 6yas h VAL 117 CO -0.89 0.19 -0.99 0.58 0.02 0.00 0.00 177.57 176.48 6yas h VAL 118 N 0.16 1.44 -0.60 2.57 2.07 -1.37 -1.99 116.25 118.53 6yas h VAL 118 Ca 0.03 -2.61 -0.08 0.00 0.82 0.00 0.00 66.70 64.87 6yas h VAL 118 Cb 0.30 2.54 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 6yas h VAL 118 CO 0.02 0.77 0.07 0.44 0.02 0.00 0.00 177.57 178.89 6yas h ASP 119 N 0.17 0.94 -0.56 0.57 3.32 -0.53 -2.23 116.42 118.10 6yas h ASP 119 Ca -0.08 -0.22 -0.11 0.00 0.02 0.00 0.00 57.03 56.63 6yas h ASP 119 Cb 1.64 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.93 6yas h ASP 119 CO 0.17 0.96 -0.08 0.50 -1.72 0.00 0.00 179.24 179.06 6yas h LYS 120 N 0.92 1.04 -0.61 3.56 1.63 -1.19 -2.54 116.57 119.39 6yas h LYS 120 Ca 0.18 -0.37 0.03 0.00 -0.85 0.00 0.00 60.65 59.64 6yas h LYS 120 Cb 0.43 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.96 6yas h LYS 120 CO 0.01 1.06 0.40 1.25 -3.45 0.00 0.00 179.45 178.73 6yas h LEU 121 N 0.93 0.63 -0.97 5.20 5.85 -1.01 -1.72 115.31 124.23 6yas h LEU 121 Ca 0.15 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 6yas h LEU 121 Cb 0.65 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 6yas h LEU 121 CO 0.04 0.44 -0.48 0.24 -0.34 0.00 0.00 178.44 178.34 6yas h MET 122 N 0.74 0.00 -0.16 1.25 2.86 -1.01 -0.10 114.93 118.51 6yas h MET 122 Ca 0.24 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.84 6yas h MET 122 Cb 0.05 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 6yas h MET 122 CO -0.06 0.48 -0.07 0.93 1.06 0.00 0.00 176.91 179.25 6yas h GLU 123 N 0.00 0.34 -0.05 1.72 5.08 -1.01 -3.16 114.58 117.50 6yas h GLU 123 Ca -0.00 -0.14 -0.19 0.00 -1.00 0.00 0.00 59.36 58.03 6yas h GLU 123 Cb 0.91 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 6yas h GLU 123 CO 0.06 0.64 -0.76 0.28 -1.00 0.00 0.00 179.01 178.23 6yas h VAL 124 N 0.02 1.40 -2.68 3.13 2.07 -1.23 -3.38 116.25 115.58 6yas h VAL 124 Ca 0.04 -2.24 -0.60 0.00 0.82 0.00 0.00 66.70 64.71 6yas h VAL 124 Cb 0.54 2.20 -0.40 0.00 -1.52 0.00 0.00 31.29 32.11 6yas h VAL 124 CO 0.02 0.67 -0.78 0.33 0.02 0.00 0.00 177.57 177.83 6yas n PHE 125 N -3.80 1.14 0.28 1.57 7.35 -0.06 -4.98 117.46 118.97 6yas n PHE 125 Ca -0.04 -3.80 0.12 0.00 -0.76 0.00 0.00 57.45 52.96 6yas n PHE 125 Cb 0.73 -0.18 0.10 0.00 0.35 0.00 0.00 39.48 40.47 6yas n PHE 125 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 6yas h PRO 126 N 5.43 0.00 -4.71 -7.13 0.13 -1.74 -3.42 132.00 120.56 6yas h PRO 126 Ca 0.21 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.65 6yas h PRO 126 Cb 0.83 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.70 6yas h PRO 126 CO 0.55 0.00 -0.58 0.34 -0.23 0.00 0.00 178.00 178.07 6yas s ASP 127 N -5.15 5.38 -0.28 1.44 2.15 -1.26 -4.93 116.67 114.02 6yas s ASP 127 Ca 0.03 -0.87 0.12 0.00 0.43 0.00 0.00 52.55 52.26 6yas s ASP 127 Cb 0.10 -1.93 0.78 0.00 -0.30 0.00 0.00 42.92 41.57 6yas s ASP 127 CO 0.74 -0.28 1.78 0.79 -0.17 0.00 0.00 175.17 178.03 6yas n TRP 128 N 4.90 2.25 0.00 -5.34 7.02 -1.26 -5.03 117.44 119.98 6yas n TRP 128 Ca -0.13 -0.97 0.00 0.00 -1.02 0.00 0.00 57.50 55.38 6yas n TRP 128 Cb 0.47 -0.60 0.00 0.00 -2.42 0.00 0.00 31.31 28.76 6yas n TRP 128 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 6yas n LYS 129 N 0.21 0.00 -0.37 -0.99 5.02 -1.26 -2.16 118.16 118.61 6yas n LYS 129 Ca 0.34 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.66 6yas n LYS 129 Cb 1.29 0.00 0.16 0.00 -0.02 0.00 0.00 35.03 36.46 6yas n LYS 129 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 6yas n ASP 130 N 5.91 2.95 -4.74 4.39 5.75 -1.26 -4.91 116.55 124.64 6yas n ASP 130 Ca 0.00 -2.39 -0.41 0.00 -0.01 0.00 0.00 54.79 51.97 6yas n ASP 130 Cb 0.00 -0.58 -0.03 0.00 -1.03 0.00 0.00 41.12 39.49 6yas n ASP 130 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 6yas s THR 131 N -1.71 2.80 0.09 2.12 2.01 -0.92 -3.96 115.64 116.07 6yas s THR 131 Ca 0.22 0.66 0.05 0.00 0.31 0.00 0.00 61.69 62.93 6yas s THR 131 Cb 0.17 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 6yas s THR 131 CO 0.06 0.10 0.00 0.42 -0.69 0.00 0.00 174.62 174.51 6yas s THR 132 N 0.16 4.04 0.20 -0.82 -4.23 -0.71 -4.87 115.64 109.41 6yas s THR 132 Ca 0.60 -0.98 0.11 0.00 -1.18 0.00 0.00 61.69 60.24 6yas s THR 132 Cb -0.41 -2.92 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 6yas s THR 132 CO 0.41 0.12 -0.23 -0.31 -0.54 0.00 0.00 174.62 174.07 6yas s TYR 133 N -1.31 2.32 0.10 3.99 2.02 -1.26 -0.90 117.35 122.30 6yas s TYR 133 Ca 0.26 -0.35 -0.12 0.00 -0.37 0.00 0.00 57.07 56.49 6yas s TYR 133 Cb -0.12 -1.13 0.01 0.00 -0.40 0.00 0.00 41.96 40.33 6yas s TYR 133 CO 0.18 0.53 0.27 -0.59 -1.57 0.00 0.00 175.55 174.37 6yas s PHE 134 N -1.77 0.01 0.11 2.71 -0.71 -0.60 -4.99 117.98 112.74 6yas s PHE 134 Ca 0.22 -0.38 0.10 0.00 -1.04 0.00 0.00 56.93 55.83 6yas s PHE 134 Cb -0.08 0.07 -0.04 0.00 -1.21 0.00 0.00 43.02 41.76 6yas s PHE 134 CO 0.11 -0.60 -0.23 0.95 -1.34 0.00 0.00 175.22 174.10 6yas s THR 135 N -3.78 2.49 0.17 -4.49 -4.23 -1.26 -0.17 115.64 104.36 6yas s THR 135 Ca 0.04 -1.59 -0.05 0.00 -1.18 0.00 0.00 61.69 58.91 6yas s THR 135 Cb 0.03 -2.10 -0.03 0.00 1.34 0.00 0.00 72.50 71.75 6yas s THR 135 CO -0.11 0.14 0.18 -0.72 -0.54 0.00 0.00 174.62 173.57 6yas s TYR 136 N -1.05 0.73 0.01 3.99 1.13 -0.44 -4.95 117.35 116.77 6yas s TYR 136 Ca 0.15 -1.07 0.05 0.00 -1.41 0.00 0.00 57.07 54.80 6yas s TYR 136 Cb -0.10 -0.30 -0.03 0.00 -1.10 0.00 0.00 41.96 40.43 6yas s TYR 136 CO 0.07 -0.65 -0.15 0.99 -2.51 0.00 0.00 175.55 173.30 6yas s THR 137 N -4.04 3.04 -0.24 -3.49 2.01 -1.26 -0.58 115.64 111.07 6yas s THR 137 Ca 0.25 -0.96 -0.12 0.00 0.31 0.00 0.00 61.69 61.17 6yas s THR 137 Cb 0.05 -2.26 0.09 0.00 0.01 0.00 0.00 72.50 70.39 6yas s THR 137 CO 0.04 0.43 0.57 -0.75 -0.69 0.00 0.00 174.62 174.22 6yas s LYS 138 N -1.22 0.54 -1.52 4.92 2.36 -0.74 -4.93 119.74 119.16 6yas s LYS 138 Ca 0.14 1.14 -0.08 0.00 -2.55 0.00 0.00 55.97 54.63 6yas s LYS 138 Cb -0.11 0.30 0.06 0.00 -1.05 0.00 0.00 37.83 37.03 6yas s LYS 138 CO 0.04 -0.18 0.61 -0.25 1.55 0.00 0.00 175.35 177.13 6yas n ASP 139 N 4.73 -1.85 0.00 1.43 8.00 -1.26 -1.78 116.55 125.82 6yas n ASP 139 Ca -0.17 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.35 6yas n ASP 139 Cb 0.54 -3.07 0.00 0.00 -0.02 0.00 0.00 41.12 38.57 6yas n ASP 139 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 6yas n GLY 140 N -1.75 2.59 3.83 0.44 0.00 -1.26 -5.01 105.19 104.03 6yas n GLY 140 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 6yas n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 6yas s LYS 141 N -0.01 3.73 -0.20 1.61 1.02 -0.74 -5.08 119.74 120.08 6yas s LYS 141 Ca 0.00 -0.06 -0.22 0.00 0.02 0.00 0.00 55.97 55.71 6yas s LYS 141 Cb 0.00 -3.26 -0.02 0.00 -0.52 0.00 0.00 37.83 34.03 6yas s LYS 141 CO 0.00 0.62 0.70 -2.00 -0.92 0.00 0.00 175.35 173.75 6yas s GLU 142 N -0.61 4.22 -0.04 1.68 2.12 -1.26 -1.79 118.70 123.02 6yas s GLU 142 Ca 0.15 0.74 0.05 0.00 0.36 0.00 0.00 54.97 56.26 6yas s GLU 142 Cb -0.12 -3.59 -0.02 0.00 0.26 0.00 0.00 34.13 30.65 6yas s GLU 142 CO 0.04 -0.30 -0.17 0.42 -0.54 0.00 0.00 175.26 174.71 6yas s ILE 143 N 2.11 2.84 -0.32 -3.70 1.01 0.25 -4.96 121.20 118.43 6yas s ILE 143 Ca 0.31 -0.81 -0.13 0.00 0.00 0.00 0.00 60.65 60.02 6yas s ILE 143 Cb -0.16 -2.09 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 6yas s ILE 143 CO 0.10 0.59 0.27 -0.89 0.00 0.00 0.00 174.94 175.01 6yas s THR 144 N -0.71 5.25 0.34 2.92 2.01 -1.26 -1.32 115.64 122.87 6yas s THR 144 Ca 0.11 0.01 0.04 0.00 0.31 0.00 0.00 61.69 62.16 6yas s THR 144 Cb -0.10 -3.70 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 6yas s THR 144 CO 0.00 0.04 0.50 -0.83 -0.69 0.00 0.00 174.62 173.65 6yas s GLY 145 N 1.73 1.44 0.05 4.40 0.00 0.76 -4.36 107.32 111.34 6yas s GLY 145 Ca 0.09 -1.21 -0.05 0.00 0.00 0.00 0.00 44.72 43.55 6yas s GLY 145 CO 0.11 -1.14 0.07 0.48 0.00 0.00 0.00 173.10 172.62 6yas s LEU 146 N -4.24 1.95 -0.14 0.66 2.34 -0.26 -1.56 118.68 117.43 6yas s LEU 146 Ca 0.42 -0.71 -0.01 0.00 0.06 0.00 0.00 54.13 53.89 6yas s LEU 146 Cb -0.09 0.56 0.04 0.00 -0.56 0.00 0.00 46.19 46.13 6yas s LEU 146 CO 0.33 -0.58 -0.05 -0.75 -1.06 0.00 0.00 176.35 174.23 6yas s LYS 147 N -3.30 1.39 0.03 1.48 2.20 -0.08 -1.71 119.74 119.75 6yas s LYS 147 Ca 0.01 -0.38 -0.32 0.00 -0.36 0.00 0.00 55.97 54.92 6yas s LYS 147 Cb 0.03 -1.79 -0.11 0.00 -1.51 0.00 0.00 37.83 34.45 6yas s LYS 147 CO -0.08 -0.37 1.88 1.28 -0.36 0.00 0.00 175.35 177.70 6yas n LEU 148 N 4.92 3.83 -4.77 5.43 4.77 -1.26 -1.73 117.00 128.19 6yas n LEU 148 Ca -0.12 0.96 -0.33 0.00 -0.03 0.00 0.00 56.01 56.50 6yas n LEU 148 Cb 0.49 -1.47 0.06 0.00 -2.33 0.00 0.00 43.42 40.16 6yas n LEU 148 CO 0.16 0.08 0.73 -0.83 -1.33 0.00 0.00 177.39 176.20 6yas s GLY 149 N 3.65 2.06 0.30 -0.72 0.00 -1.25 -4.87 107.32 106.49 6yas s GLY 149 Ca 0.88 0.49 0.14 0.00 0.00 0.00 0.00 44.72 46.22 6yas s GLY 149 CO 0.44 0.84 1.64 0.74 0.00 0.00 0.00 173.10 176.75 6yas h PHE 150 N -0.19 0.00 -0.10 1.90 0.04 -1.93 -1.13 116.94 115.52 6yas h PHE 150 Ca -0.46 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.14 6yas h PHE 150 Cb 1.24 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.40 6yas h PHE 150 CO 0.55 0.54 -0.60 1.15 -0.60 0.00 0.00 178.31 179.36 6yas h THR 151 N 0.00 1.35 -0.74 -1.55 2.02 -1.93 -1.50 112.91 110.55 6yas h THR 151 Ca -0.01 -1.89 -0.01 0.00 0.77 0.00 0.00 66.41 65.27 6yas h THR 151 Cb 1.06 2.18 -0.04 0.00 -1.74 0.00 0.00 68.15 69.62 6yas h THR 151 CO 0.07 0.58 0.44 0.25 0.37 0.00 0.00 175.52 177.23 6yas h LEU 152 N 0.22 0.90 0.02 2.58 5.85 -1.84 0.15 115.31 123.19 6yas h LEU 152 Ca -0.05 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.62 6yas h LEU 152 Cb 1.24 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 6yas h LEU 152 CO 0.12 0.71 -0.12 0.25 -0.34 0.00 0.00 178.44 179.06 6yas h LEU 153 N 1.02 -0.34 -0.08 2.25 5.85 -1.15 -0.87 115.31 121.98 6yas h LEU 153 Ca 0.27 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 6yas h LEU 153 Cb -0.02 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 6yas h LEU 153 CO -0.05 -0.17 0.02 -0.09 -0.34 0.00 0.00 178.44 177.81 6yas h ARG 154 N -0.21 0.13 0.20 1.25 9.65 -1.12 0.51 114.38 124.79 6yas h ARG 154 Ca 0.04 -0.03 -0.34 0.00 -1.10 0.00 0.00 59.98 58.54 6yas h ARG 154 Cb 0.25 -0.02 0.02 0.00 -1.39 0.00 0.00 29.97 28.83 6yas h ARG 154 CO -0.10 0.34 -1.67 0.93 2.80 0.00 0.00 179.97 182.27 6yas h GLU 155 N -0.10 0.42 0.00 0.20 5.08 -0.94 -3.14 114.58 116.10 6yas h GLU 155 Ca 0.02 -0.72 -0.31 0.00 -1.00 0.00 0.00 59.36 57.35 6yas h GLU 155 Cb 0.27 0.27 -0.06 0.00 0.50 0.00 0.00 28.75 29.73 6yas h GLU 155 CO 0.00 1.33 -2.18 0.09 -1.00 0.00 0.00 179.01 177.25 6yas n ASN 156 N -3.61 1.26 -0.11 1.42 4.13 -0.36 -4.31 115.26 113.68 6yas n ASN 156 Ca -0.22 -0.03 -0.19 0.00 1.68 0.00 0.00 54.58 55.82 6yas n ASN 156 Cb 1.08 0.55 -0.12 0.00 -1.54 0.00 0.00 39.78 39.75 6yas n ASN 156 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 6yas n LEU 157 N -2.78 2.93 -1.78 3.41 4.32 -1.04 -3.89 117.00 118.18 6yas n LEU 157 Ca -0.31 -0.09 -0.19 0.00 -0.02 0.00 0.00 56.01 55.40 6yas n LEU 157 Cb 1.01 -0.94 0.08 0.00 -1.62 0.00 0.00 43.42 41.95 6yas n LEU 157 CO 0.32 0.93 0.52 -1.22 -1.22 0.00 0.00 177.39 176.71 6yas n TYR 158 N -3.30 2.26 -0.27 -1.77 4.02 0.15 -3.28 117.16 114.97 6yas n TYR 158 Ca -0.44 -2.18 0.01 0.00 -0.01 0.00 0.00 57.90 55.28 6yas n TYR 158 Cb 1.00 -0.56 0.08 0.00 -0.02 0.00 0.00 39.34 39.84 6yas n TYR 158 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 6yas h THR 159 N 1.63 0.22 -0.40 -0.72 2.02 -1.73 -2.13 112.91 111.80 6yas h THR 159 Ca 0.35 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.53 6yas h THR 159 Cb 1.39 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 6yas h THR 159 CO 0.76 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.83 6yas n LEU 160 N -5.50 3.39 -4.80 2.58 4.32 -1.26 -4.95 117.00 110.78 6yas n LEU 160 Ca 0.10 -2.24 -0.34 0.00 -0.02 0.00 0.00 56.01 53.51 6yas n LEU 160 Cb 0.39 -0.35 -0.05 0.00 -1.62 0.00 0.00 43.42 41.79 6yas n LEU 160 CO -0.02 0.75 0.69 0.00 -1.22 0.00 0.00 177.39 177.60 6yas s GLY 162 N -2.01 1.96 0.55 0.00 0.00 -1.26 -4.75 107.32 101.81 6yas s GLY 162 Ca 0.65 0.64 0.25 0.00 0.00 0.00 0.00 44.72 46.25 6yas s GLY 162 CO 0.18 1.03 2.09 -0.56 0.00 0.00 0.00 173.10 175.84 6yas h PRO 163 N -1.03 0.00 0.00 2.90 0.13 -1.97 -0.92 132.00 131.10 6yas h PRO 163 Ca -0.45 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.61 6yas h PRO 163 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 6yas h PRO 163 CO 0.47 0.00 -0.33 1.05 -0.23 0.00 0.00 178.00 178.96 6yas h GLU 164 N 0.00 0.00 0.23 0.86 9.09 -1.99 0.27 114.58 123.04 6yas h GLU 164 Ca 0.11 0.00 -0.33 0.00 0.05 0.00 0.00 59.36 59.19 6yas h GLU 164 Cb 0.50 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.63 6yas h GLU 164 CO -0.00 0.33 -1.50 0.93 0.05 0.00 0.00 179.01 178.82 6yas h GLU 165 N 0.00 0.49 -0.08 1.06 4.39 -1.56 -3.20 114.58 115.69 6yas h GLU 165 Ca -0.00 -0.84 -0.06 0.00 0.34 0.00 0.00 59.36 58.80 6yas h GLU 165 Cb 1.14 0.31 -0.01 0.00 -0.10 0.00 0.00 28.75 30.09 6yas h GLU 165 CO 0.04 1.40 -0.23 -0.92 -1.16 0.00 0.00 179.01 178.14 6yas h TYR 166 N 0.13 0.14 -0.70 4.33 3.20 -1.23 -3.00 116.97 119.84 6yas h TYR 166 Ca -0.26 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.55 6yas h TYR 166 Cb 2.14 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 40.34 6yas h TYR 166 CO 0.12 0.36 0.30 1.49 -1.64 0.00 0.00 178.16 178.79 6yas h GLU 167 N 0.12 1.04 -0.81 1.82 4.57 -1.00 -2.31 114.58 118.01 6yas h GLU 167 Ca 0.02 -0.18 0.03 0.00 -1.18 0.00 0.00 59.36 58.05 6yas h GLU 167 Cb 0.48 -0.17 -0.05 0.00 -0.16 0.00 0.00 28.75 28.85 6yas h GLU 167 CO 0.03 0.85 0.52 -0.07 -1.18 0.00 0.00 179.01 179.16 6yas h LEU 168 N 1.00 0.87 -0.25 1.64 3.38 -1.52 -1.86 115.31 118.57 6yas h LEU 168 Ca 0.24 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.21 6yas h LEU 168 Cb 0.18 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 6yas h LEU 168 CO -0.02 0.60 0.14 0.00 0.09 0.00 0.00 178.44 179.25 6yas h ALA 169 N 1.34 0.30 -0.32 1.53 0.00 -1.46 0.15 119.26 120.80 6yas h ALA 169 Ca 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 6yas h ALA 169 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 6yas h ALA 169 CO -0.11 -0.25 0.16 0.87 0.00 0.00 0.00 179.25 179.92 6yas h LYS 170 N 0.30 0.44 0.09 0.00 1.57 -1.04 -1.54 116.57 116.38 6yas h LYS 170 Ca 0.10 -0.04 -0.28 0.00 -1.87 0.00 0.00 60.65 58.55 6yas h LYS 170 Cb -0.01 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 6yas h LYS 170 CO -0.04 0.34 -1.41 0.52 -0.57 0.00 0.00 179.45 178.29 6yas h MET 171 N 0.44 0.19 0.00 3.15 2.86 -1.06 -3.41 114.93 117.12 6yas h MET 171 Ca 0.11 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 6yas h MET 171 Cb 0.04 0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.82 6yas h MET 171 CO -0.02 1.06 -1.42 1.28 1.06 0.00 0.00 176.91 178.87 6yas n LEU 172 N -3.42 0.06 -4.75 1.22 4.77 0.51 -4.98 117.00 110.40 6yas n LEU 172 Ca -0.12 -0.05 -0.41 0.00 -0.03 0.00 0.00 56.01 55.39 6yas n LEU 172 Cb 1.02 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.09 6yas n LEU 172 CO 0.50 0.01 1.00 0.42 -1.33 0.00 0.00 177.39 178.00 6yas s THR 173 N -2.73 2.97 0.45 -5.08 -4.23 -0.59 -4.79 115.64 101.64 6yas s THR 173 Ca -0.03 0.85 0.06 0.00 -1.18 0.00 0.00 61.69 61.39 6yas s THR 173 Cb 0.08 -3.54 -0.04 0.00 1.34 0.00 0.00 72.50 70.34 6yas s THR 173 CO 0.48 0.15 0.16 -0.13 -0.54 0.00 0.00 174.62 174.74 6yas s ARG 174 N -0.67 2.19 0.34 3.99 0.52 -0.79 -5.01 118.95 119.51 6yas s ARG 174 Ca 0.55 -1.99 -0.29 0.00 -0.52 0.00 0.00 55.73 53.48 6yas s ARG 174 Cb -0.38 -1.88 -0.10 0.00 0.52 0.00 0.00 34.95 33.10 6yas s ARG 174 CO 0.43 -0.21 1.34 0.15 0.02 0.00 0.00 175.30 177.03 6yas s LYS 175 N -3.93 4.31 0.08 3.54 1.02 -1.26 -4.41 119.74 119.10 6yas s LYS 175 Ca 0.34 2.28 0.01 0.00 0.02 0.00 0.00 55.97 58.61 6yas s LYS 175 Cb 0.04 -3.06 -0.00 0.00 -0.52 0.00 0.00 37.83 34.29 6yas s LYS 175 CO 0.19 -0.25 0.09 0.41 -0.92 0.00 0.00 175.35 174.87 6yas n GLY 176 N 0.79 3.31 3.30 -3.33 0.00 -0.69 -4.66 105.19 103.90 6yas n GLY 176 Ca 0.00 -1.57 -0.14 0.00 0.00 0.00 0.00 46.02 44.31 6yas n GLY 176 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 6yas s SER 177 N -1.54 -0.31 0.18 1.61 0.15 -1.26 -1.11 113.70 111.43 6yas s SER 177 Ca 0.08 0.29 0.24 0.00 0.70 0.00 0.00 55.95 57.26 6yas s SER 177 Cb 0.00 0.41 0.30 0.00 -1.71 0.00 0.00 66.02 65.02 6yas s SER 177 CO 0.06 -0.45 1.32 -0.07 1.20 0.00 0.00 173.24 175.30 6yas h LEU 178 N 3.86 0.00 -0.21 3.45 3.38 -1.98 -3.48 115.31 120.33 6yas h LEU 178 Ca -0.29 -0.12 -0.44 0.00 0.09 0.00 0.00 57.88 57.13 6yas h LEU 178 Cb 1.17 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.86 6yas h LEU 178 CO 0.38 0.06 -0.67 0.49 0.09 0.00 0.00 178.44 178.78 6yas n PHE 179 N -2.38 -2.03 -0.10 1.13 3.72 -1.26 -4.89 117.46 111.66 6yas n PHE 179 Ca 0.03 0.69 -0.08 0.00 -0.05 0.00 0.00 57.45 58.04 6yas n PHE 179 Cb 0.48 -3.56 -0.01 0.00 -0.94 0.00 0.00 39.48 35.45 6yas n PHE 179 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 6yas h GLN 180 N -1.55 0.40 0.00 -1.08 4.15 -1.93 -1.10 115.11 114.01 6yas h GLN 180 Ca -0.52 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 58.87 6yas h GLN 180 Cb 1.34 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.94 6yas h GLN 180 CO 0.62 0.27 -0.05 -2.95 -1.93 0.00 0.00 178.83 174.79 6yas h ASN 181 N 0.42 0.00 0.50 -0.69 -1.07 -1.94 -2.26 115.58 110.53 6yas h ASN 181 Ca 0.13 0.00 -0.29 0.00 0.07 0.00 0.00 56.30 56.20 6yas h ASN 181 Cb -0.02 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.19 6yas h ASN 181 CO -0.05 0.05 -1.65 0.40 0.07 0.00 0.00 177.43 176.25 6yas h ILE 182 N 0.00 0.94 -0.36 6.14 2.04 -1.75 -3.31 117.51 121.21 6yas h ILE 182 Ca -0.00 -2.75 -0.05 0.00 1.00 0.00 0.00 64.86 63.06 6yas h ILE 182 Cb 0.11 2.50 -0.02 0.00 -0.74 0.00 0.00 36.82 38.68 6yas h ILE 182 CO 0.01 0.61 0.01 -0.07 0.00 0.00 0.00 178.15 178.71 6yas h LEU 183 N 0.01 0.52 -1.35 1.44 3.38 -0.91 -1.91 115.31 116.50 6yas h LEU 183 Ca -0.27 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 6yas h LEU 183 Cb 1.99 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.58 6yas h LEU 183 CO 0.09 0.59 0.13 0.00 0.09 0.00 0.00 178.44 179.34 6yas h ALA 184 N 1.48 1.49 -0.01 1.53 0.00 -1.51 -2.45 119.26 119.79 6yas h ALA 184 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.89 6yas h ALA 184 Cb 0.33 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.96 6yas h ALA 184 CO 0.01 0.39 -0.34 1.63 0.00 0.00 0.00 179.25 180.93 6yas n LYS 185 N -4.36 1.04 -2.22 0.00 5.02 -0.96 -4.76 118.16 111.93 6yas n LYS 185 Ca 0.03 -0.74 -0.39 0.00 -2.02 0.00 0.00 58.31 55.19 6yas n LYS 185 Cb 0.17 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.68 6yas n LYS 185 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 6yas s ARG 186 N -2.47 4.02 0.43 1.97 3.52 -0.76 -5.01 118.95 120.65 6yas s ARG 186 Ca 0.22 1.93 -0.23 0.00 -0.13 0.00 0.00 55.73 57.52 6yas s ARG 186 Cb 0.19 -2.70 -0.11 0.00 -1.56 0.00 0.00 34.95 30.77 6yas s ARG 186 CO 0.54 -0.38 0.85 -0.35 -0.81 0.00 0.00 175.30 175.15 6yas n PRO 187 N 0.09 1.05 -1.72 5.12 -0.04 -1.26 -4.56 135.00 133.67 6yas n PRO 187 Ca 0.04 0.38 -0.36 0.00 -0.04 0.00 0.00 63.50 63.52 6yas n PRO 187 Cb 0.46 -1.86 0.07 0.00 -0.04 0.00 0.00 33.50 32.12 6yas n PRO 187 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 6yas s PHE 188 N -1.34 2.14 0.42 0.54 0.40 -1.26 -4.75 117.98 114.13 6yas s PHE 188 Ca 0.64 1.52 -0.25 0.00 -0.60 0.00 0.00 56.93 58.24 6yas s PHE 188 Cb -0.57 -3.59 -0.08 0.00 0.51 0.00 0.00 43.02 39.29 6yas s PHE 188 CO 0.57 -2.69 1.20 -0.06 0.70 0.00 0.00 175.22 174.94 6yas s PHE 189 N -1.59 2.94 0.39 0.36 0.08 -1.26 -5.00 117.98 113.89 6yas s PHE 189 Ca 0.79 1.51 -0.03 0.00 0.12 0.00 0.00 56.93 59.33 6yas s PHE 189 Cb -0.34 -3.47 -0.04 0.00 -0.57 0.00 0.00 43.02 38.61 6yas s PHE 189 CO 0.40 -1.59 0.64 0.95 -0.10 0.00 0.00 175.22 175.52 6yas s THR 190 N -1.40 5.01 0.14 0.64 -4.23 -1.26 -4.56 115.64 109.97 6yas s THR 190 Ca 0.59 -0.11 0.11 0.00 -1.18 0.00 0.00 61.69 61.11 6yas s THR 190 Cb -0.32 -3.84 -0.05 0.00 1.34 0.00 0.00 72.50 69.63 6yas s THR 190 CO 0.40 -0.63 1.50 0.11 -0.54 0.00 0.00 174.62 175.46 6yas h LYS 191 N 0.72 0.00 0.00 3.99 1.57 -1.94 0.15 116.57 121.06 6yas h LYS 191 Ca -0.48 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.17 6yas h LYS 191 Cb 1.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 6yas h LYS 191 CO 0.62 0.69 -0.94 0.93 -0.57 0.00 0.00 179.45 180.18 6yas h GLU 192 N 0.00 0.00 0.00 3.15 4.39 -1.94 -1.85 114.58 118.33 6yas h GLU 192 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 6yas h GLU 192 Cb 1.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 6yas h GLU 192 CO 0.09 0.37 0.00 0.41 -1.16 0.00 0.00 179.01 178.72 6yas n GLY 193 N 1.30 0.71 0.32 -3.84 0.00 -1.24 -4.27 105.19 98.16 6yas n GLY 193 Ca -0.03 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.99 6yas n GLY 193 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 6yas h TYR 194 N 0.00 0.97 -0.36 1.61 3.20 -1.54 -2.48 116.97 118.37 6yas h TYR 194 Ca 0.00 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.91 6yas h TYR 194 Cb 0.00 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 37.94 6yas h TYR 194 CO 0.00 0.49 0.24 0.78 -1.64 0.00 0.00 178.16 178.02 6yas h GLY 195 N 0.95 0.48 2.00 1.82 0.00 -0.75 -2.67 103.07 104.90 6yas h GLY 195 Ca 0.37 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.53 6yas h GLY 195 CO -0.18 0.17 0.00 1.48 0.00 0.00 0.00 176.54 178.01 6yas h SER 196 N 0.45 0.00 -3.77 0.19 4.64 -0.84 -3.47 113.55 110.75 6yas h SER 196 Ca 0.14 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.94 6yas h SER 196 Cb 0.00 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.14 6yas h SER 196 CO -0.03 0.00 0.59 -0.63 -0.87 0.00 0.00 176.83 175.89 6yas s ILE 197 N -3.14 3.06 0.10 0.95 1.09 -1.01 -5.00 121.20 117.25 6yas s ILE 197 Ca 0.10 1.02 -0.31 0.00 -1.10 0.00 0.00 60.65 60.36 6yas s ILE 197 Cb 0.11 -3.65 -0.08 0.00 -1.06 0.00 0.00 42.46 37.78 6yas s ILE 197 CO 0.59 0.23 1.50 -0.54 -0.10 0.00 0.00 174.94 176.62 6yas s LYS 198 N -1.37 4.26 -0.11 2.79 3.01 -1.26 -4.97 119.74 122.08 6yas s LYS 198 Ca 0.49 2.20 0.03 0.00 -1.01 0.00 0.00 55.97 57.68 6yas s LYS 198 Cb -0.37 -3.34 0.00 0.00 -1.01 0.00 0.00 37.83 33.11 6yas s LYS 198 CO 0.46 -0.57 -0.22 0.15 0.51 0.00 0.00 175.35 175.68 6yas s LYS 199 N 1.64 2.93 -0.21 1.68 -0.14 -1.26 -1.67 119.74 122.71 6yas s LYS 199 Ca 0.68 -0.83 -0.01 0.00 -1.36 0.00 0.00 55.97 54.45 6yas s LYS 199 Cb -0.39 -2.28 0.01 0.00 -1.68 0.00 0.00 37.83 33.49 6yas s LYS 199 CO 0.30 0.10 -0.11 0.42 -0.76 0.00 0.00 175.35 175.30 6yas s ILE 200 N 0.54 2.72 -0.40 2.17 1.09 -0.42 -0.34 121.20 126.56 6yas s ILE 200 Ca -0.14 -0.77 -0.14 0.00 -1.10 0.00 0.00 60.65 58.50 6yas s ILE 200 Cb -0.17 -2.23 0.02 0.00 -1.06 0.00 0.00 42.46 39.02 6yas s ILE 200 CO 0.05 0.44 0.27 -0.47 -0.10 0.00 0.00 174.94 175.13 6yas s TYR 201 N 1.37 3.24 -0.18 3.97 6.14 0.17 -0.48 117.35 131.58 6yas s TYR 201 Ca 0.05 -0.66 -0.08 0.00 0.64 0.00 0.00 57.07 57.01 6yas s TYR 201 Cb -0.14 -2.54 -0.04 0.00 0.42 0.00 0.00 41.96 39.65 6yas s TYR 201 CO -0.08 -0.59 0.11 0.08 0.64 0.00 0.00 175.55 175.71 6yas s VAL 202 N 1.65 5.20 0.24 3.14 1.01 0.45 -0.88 120.40 131.20 6yas s VAL 202 Ca 0.04 0.11 -0.19 0.00 0.00 0.00 0.00 61.98 61.94 6yas s VAL 202 Cb -0.19 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 32.88 6yas s VAL 202 CO 0.09 0.48 0.61 -1.66 0.00 0.00 0.00 175.10 174.63 6yas s TRP 203 N 0.07 -0.11 -0.02 5.22 1.48 -0.62 -1.74 118.94 123.22 6yas s TRP 203 Ca 0.08 -0.27 0.03 0.00 -1.06 0.00 0.00 56.10 54.88 6yas s TRP 203 Cb -0.12 0.52 -0.00 0.00 -1.16 0.00 0.00 33.47 32.71 6yas s TRP 203 CO -0.00 -1.07 -0.11 -0.08 -4.06 0.00 0.00 176.95 171.63 6yas s THR 204 N -3.91 0.89 -1.49 0.66 -1.32 -1.26 -1.16 115.64 108.06 6yas s THR 204 Ca 0.11 -0.46 0.20 0.00 -1.21 0.00 0.00 61.69 60.33 6yas s THR 204 Cb -0.03 -0.76 0.37 0.00 -1.51 0.00 0.00 72.50 70.56 6yas s THR 204 CO 0.03 0.26 1.61 -0.90 -2.21 0.00 0.00 174.62 173.40 6yas n ASP 205 N 2.98 0.00 -0.34 8.08 5.68 -1.26 -2.72 116.55 128.97 6yas n ASP 205 Ca -0.15 -0.06 0.14 0.00 -0.50 0.00 0.00 54.79 54.21 6yas n ASP 205 Cb 0.55 -0.26 0.61 0.00 -1.14 0.00 0.00 41.12 40.89 6yas n ASP 205 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 6yas n GLN 206 N -1.26 1.46 -1.97 0.11 1.13 -1.26 -4.64 117.38 110.96 6yas n GLN 206 Ca 0.10 -0.68 -0.42 0.00 -1.94 0.00 0.00 57.00 54.06 6yas n GLN 206 Cb 0.15 -1.46 -0.03 0.00 0.11 0.00 0.00 30.24 29.01 6yas n GLN 206 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 6yas s ASP 207 N -1.91 6.64 0.00 1.08 -1.08 -1.10 -4.68 116.67 115.62 6yas s ASP 207 Ca 0.39 2.42 0.17 0.00 -0.52 0.00 0.00 52.55 55.01 6yas s ASP 207 Cb 0.20 -2.56 0.49 0.00 -1.46 0.00 0.00 42.92 39.59 6yas s ASP 207 CO 0.33 -0.87 1.40 -0.62 0.52 0.00 0.00 175.17 175.93 6yas n GLU 208 N 5.65 2.11 0.00 4.34 -0.58 -1.26 -4.02 120.64 126.89 6yas n GLU 208 Ca 0.16 -1.71 0.00 0.00 -0.42 0.00 0.00 57.16 55.18 6yas n GLU 208 Cb 0.41 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 29.88 6yas n GLU 208 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 6yas n ILE 209 N 0.90 0.00 -2.71 -3.67 -0.00 -1.25 -4.78 119.36 107.84 6yas n ILE 209 Ca 0.17 0.00 -0.43 0.00 -0.00 0.00 0.00 62.75 62.48 6yas n ILE 209 Cb 0.42 -1.13 0.00 0.00 -0.00 0.00 0.00 39.64 38.93 6yas n ILE 209 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 6yas n PHE 210 N -2.80 4.13 -1.55 1.39 3.01 -1.26 -4.81 117.46 115.58 6yas n PHE 210 Ca 0.00 -3.13 -0.37 0.00 1.01 0.00 0.00 57.45 54.96 6yas n PHE 210 Cb 0.34 -2.08 0.07 0.00 -0.01 0.00 0.00 39.48 37.80 6yas n PHE 210 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 6yas n LEU 211 N 4.86 3.93 -0.29 4.37 4.77 -1.26 -4.64 117.00 128.74 6yas n LEU 211 Ca 0.38 0.75 0.18 0.00 -0.03 0.00 0.00 56.01 57.29 6yas n LEU 211 Cb 0.40 -1.41 0.46 0.00 -2.33 0.00 0.00 43.42 40.53 6yas n LEU 211 CO 0.70 -1.84 1.22 -0.65 -1.33 0.00 0.00 177.39 175.49 6yas h PRO 212 N 0.21 0.49 -0.56 3.23 0.11 -1.82 -1.04 132.00 132.63 6yas h PRO 212 Ca -0.48 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.60 6yas h PRO 212 Cb 1.35 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 6yas h PRO 212 CO 0.50 0.33 0.37 1.49 -0.21 0.00 0.00 178.00 180.47 6yas h GLU 213 N 0.51 0.72 -0.23 1.05 4.81 -1.99 0.32 114.58 119.78 6yas h GLU 213 Ca 0.52 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.62 6yas h GLU 213 Cb 1.16 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.37 6yas h GLU 213 CO -0.25 0.48 -0.19 0.35 -0.73 0.00 0.00 179.01 178.66 6yas h PHE 214 N 0.75 0.64 -0.36 0.92 3.57 -1.55 -2.47 116.94 118.43 6yas h PHE 214 Ca 0.21 -0.18 -0.12 0.00 3.53 0.00 0.00 57.97 61.41 6yas h PHE 214 Cb -0.07 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 6yas h PHE 214 CO -0.04 0.86 -0.25 1.96 -2.23 0.00 0.00 178.31 178.60 6yas h GLN 215 N 0.24 0.72 0.00 1.11 4.20 -1.14 -1.67 115.11 118.58 6yas h GLN 215 Ca 0.04 -0.30 -0.15 0.00 0.06 0.00 0.00 58.65 58.30 6yas h GLN 215 Cb 0.73 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 6yas h GLN 215 CO 0.05 0.90 -0.73 -0.07 -0.67 0.00 0.00 178.83 178.32 6yas h LEU 216 N 0.63 0.00 -0.68 1.46 3.38 -1.03 -2.79 115.31 116.28 6yas h LEU 216 Ca 0.08 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 6yas h LEU 216 Cb 0.76 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 6yas h LEU 216 CO 0.06 0.73 0.13 -0.25 0.09 0.00 0.00 178.44 179.19 6yas h TRP 217 N 0.00 1.19 -0.45 1.13 7.01 -1.20 -2.49 115.95 121.14 6yas h TRP 217 Ca -0.01 -0.16 -0.08 0.00 2.11 0.00 0.00 58.89 60.75 6yas h TRP 217 Cb 1.31 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 28.02 6yas h TRP 217 CO 0.00 0.98 -0.05 1.96 -2.79 0.00 0.00 178.44 178.55 6yas h GLN 218 N 1.05 0.83 -0.92 2.65 4.20 -1.10 -0.21 115.11 121.60 6yas h GLN 218 Ca 0.21 -0.29 0.04 0.00 0.06 0.00 0.00 58.65 58.67 6yas h GLN 218 Cb 0.42 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.09 6yas h GLN 218 CO 0.01 0.91 0.60 0.82 -0.67 0.00 0.00 178.83 180.50 6yas h ILE 219 N 0.66 1.14 0.03 2.54 2.04 -1.50 -1.99 117.51 120.43 6yas h ILE 219 Ca 0.12 -0.39 -0.22 0.00 1.00 0.00 0.00 64.86 65.37 6yas h ILE 219 Cb 0.57 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 6yas h ILE 219 CO 0.03 0.21 -0.98 -0.08 0.00 0.00 0.00 178.15 177.33 6yas h GLU 220 N 1.13 0.27 -0.34 2.37 4.57 -1.24 -3.17 114.58 118.17 6yas h GLU 220 Ca 0.37 -0.33 -0.09 0.00 -1.18 0.00 0.00 59.36 58.14 6yas h GLU 220 Cb 0.04 0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.72 6yas h GLU 220 CO -0.12 1.06 -0.15 -0.97 -1.18 0.00 0.00 179.01 177.65 6yas h ASN 221 N 0.13 0.59 -1.67 1.04 -1.24 -0.57 -3.40 115.58 110.47 6yas h ASN 221 Ca -0.07 -0.17 -0.17 0.00 0.71 0.00 0.00 56.30 56.60 6yas h ASN 221 Cb 1.64 -0.16 -0.28 0.00 0.73 0.00 0.00 38.32 40.25 6yas h ASN 221 CO 0.16 0.76 -0.51 -0.47 -1.29 0.00 0.00 177.43 176.07 6yas s TYR 222 N -4.70 -1.05 -0.01 0.67 5.04 -0.79 -5.09 117.35 111.42 6yas s TYR 222 Ca -0.08 0.46 -0.30 0.00 -2.44 0.00 0.00 57.07 54.71 6yas s TYR 222 Cb 0.14 -0.09 -0.07 0.00 0.35 0.00 0.00 41.96 42.29 6yas s TYR 222 CO 0.80 -0.96 1.76 0.15 -1.34 0.00 0.00 175.55 175.96 6yas s LYS 223 N 2.57 4.17 0.79 4.97 3.01 -1.20 -4.50 119.74 129.55 6yas s LYS 223 Ca 0.10 2.36 -0.10 0.00 -1.01 0.00 0.00 55.97 57.32 6yas s LYS 223 Cb -0.13 -3.99 0.07 0.00 -1.01 0.00 0.00 37.83 32.77 6yas s LYS 223 CO -0.28 -0.87 1.10 -2.14 0.51 0.00 0.00 175.35 173.67 6yas s PRO 224 N 3.99 2.07 0.38 -1.68 0.02 -1.26 -4.96 135.00 133.57 6yas s PRO 224 Ca 0.79 1.22 0.16 0.00 0.02 0.00 0.00 61.00 63.18 6yas s PRO 224 Cb -0.37 -1.87 0.78 0.00 0.02 0.00 0.00 34.50 33.05 6yas s PRO 224 CO 0.34 -1.79 1.82 -0.44 -0.33 0.00 0.00 177.00 176.60 6yas h ASP 225 N -1.24 0.00 -4.62 2.53 3.32 -1.08 -3.45 116.42 111.89 6yas h ASP 225 Ca -0.43 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.51 6yas h ASP 225 Cb 1.24 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.57 6yas h ASP 225 CO 0.50 0.36 -0.18 -0.54 -1.72 0.00 0.00 179.24 177.66 6yas s LYS 226 N -4.02 0.67 -0.07 3.56 1.02 -1.11 -5.02 119.74 114.77 6yas s LYS 226 Ca -0.02 0.14 0.04 0.00 0.02 0.00 0.00 55.97 56.15 6yas s LYS 226 Cb 0.13 0.31 0.00 0.00 -0.52 0.00 0.00 37.83 37.76 6yas s LYS 226 CO 0.70 -0.16 -0.18 0.08 -0.92 0.00 0.00 175.35 174.87 6yas s VAL 227 N -0.79 1.54 -0.11 3.17 1.01 -1.26 -0.66 120.40 123.30 6yas s VAL 227 Ca -0.09 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.18 6yas s VAL 227 Cb -0.04 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 35.01 6yas s VAL 227 CO 0.04 0.44 -0.19 -0.31 0.00 0.00 0.00 175.10 175.09 6yas s TYR 228 N 0.32 2.25 -0.20 5.22 1.51 -0.06 -4.96 117.35 121.43 6yas s TYR 228 Ca -0.12 -1.05 -0.03 0.00 -1.01 0.00 0.00 57.07 54.86 6yas s TYR 228 Cb -0.15 -1.57 -0.01 0.00 -0.11 0.00 0.00 41.96 40.12 6yas s TYR 228 CO 0.05 -0.50 -0.05 0.21 -1.11 0.00 0.00 175.55 174.15 6yas s LYS 229 N 0.80 3.41 -0.14 -0.62 2.20 -1.26 -1.59 119.74 122.53 6yas s LYS 229 Ca -0.09 -0.62 -0.19 0.00 -0.36 0.00 0.00 55.97 54.70 6yas s LYS 229 Cb -0.16 -2.95 -0.04 0.00 -1.51 0.00 0.00 37.83 33.18 6yas s LYS 229 CO 0.01 -0.10 0.52 0.08 -0.36 0.00 0.00 175.35 175.50 6yas s VAL 230 N 1.22 5.14 0.00 4.02 1.01 -0.31 -4.98 120.40 126.51 6yas s VAL 230 Ca 0.03 1.02 -0.28 0.00 0.00 0.00 0.00 61.98 62.75 6yas s VAL 230 Cb -0.14 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 6yas s VAL 230 CO -0.02 0.26 0.91 -1.61 0.00 0.00 0.00 175.10 174.64 6yas s GLU 231 N 1.03 4.55 2.19 2.72 0.41 -1.26 -4.40 118.70 123.93 6yas s GLU 231 Ca 0.27 1.29 0.00 0.00 -0.41 0.00 0.00 54.97 56.12 6yas s GLU 231 Cb -0.15 -3.44 0.00 0.00 -1.78 0.00 0.00 34.13 28.75 6yas s GLU 231 CO 0.11 0.03 0.00 0.41 -0.49 0.00 0.00 175.26 175.32 6yas n GLY 232 N 2.83 -1.02 7.00 -1.39 0.00 -1.26 -5.07 105.19 106.28 6yas n GLY 232 Ca 0.03 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.76 6yas n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 6yas n GLY 233 N 0.00 -1.34 0.00 -0.02 0.00 -1.26 -4.62 105.19 97.95 6yas n GLY 233 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.82 6yas n GLY 233 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 6yas n ASP 234 N -0.91 0.05 0.05 1.61 5.68 -1.26 -4.72 116.55 117.05 6yas n ASP 234 Ca 0.00 -0.02 0.02 0.00 -0.50 0.00 0.00 54.79 54.29 6yas n ASP 234 Cb 0.00 0.00 0.38 0.00 -1.14 0.00 0.00 41.12 40.36 6yas n ASP 234 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 6yas h HIS 235 N 0.02 0.41 -2.19 2.11 -0.00 -1.81 -3.29 115.15 110.40 6yas h HIS 235 Ca 0.00 -0.03 -0.77 0.00 -0.00 0.00 0.00 60.37 59.57 6yas h HIS 235 Cb 0.00 -0.13 -0.21 0.00 -0.00 0.00 0.00 27.41 27.08 6yas h HIS 235 CO 0.00 0.40 1.39 1.63 -0.00 0.00 0.00 177.93 181.35 6yas n LYS 236 N -4.34 3.83 0.28 5.26 4.76 -1.21 -4.80 118.16 121.94 6yas n LYS 236 Ca 0.01 -3.98 0.14 0.00 -2.87 0.00 0.00 58.31 51.61 6yas n LYS 236 Cb 0.20 -2.78 0.81 0.00 -1.84 0.00 0.00 35.03 31.41 6yas n LYS 236 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 6yas h LEU 237 N 7.33 0.00 -0.06 -0.35 3.38 -1.94 -0.32 115.31 123.35 6yas h LEU 237 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 6yas h LEU 237 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 6yas h LEU 237 CO 1.41 0.08 0.00 0.00 0.09 0.00 0.00 178.44 180.02 6yas n GLN 238 N -3.63 0.03 -0.11 1.13 0.00 -1.26 -1.04 117.38 112.49 6yas n GLN 238 Ca -0.02 0.19 -0.18 0.00 0.00 0.00 0.00 57.00 56.99 6yas n GLN 238 Cb 0.19 -1.54 -0.10 0.00 0.00 0.00 0.00 30.24 28.79 6yas n GLN 238 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 6yas n LEU 239 N -1.59 2.62 0.08 2.61 4.77 -0.19 -4.24 117.00 121.06 6yas n LEU 239 Ca 0.04 -0.01 0.11 0.00 -0.03 0.00 0.00 56.01 56.13 6yas n LEU 239 Cb 0.23 -0.75 -0.04 0.00 -2.33 0.00 0.00 43.42 40.54 6yas n LEU 239 CO 0.18 0.77 -0.16 0.35 -1.33 0.00 0.00 177.39 177.20 6yas n THR 240 N -3.39 0.53 -2.69 -5.08 -2.24 -0.85 -4.39 114.28 96.16 6yas n THR 240 Ca -0.41 -0.55 -0.05 0.00 -2.27 0.00 0.00 64.05 60.77 6yas n THR 240 Cb 0.89 -0.29 0.04 0.00 -2.10 0.00 0.00 70.33 68.87 6yas n THR 240 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 6yas n LYS 241 N -2.61 2.00 -0.19 -0.78 4.76 -0.20 -4.84 118.16 116.30 6yas n LYS 241 Ca -0.01 -3.61 -0.00 0.00 -2.87 0.00 0.00 58.31 51.82 6yas n LYS 241 Cb 0.57 -1.69 0.10 0.00 -1.84 0.00 0.00 35.03 32.17 6yas n LYS 241 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 6yas h THR 242 N 4.78 0.68 -0.44 -0.18 2.02 -1.70 -1.24 112.91 116.82 6yas h THR 242 Ca -0.05 -0.10 -0.10 0.00 0.77 0.00 0.00 66.41 66.94 6yas h THR 242 Cb 1.30 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 6yas h THR 242 CO 0.31 0.05 -0.12 0.50 0.37 0.00 0.00 175.52 176.64 6yas h LYS 243 N 0.28 0.81 -0.59 6.66 3.64 -1.93 -0.16 116.57 125.28 6yas h LYS 243 Ca 0.30 -0.28 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 6yas h LYS 243 Cb 0.42 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 6yas h LYS 243 CO -0.37 0.89 0.04 0.93 -2.27 0.00 0.00 179.45 178.67 6yas h GLU 244 N 0.73 1.02 -0.45 1.90 3.07 -1.79 -1.67 114.58 117.39 6yas h GLU 244 Ca 0.12 -0.30 -0.12 0.00 -0.50 0.00 0.00 59.36 58.55 6yas h GLU 244 Cb 0.61 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 6yas h GLU 244 CO 0.04 0.99 -0.20 0.82 -1.40 0.00 0.00 179.01 179.25 6yas h ILE 245 N 0.92 1.27 -0.11 3.13 1.08 -0.83 -1.90 117.51 121.07 6yas h ILE 245 Ca 0.17 -1.36 -0.06 0.00 -0.39 0.00 0.00 64.86 63.23 6yas h ILE 245 Cb 0.50 1.18 -0.01 0.00 -3.07 0.00 0.00 36.82 35.42 6yas h ILE 245 CO 0.02 0.46 -0.19 0.00 -0.69 0.00 0.00 178.15 177.76 6yas h ALA 246 N 0.85 1.49 -0.40 1.87 0.00 -0.89 -1.22 119.26 120.97 6yas h ALA 246 Ca 0.10 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 6yas h ALA 246 Cb 0.78 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 6yas h ALA 246 CO 0.06 0.36 -0.13 0.93 0.00 0.00 0.00 179.25 180.48 6yas h GLU 247 N 0.17 0.79 -0.56 0.00 5.08 -0.97 -2.26 114.58 116.82 6yas h GLU 247 Ca 0.03 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 6yas h GLU 247 Cb 0.43 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 6yas h GLU 247 CO 0.03 0.94 0.30 0.82 -1.00 0.00 0.00 179.01 180.09 6yas h ILE 248 N 0.60 1.19 0.00 3.13 2.04 -1.00 -2.45 117.51 121.02 6yas h ILE 248 Ca 0.10 -0.49 -0.08 0.00 1.00 0.00 0.00 64.86 65.39 6yas h ILE 248 Cb 0.66 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 6yas h ILE 248 CO 0.05 0.21 -0.38 -0.07 0.00 0.00 0.00 178.15 177.96 6yas h LEU 249 N 0.76 0.00 -0.26 1.44 3.38 -1.14 -0.92 115.31 118.56 6yas h LEU 249 Ca 0.20 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 6yas h LEU 249 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 6yas h LEU 249 CO -0.03 0.38 -0.19 -0.61 0.09 0.00 0.00 178.44 178.07 6yas h GLN 250 N 0.00 0.59 -0.71 1.13 5.75 -1.27 0.26 115.11 120.87 6yas h GLN 250 Ca -0.00 -0.29 -0.04 0.00 -0.15 0.00 0.00 58.65 58.17 6yas h GLN 250 Cb 0.71 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.23 6yas h GLN 250 CO 0.05 0.87 0.28 1.49 -2.65 0.00 0.00 178.83 178.87 6yas h GLU 251 N 0.32 1.04 -0.57 1.69 4.81 -1.07 -0.67 114.58 120.13 6yas h GLU 251 Ca 0.05 -0.18 -0.10 0.00 -0.13 0.00 0.00 59.36 59.00 6yas h GLU 251 Cb 0.73 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 6yas h GLU 251 CO 0.05 0.85 -0.04 0.28 -0.73 0.00 0.00 179.01 179.42 6yas h VAL 252 N 1.02 1.26 -0.65 0.32 2.07 -0.97 -2.32 116.25 116.98 6yas h VAL 252 Ca 0.24 -1.19 -0.03 0.00 0.82 0.00 0.00 66.70 66.54 6yas h VAL 252 Cb 0.20 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 6yas h VAL 252 CO -0.02 0.43 0.27 0.00 0.02 0.00 0.00 177.57 178.27 6yas h ALA 253 N 1.01 1.26 0.00 1.67 0.00 -0.49 -1.77 119.26 120.93 6yas h ALA 253 Ca 0.16 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 6yas h ALA 253 Cb 0.60 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 6yas h ALA 253 CO 0.04 0.55 -0.01 -0.44 0.00 0.00 0.00 179.25 179.39 6yas h ASP 254 N 0.93 0.00 0.03 0.00 3.32 -0.82 -3.35 116.42 116.54 6yas h ASP 254 Ca 0.22 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.89 6yas h ASP 254 Cb 0.16 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.66 6yas h ASP 254 CO -0.02 0.01 -2.22 0.41 -1.72 0.00 0.00 179.24 175.70 6yas n THR 255 N -3.11 1.57 -4.13 0.35 -1.04 -0.90 -4.89 114.28 102.14 6yas n THR 255 Ca 0.02 -0.47 -0.36 0.00 -2.04 0.00 0.00 64.05 61.20 6yas n THR 255 Cb 0.38 -1.70 -0.08 0.00 -1.82 0.00 0.00 70.33 67.11 6yas n THR 255 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 6yas s TYR 256 N -2.50 3.37 0.00 -1.42 2.02 -0.71 -5.12 117.35 112.99 6yas s TYR 256 Ca -0.32 0.35 0.00 0.00 -0.37 0.00 0.00 57.07 56.73 6yas s TYR 256 Cb 0.10 -1.87 0.00 0.00 -0.40 0.00 0.00 41.96 39.79 6yas s TYR 256 CO 0.61 0.59 0.00 0.27 -1.57 0.00 0.00 175.55 175.45