#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t6g n PRO 2 N 0.00 -0.68 -4.42 3.23 -0.02 -1.26 -4.77 135.00 127.07 1t6g n PRO 2 Ca 0.00 -0.14 -0.34 0.00 -2.02 0.00 0.00 63.50 61.00 1t6g n PRO 2 Cb 0.00 -2.24 -0.12 0.00 -0.02 0.00 0.00 33.50 31.12 1t6g n PRO 2 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1t6g s VAL 3 N -2.56 3.90 -0.11 -1.45 1.01 -0.11 -1.59 120.40 119.49 1t6g s VAL 3 Ca 0.65 -0.36 -0.00 0.00 0.00 0.00 0.00 61.98 62.27 1t6g s VAL 3 Cb -0.23 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 1t6g s VAL 3 CO 0.61 0.51 -0.10 -0.22 0.00 0.00 0.00 175.10 175.90 1t6g s LEU 4 N 0.18 2.91 0.00 3.92 2.96 0.95 -0.14 118.68 129.46 1t6g s LEU 4 Ca -0.02 -0.21 0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1t6g s LEU 4 Cb -0.14 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.89 1t6g s LEU 4 CO 0.03 0.23 -0.05 0.00 -1.32 0.00 0.00 176.35 175.23 1t6g s ALA 5 N -0.01 0.44 0.41 5.97 0.00 -0.15 -2.87 121.76 125.56 1t6g s ALA 5 Ca -0.02 -0.28 -0.23 0.00 0.00 0.00 0.00 51.96 51.43 1t6g s ALA 5 Cb -0.14 -0.09 -0.09 0.00 0.00 0.00 0.00 23.12 22.80 1t6g s ALA 5 CO 0.04 0.09 1.02 -1.25 0.00 0.00 0.00 175.76 175.66 1t6g s PRO 6 N -0.28 4.15 -0.16 0.00 0.04 -1.26 -1.50 135.00 135.99 1t6g s PRO 6 Ca 0.01 1.41 -0.02 0.00 0.04 0.00 0.00 61.00 62.44 1t6g s PRO 6 Cb -0.03 -2.43 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 1t6g s PRO 6 CO -0.00 -0.14 -0.09 0.08 0.04 0.00 0.00 177.00 176.89 1t6g s VAL 7 N -1.79 3.34 -0.13 -0.36 1.01 -0.56 -4.22 120.40 117.69 1t6g s VAL 7 Ca 0.59 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 1t6g s VAL 7 Cb -0.19 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.72 1t6g s VAL 7 CO 0.24 0.50 -0.09 -0.89 0.00 0.00 0.00 175.10 174.86 1t6g s THR 8 N 0.59 3.47 -0.30 3.92 2.01 -0.39 -0.27 115.64 124.66 1t6g s THR 8 Ca -0.06 -0.52 -0.22 0.00 0.31 0.00 0.00 61.69 61.20 1t6g s THR 8 Cb -0.15 -2.47 -0.00 0.00 0.01 0.00 0.00 72.50 69.88 1t6g s THR 8 CO 0.03 0.53 0.74 -0.75 -0.69 0.00 0.00 174.62 174.48 1t6g s LYS 9 N 0.14 3.95 -0.11 4.92 2.20 -1.26 -1.01 119.74 128.57 1t6g s LYS 9 Ca -0.04 0.51 -0.30 0.00 -0.36 0.00 0.00 55.97 55.79 1t6g s LYS 9 Cb -0.14 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.42 1t6g s LYS 9 CO 0.04 -0.64 1.33 0.34 -0.36 0.00 0.00 175.35 176.06 1t6g s ASP 10 N 1.61 6.91 0.19 1.43 3.68 0.18 -4.92 116.67 125.76 1t6g s ASP 10 Ca 0.30 1.84 -0.12 0.00 2.13 0.00 0.00 52.55 56.70 1t6g s ASP 10 Cb -0.14 -2.54 0.19 0.00 -1.45 0.00 0.00 42.92 38.97 1t6g s ASP 10 CO 0.12 -0.75 1.75 -0.65 0.13 0.00 0.00 175.17 175.77 1t6g h PRO 11 N 8.25 0.37 -0.31 4.34 0.11 -1.96 0.17 132.00 142.96 1t6g h PRO 11 Ca -0.31 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.65 1t6g h PRO 11 Cb 1.13 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1t6g h PRO 11 CO 0.95 0.24 -0.35 0.00 -0.21 0.00 0.00 178.00 178.63 1t6g h ALA 12 N 1.34 0.80 0.00 -0.75 0.00 -1.98 -3.32 119.26 115.37 1t6g h ALA 12 Ca 0.25 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1t6g h ALA 12 Cb 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1t6g h ALA 12 CO -0.25 0.65 -1.19 0.25 0.00 0.00 0.00 179.25 178.71 1t6g n THR 13 N -4.06 0.00 -1.02 0.00 -2.24 -1.20 -4.99 114.28 100.77 1t6g n THR 13 Ca -0.01 -0.26 -0.01 0.00 -2.27 0.00 0.00 64.05 61.50 1t6g n THR 13 Cb 0.50 0.54 -0.00 0.00 -2.10 0.00 0.00 70.33 69.27 1t6g n THR 13 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1t6g n SER 14 N -1.69 -4.75 -4.90 3.42 7.64 0.04 -4.97 113.62 108.42 1t6g n SER 14 Ca -0.00 0.02 -0.28 0.00 1.01 0.00 0.00 58.87 59.61 1t6g n SER 14 Cb 0.29 -2.32 -0.00 0.00 -1.01 0.00 0.00 64.21 61.17 1t6g n SER 14 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1t6g s LEU 15 N -0.18 3.58 -0.13 -3.43 1.43 -1.26 -4.72 118.68 113.98 1t6g s LEU 15 Ca 0.00 1.02 -0.02 0.00 -1.03 0.00 0.00 54.13 54.11 1t6g s LEU 15 Cb 0.00 -3.99 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 1t6g s LEU 15 CO 0.00 -0.61 -0.07 -0.31 0.23 0.00 0.00 176.35 175.59 1t6g s TYR 16 N -2.78 2.94 0.21 0.29 2.02 -1.26 -0.64 117.35 118.13 1t6g s TYR 16 Ca 0.49 -0.33 0.09 0.00 -0.37 0.00 0.00 57.07 56.95 1t6g s TYR 16 Cb -0.10 -1.87 -0.05 0.00 -0.40 0.00 0.00 41.96 39.54 1t6g s TYR 16 CO 0.45 -0.01 -0.18 0.95 -1.57 0.00 0.00 175.55 175.20 1t6g s THR 17 N 0.11 2.00 0.14 -0.71 -4.23 -0.18 -0.47 115.64 112.30 1t6g s THR 17 Ca -0.03 -2.16 0.09 0.00 -1.18 0.00 0.00 61.69 58.41 1t6g s THR 17 Cb -0.14 -2.05 -0.04 0.00 1.34 0.00 0.00 72.50 71.61 1t6g s THR 17 CO 0.03 -0.42 -0.20 0.27 -0.54 0.00 0.00 174.62 173.76 1t6g s ILE 18 N -2.47 1.83 0.28 2.99 -4.36 -0.48 -1.27 121.20 117.73 1t6g s ILE 18 Ca 0.22 -1.78 -0.29 0.00 -0.26 0.00 0.00 60.65 58.54 1t6g s ILE 18 Cb -0.04 -1.76 -0.10 0.00 1.25 0.00 0.00 42.46 41.81 1t6g s ILE 18 CO 0.09 -0.19 1.26 -2.84 0.24 0.00 0.00 174.94 173.50 1t6g s PRO 19 N -2.41 4.43 -0.13 0.37 0.02 -1.26 -0.84 135.00 135.18 1t6g s PRO 19 Ca 0.12 2.07 -0.12 0.00 0.02 0.00 0.00 61.00 63.09 1t6g s PRO 19 Cb -0.08 -3.13 -0.05 0.00 0.02 0.00 0.00 34.50 31.25 1t6g s PRO 19 CO 0.06 -0.11 -0.26 0.34 -0.33 0.00 0.00 177.00 176.70 1t6g n PHE 20 N 1.43 0.00 -3.83 6.54 7.35 0.20 -4.82 117.46 124.33 1t6g n PHE 20 Ca 0.01 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.66 1t6g n PHE 20 Cb 0.43 -0.45 0.01 0.00 0.35 0.00 0.00 39.48 39.81 1t6g n PHE 20 CO 0.00 0.00 0.00 -3.38 -0.76 0.00 0.00 176.76 172.62 1t6g s HIS 21 N -2.60 0.00 -1.45 -5.13 -3.43 -1.19 -0.35 115.29 101.15 1t6g s HIS 21 Ca -0.23 -0.43 -0.17 0.00 -0.80 0.00 0.00 55.06 53.43 1t6g s HIS 21 Cb 0.05 0.71 0.16 0.00 -1.43 0.00 0.00 32.58 32.07 1t6g s HIS 21 CO 0.33 -1.02 0.51 -0.25 -2.00 0.00 0.00 174.74 172.31 1t6g n ASP 22 N -0.98 -2.17 0.00 7.38 8.00 -1.26 0.43 116.55 127.96 1t6g n ASP 22 Ca -0.05 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.66 1t6g n ASP 22 Cb 0.60 -1.86 0.00 0.00 -0.02 0.00 0.00 41.12 39.83 1t6g n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1t6g n GLY 23 N -1.03 1.91 3.77 0.44 0.00 -1.26 -4.99 105.19 104.03 1t6g n GLY 23 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1t6g n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t6g s ALA 24 N -1.73 3.31 0.27 4.61 0.00 0.17 -4.95 121.76 123.43 1t6g s ALA 24 Ca 0.00 0.89 0.10 0.00 0.00 0.00 0.00 51.96 52.95 1t6g s ALA 24 Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1t6g s ALA 24 CO 0.00 -0.25 -0.07 -1.54 0.00 0.00 0.00 175.76 173.90 1t6g s SER 25 N -1.03 4.23 0.08 0.00 1.04 -1.06 -0.63 113.70 116.34 1t6g s SER 25 Ca 0.49 -0.76 0.09 0.00 0.48 0.00 0.00 55.95 56.25 1t6g s SER 25 Cb -0.30 -0.67 -0.03 0.00 0.10 0.00 0.00 66.02 65.12 1t6g s SER 25 CO 0.39 0.02 -0.24 -0.76 0.98 0.00 0.00 173.24 173.62 1t6g s LEU 26 N -3.59 2.24 -0.02 2.42 1.43 -0.02 -1.29 118.68 119.84 1t6g s LEU 26 Ca 0.31 -0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 52.47 1t6g s LEU 26 Cb -0.06 -1.12 -0.03 0.00 0.03 0.00 0.00 46.19 45.01 1t6g s LEU 26 CO 0.18 0.18 0.98 -0.69 0.23 0.00 0.00 176.35 177.23 1t6g s VAL 27 N -0.95 4.85 -0.13 -1.59 1.01 -0.05 -1.39 120.40 122.16 1t6g s VAL 27 Ca 0.11 2.06 -0.29 0.00 0.00 0.00 0.00 61.98 63.85 1t6g s VAL 27 Cb -0.10 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 1t6g s VAL 27 CO 0.04 0.13 1.23 -0.76 0.00 0.00 0.00 175.10 175.73 1t6g s LEU 28 N 1.20 4.21 -0.35 3.92 1.43 0.38 0.23 118.68 129.70 1t6g s LEU 28 Ca 0.51 1.72 0.02 0.00 -1.03 0.00 0.00 54.13 55.35 1t6g s LEU 28 Cb -0.20 -3.55 0.10 0.00 0.03 0.00 0.00 46.19 42.57 1t6g s LEU 28 CO 0.26 -0.69 0.10 -0.62 0.23 0.00 0.00 176.35 175.63 1t6g s ASP 29 N 1.74 4.34 0.00 2.29 2.15 -0.59 -4.73 116.67 121.88 1t6g s ASP 29 Ca 0.54 -2.02 0.14 0.00 0.43 0.00 0.00 52.55 51.64 1t6g s ASP 29 Cb -0.22 -1.26 0.59 0.00 -0.30 0.00 0.00 42.92 41.73 1t6g s ASP 29 CO 0.17 -0.38 1.43 1.33 -0.17 0.00 0.00 175.17 177.55 1t6g n VAL 30 N 4.38 1.02 0.54 1.11 0.24 -1.26 -0.92 118.33 123.44 1t6g n VAL 30 Ca 0.02 0.25 0.08 0.00 -2.04 0.00 0.00 64.34 62.65 1t6g n VAL 30 Cb 0.41 -1.02 0.08 0.00 -1.47 0.00 0.00 33.84 31.83 1t6g n VAL 30 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t6g n ALA 31 N -1.48 2.45 -2.52 2.33 0.00 -1.26 -3.09 120.51 116.94 1t6g n ALA 31 Ca 0.04 -0.68 -0.41 0.00 0.00 0.00 0.00 53.44 52.39 1t6g n ALA 31 Cb 0.15 -0.52 -0.04 0.00 0.00 0.00 0.00 19.45 19.04 1t6g n ALA 31 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1t6g s GLY 32 N -1.23 2.83 0.01 0.00 0.00 -0.48 -4.62 107.32 103.83 1t6g s GLY 32 Ca 0.19 0.38 0.25 0.00 0.00 0.00 0.00 44.72 45.54 1t6g s GLY 32 CO 0.19 1.34 1.41 -1.55 0.00 0.00 0.00 173.10 174.49 1t6g n PRO 33 N 3.30 0.04 -4.36 2.90 -0.04 -1.26 -1.49 135.00 134.08 1t6g n PRO 33 Ca 0.01 0.01 -0.25 0.00 -0.04 0.00 0.00 63.50 63.23 1t6g n PRO 33 Cb 0.50 -1.52 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 1t6g n PRO 33 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1t6g s LEU 34 N -3.14 2.40 -0.16 1.53 1.43 -1.26 -2.33 118.68 117.15 1t6g s LEU 34 Ca 0.10 -0.82 -0.16 0.00 -1.03 0.00 0.00 54.13 52.23 1t6g s LEU 34 Cb 0.17 -1.00 -0.04 0.00 0.03 0.00 0.00 46.19 45.34 1t6g s LEU 34 CO 0.70 0.06 0.37 -0.69 0.23 0.00 0.00 176.35 177.02 1t6g s VAL 35 N -1.63 5.25 0.00 -1.59 1.01 -1.25 -1.19 120.40 121.00 1t6g s VAL 35 Ca 0.15 0.70 -0.03 0.00 0.00 0.00 0.00 61.98 62.80 1t6g s VAL 35 Cb -0.08 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1t6g s VAL 35 CO 0.07 0.34 0.06 -1.66 0.00 0.00 0.00 175.10 173.91 1t6g s TRP 36 N 0.72 0.11 0.13 5.22 1.48 -0.53 -1.12 118.94 124.95 1t6g s TRP 36 Ca 0.20 -0.23 -0.13 0.00 -1.06 0.00 0.00 56.10 54.87 1t6g s TRP 36 Cb -0.14 -0.09 0.02 0.00 -1.16 0.00 0.00 33.47 32.10 1t6g s TRP 36 CO 0.07 -0.20 0.34 0.45 -4.06 0.00 0.00 176.95 173.54 1t6g s SER 37 N -1.16 -0.10 0.78 -2.66 0.15 -0.52 -0.85 113.70 109.33 1t6g s SER 37 Ca -0.13 -0.51 -0.13 0.00 0.70 0.00 0.00 55.95 55.88 1t6g s SER 37 Cb -0.07 0.44 0.06 0.00 -1.71 0.00 0.00 66.02 64.75 1t6g s SER 37 CO 0.00 -0.85 1.17 0.42 1.20 0.00 0.00 173.24 175.18 1t6g s THR 38 N -3.85 2.42 0.07 6.45 -4.23 -0.28 -0.78 115.64 115.44 1t6g s THR 38 Ca 0.06 0.18 -0.00 0.00 -1.18 0.00 0.00 61.69 60.75 1t6g s THR 38 Cb 0.03 -2.60 -0.04 0.00 1.34 0.00 0.00 72.50 71.22 1t6g s THR 38 CO -0.09 -0.14 -0.03 0.00 -0.54 0.00 0.00 174.62 173.82 1t6g n ASP 40 N 0.05 0.29 0.13 0.00 5.68 -1.26 -5.02 116.55 116.42 1t6g n ASP 40 Ca -0.13 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.27 1t6g n ASP 40 Cb 0.61 0.00 0.50 0.00 -1.14 0.00 0.00 41.12 41.09 1t6g n ASP 40 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1t6g n GLY 41 N 1.55 -1.10 0.17 6.12 0.00 -1.26 -2.38 105.19 108.29 1t6g n GLY 41 Ca 0.00 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.27 1t6g n GLY 41 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1t6g h GLY 42 N 1.44 0.00 -7.14 -0.02 0.00 -1.97 -3.36 103.07 92.02 1t6g h GLY 42 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.70 1t6g h GLY 42 CO 0.00 0.00 -0.57 1.20 0.00 0.00 0.00 176.54 177.17 1t6g s GLN 43 N -3.38 2.42 0.43 4.80 1.11 -1.00 -4.88 119.66 119.15 1t6g s GLN 43 Ca 0.04 -3.24 -0.23 0.00 0.01 0.00 0.00 55.36 51.94 1t6g s GLN 43 Cb 0.09 -3.43 -0.09 0.00 -1.01 0.00 0.00 33.01 28.58 1t6g s GLN 43 CO 0.46 -1.26 1.07 -1.25 0.01 0.00 0.00 175.29 174.33 1t6g s PRO 44 N -1.29 4.01 0.20 2.91 0.04 -1.26 -4.73 135.00 134.89 1t6g s PRO 44 Ca 0.24 1.54 -0.31 0.00 0.04 0.00 0.00 61.00 62.51 1t6g s PRO 44 Cb -0.08 -2.44 -0.10 0.00 0.04 0.00 0.00 34.50 31.92 1t6g s PRO 44 CO -0.14 -0.28 1.55 -1.25 0.04 0.00 0.00 177.00 176.92 1t6g s PRO 45 N -2.66 4.22 0.45 0.56 0.04 -1.26 -2.66 135.00 133.68 1t6g s PRO 45 Ca 0.61 2.38 -0.24 0.00 0.04 0.00 0.00 61.00 63.78 1t6g s PRO 45 Cb -0.22 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.11 1t6g s PRO 45 CO 0.28 -0.57 1.22 0.00 0.04 0.00 0.00 177.00 177.97 1t6g s ALA 46 N 0.78 3.04 -0.48 8.56 0.00 0.21 -4.89 121.76 128.98 1t6g s ALA 46 Ca 0.67 1.07 -0.26 0.00 0.00 0.00 0.00 51.96 53.43 1t6g s ALA 46 Cb -0.44 -3.43 -0.26 0.00 0.00 0.00 0.00 23.12 18.99 1t6g s ALA 46 CO 0.35 -0.78 1.79 -0.85 0.00 0.00 0.00 175.76 176.28 1t6g n GLU 47 N -0.33 0.76 -3.73 0.00 0.00 -1.26 -4.83 120.64 111.25 1t6g n GLU 47 Ca 0.06 -1.51 -0.28 0.00 0.00 0.00 0.00 57.16 55.44 1t6g n GLU 47 Cb 0.46 -2.85 -0.16 0.00 0.00 0.00 0.00 31.44 28.89 1t6g n GLU 47 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1t6g s ILE 48 N 7.07 0.53 0.64 3.84 1.01 -1.26 -5.10 121.20 127.93 1t6g s ILE 48 Ca 0.65 -0.65 -0.11 0.00 0.00 0.00 0.00 60.65 60.54 1t6g s ILE 48 Cb 0.12 -1.09 -0.02 0.00 0.01 0.00 0.00 42.46 41.48 1t6g s ILE 48 CO 0.23 -0.28 1.04 -2.16 0.00 0.00 0.00 174.94 173.77 1t6g s PRO 49 N 1.84 3.31 0.40 2.79 0.04 -1.26 -0.92 135.00 141.19 1t6g s PRO 49 Ca 0.00 0.59 0.12 0.00 0.04 0.00 0.00 61.00 61.76 1t6g s PRO 49 Cb -0.17 -2.08 0.82 0.00 0.04 0.00 0.00 34.50 33.11 1t6g s PRO 49 CO -0.11 -0.73 1.91 0.00 0.04 0.00 0.00 177.00 178.11 1t6g h SER 51 N 0.09 0.00 -4.01 0.00 4.64 -1.97 -3.39 113.55 108.91 1t6g h SER 51 Ca 0.02 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.79 1t6g h SER 51 Cb 0.46 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 62.73 1t6g h SER 51 CO 0.03 0.38 0.24 -1.54 -0.87 0.00 0.00 176.83 175.08 1t6g n SER 52 N -3.75 0.85 -0.31 4.97 3.41 -1.01 -4.82 113.62 112.96 1t6g n SER 52 Ca -0.01 0.63 0.08 0.00 -0.26 0.00 0.00 58.87 59.31 1t6g n SER 52 Cb 0.46 -1.47 0.23 0.00 -0.26 0.00 0.00 64.21 63.18 1t6g n SER 52 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1t6g h PRO 53 N -0.55 0.64 -0.64 4.33 0.11 -1.90 -2.74 132.00 131.26 1t6g h PRO 53 Ca -0.47 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1t6g h PRO 53 Cb 1.31 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 1t6g h PRO 53 CO 0.47 0.43 0.24 1.15 -0.21 0.00 0.00 178.00 180.08 1t6g h THR 54 N 0.66 1.23 -0.19 -1.15 2.02 -1.91 -1.95 112.91 111.62 1t6g h THR 54 Ca 0.48 -0.73 -0.19 0.00 0.77 0.00 0.00 66.41 66.74 1t6g h THR 54 Cb 0.66 0.48 0.01 0.00 -1.74 0.00 0.00 68.15 67.56 1t6g h THR 54 CO -0.36 0.29 -0.62 0.00 0.37 0.00 0.00 175.52 175.20 1t6g h LEU 56 N 0.47 0.99 -0.50 0.00 3.38 -1.38 -2.52 115.31 115.75 1t6g h LEU 56 Ca -0.02 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1t6g h LEU 56 Cb 1.24 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1t6g h LEU 56 CO 0.13 0.83 0.09 0.25 0.09 0.00 0.00 178.44 179.84 1t6g h LEU 57 N 1.08 0.78 -1.95 1.67 7.12 -1.27 -2.36 115.31 120.39 1t6g h LEU 57 Ca 0.26 -0.25 -0.02 0.00 0.13 0.00 0.00 57.88 58.00 1t6g h LEU 57 Cb 0.11 -0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 40.03 1t6g h LEU 57 CO -0.03 0.83 -0.11 0.00 -0.13 0.00 0.00 178.44 179.00 1t6g h ALA 58 N 0.98 1.48 -0.45 1.25 0.00 -0.86 -2.47 119.26 119.18 1t6g h ALA 58 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1t6g h ALA 58 Cb 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1t6g h ALA 58 CO 0.01 0.14 0.00 0.09 0.00 0.00 0.00 179.25 179.49 1t6g n ASN 59 N -3.92 4.20 0.27 0.00 4.13 -0.98 -4.65 115.26 114.31 1t6g n ASN 59 Ca -0.02 -2.58 0.16 0.00 1.68 0.00 0.00 54.58 53.81 1t6g n ASN 59 Cb 0.20 -0.51 0.71 0.00 -1.54 0.00 0.00 39.78 38.65 1t6g n ASN 59 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1t6g h ALA 60 N 2.92 1.05 -2.11 5.41 0.00 -0.93 -3.33 119.26 122.26 1t6g h ALA 60 Ca 0.00 -0.06 -0.56 0.00 0.00 0.00 0.00 54.91 54.29 1t6g h ALA 60 Cb 1.35 -0.01 -0.41 0.00 0.00 0.00 0.00 17.79 18.73 1t6g h ALA 60 CO 0.21 0.08 -0.88 0.66 0.00 0.00 0.00 179.25 179.32 1t6g n TYR 61 N -3.23 1.82 -1.66 0.00 4.02 -1.26 -5.05 117.16 111.80 1t6g n TYR 61 Ca -0.00 -3.88 -0.44 0.00 -0.01 0.00 0.00 57.90 53.57 1t6g n TYR 61 Cb 0.29 -0.45 -0.02 0.00 -0.02 0.00 0.00 39.34 39.14 1t6g n TYR 61 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1t6g n PRO 62 N 0.70 1.87 -2.06 -0.72 -0.04 -1.25 -4.91 135.00 128.59 1t6g n PRO 62 Ca 0.26 0.66 -0.38 0.00 -0.04 0.00 0.00 63.50 64.00 1t6g n PRO 62 Cb 0.49 -2.24 0.01 0.00 -0.04 0.00 0.00 33.50 31.72 1t6g n PRO 62 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t6g s ALA 63 N -0.52 3.03 0.16 0.55 0.00 -1.26 -4.93 121.76 118.78 1t6g s ALA 63 Ca 0.63 1.14 -0.24 0.00 0.00 0.00 0.00 51.96 53.50 1t6g s ALA 63 Cb -0.65 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.02 1t6g s ALA 63 CO 0.55 -0.91 1.38 -2.30 0.00 0.00 0.00 175.76 174.48 1t6g n PRO 64 N -0.42 -0.34 -1.65 0.00 -0.02 -1.26 -2.29 135.00 129.01 1t6g n PRO 64 Ca 0.07 1.35 -0.35 0.00 -2.02 0.00 0.00 63.50 62.56 1t6g n PRO 64 Cb 0.46 -2.00 0.06 0.00 -0.02 0.00 0.00 33.50 32.00 1t6g n PRO 64 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t6g n GLY 65 N -1.28 5.85 3.48 -1.23 0.00 -1.26 -4.99 105.19 105.75 1t6g n GLY 65 Ca 0.04 -2.43 -0.33 0.00 0.00 0.00 0.00 46.02 43.30 1t6g n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t6g n PRO 67 N 2.50 -0.07 -2.88 0.00 -0.02 -1.26 -4.93 135.00 128.35 1t6g n PRO 67 Ca -0.17 1.39 -0.01 0.00 -2.02 0.00 0.00 63.50 62.69 1t6g n PRO 67 Cb 0.52 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1t6g n PRO 67 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1t6g n ALA 68 N -3.06 -3.03 0.00 3.55 0.00 -1.26 -5.20 120.51 111.51 1t6g n ALA 68 Ca 0.24 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.08 1t6g n ALA 68 Cb 0.80 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 19.20 1t6g n ALA 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1t6g n PRO 79 N 0.79 0.00 -2.75 0.00 -0.04 -1.26 -5.14 135.00 126.60 1t6g n PRO 79 Ca 0.00 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 1t6g n PRO 79 Cb 0.18 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.58 1t6g n PRO 79 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t6g s THR 81 N -1.13 2.11 0.70 0.00 -4.23 -1.26 -4.05 115.64 107.79 1t6g s THR 81 Ca 0.41 -1.00 -0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1t6g s THR 81 Cb -0.26 -1.92 0.12 0.00 1.34 0.00 0.00 72.50 71.78 1t6g s THR 81 CO 0.32 0.48 0.97 0.00 -0.54 0.00 0.00 174.62 175.85 1t6g s ALA 82 N 1.28 3.75 -0.52 3.99 0.00 0.94 -4.89 121.76 126.31 1t6g s ALA 82 Ca 0.04 -1.72 0.04 0.00 0.00 0.00 0.00 51.96 50.32 1t6g s ALA 82 Cb -0.14 -1.99 0.17 0.00 0.00 0.00 0.00 23.12 21.16 1t6g s ALA 82 CO -0.12 -1.39 0.40 0.71 0.00 0.00 0.00 175.76 175.36 1t6g s TYR 83 N -3.10 1.96 0.42 0.00 2.02 -1.26 -1.47 117.35 115.92 1t6g s TYR 83 Ca 0.65 -2.69 -0.25 0.00 -0.37 0.00 0.00 57.07 54.41 1t6g s TYR 83 Cb -0.06 -1.54 -0.10 0.00 -0.40 0.00 0.00 41.96 39.86 1t6g s TYR 83 CO 0.44 -0.73 1.23 -0.35 -1.57 0.00 0.00 175.55 174.57 1t6g n PRO 84 N 2.53 1.84 -4.73 -1.71 -0.04 -1.10 -4.72 135.00 127.06 1t6g n PRO 84 Ca 0.26 0.65 -0.30 0.00 -0.04 0.00 0.00 63.50 64.07 1t6g n PRO 84 Cb 0.43 -2.32 -0.17 0.00 -0.04 0.00 0.00 33.50 31.41 1t6g n PRO 84 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1t6g s TYR 85 N -1.20 2.31 -0.36 0.54 5.04 -1.26 -2.37 117.35 120.05 1t6g s TYR 85 Ca 0.61 -1.07 -0.26 0.00 -2.44 0.00 0.00 57.07 53.91 1t6g s TYR 85 Cb -0.52 -1.60 0.01 0.00 0.35 0.00 0.00 41.96 40.21 1t6g s TYR 85 CO 0.58 -0.49 0.93 1.21 -1.34 0.00 0.00 175.55 176.43 1t6g s ASN 86 N 0.74 6.69 0.09 4.32 3.84 0.54 -4.94 114.94 126.22 1t6g s ASN 86 Ca -0.10 0.60 0.23 0.00 0.21 0.00 0.00 52.86 53.79 1t6g s ASN 86 Cb -0.16 -2.46 0.92 0.00 -0.55 0.00 0.00 41.25 39.00 1t6g s ASN 86 CO 0.01 -0.85 1.72 -0.81 -2.79 0.00 0.00 177.10 174.38 1t6g n PRO 87 N 6.76 0.09 -0.09 0.43 -0.04 -1.26 -0.50 135.00 140.39 1t6g n PRO 87 Ca 0.07 0.20 -0.14 0.00 -0.04 0.00 0.00 63.50 63.59 1t6g n PRO 87 Cb 0.48 -1.63 -0.08 0.00 -0.04 0.00 0.00 33.50 32.23 1t6g n PRO 87 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1t6g h VAL 88 N 0.00 0.69 0.00 0.52 2.07 -1.92 -3.40 116.25 114.20 1t6g h VAL 88 Ca 0.00 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.77 1t6g h VAL 88 Cb 0.45 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1t6g h VAL 88 CO 0.00 0.23 -0.60 0.77 0.02 0.00 0.00 177.57 177.99 1t6g h SER 89 N -1.00 0.00 0.00 0.57 4.64 -1.85 -3.48 113.55 112.44 1t6g h SER 89 Ca -0.17 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1t6g h SER 89 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1t6g h SER 89 CO -0.10 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.50 1t6g n GLY 90 N 1.22 0.78 3.77 -0.77 0.00 0.35 -5.02 105.19 105.53 1t6g n GLY 90 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1t6g n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t6g s ALA 91 N -3.32 2.85 0.06 4.61 0.00 -1.24 -4.74 121.76 119.98 1t6g s ALA 91 Ca 0.00 0.89 -0.03 0.00 0.00 0.00 0.00 51.96 52.82 1t6g s ALA 91 Cb 0.00 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 1t6g s ALA 91 CO 0.00 -0.70 0.02 0.00 0.00 0.00 0.00 175.76 175.08 1t6g s ALA 93 N -3.91 -1.26 0.28 0.00 0.00 -1.00 -5.03 121.76 110.85 1t6g s ALA 93 Ca 0.07 0.59 -0.29 0.00 0.00 0.00 0.00 51.96 52.32 1t6g s ALA 93 Cb 0.07 0.30 -0.10 0.00 0.00 0.00 0.00 23.12 23.40 1t6g s ALA 93 CO -0.10 -0.46 1.17 0.00 0.00 0.00 0.00 175.76 176.38 1t6g s ALA 94 N -2.21 3.44 0.00 0.00 0.00 -1.26 -2.72 121.76 119.01 1t6g s ALA 94 Ca -0.07 1.01 -0.20 0.00 0.00 0.00 0.00 51.96 52.71 1t6g s ALA 94 Cb -0.01 -3.38 0.04 0.00 0.00 0.00 0.00 23.12 19.77 1t6g s ALA 94 CO 0.00 -0.33 0.43 0.20 0.00 0.00 0.00 175.76 176.06 1t6g s GLY 95 N -0.63 -0.30 0.22 0.00 0.00 -0.54 -4.69 107.32 101.38 1t6g s GLY 95 Ca 0.47 0.52 -0.05 0.00 0.00 0.00 0.00 44.72 45.66 1t6g s GLY 95 CO 0.44 0.26 0.47 -1.35 0.00 0.00 0.00 173.10 172.93 1t6g s SER 96 N -1.60 6.48 0.18 1.64 1.04 -1.25 -0.04 113.70 120.14 1t6g s SER 96 Ca -0.09 0.66 -0.29 0.00 0.48 0.00 0.00 55.95 56.71 1t6g s SER 96 Cb -0.02 -2.12 -0.08 0.00 0.10 0.00 0.00 66.02 63.90 1t6g s SER 96 CO 0.02 -0.08 0.89 -0.76 0.98 0.00 0.00 173.24 174.30 1t6g s LEU 97 N -3.14 4.58 0.05 2.42 1.43 -1.26 -0.62 118.68 122.15 1t6g s LEU 97 Ca 0.43 1.80 -0.04 0.00 -1.03 0.00 0.00 54.13 55.29 1t6g s LEU 97 Cb -0.11 -3.50 -0.02 0.00 0.03 0.00 0.00 46.19 42.59 1t6g s LEU 97 CO 0.27 0.11 0.06 -0.44 0.23 0.00 0.00 176.35 176.57 1t6g s SER 98 N -0.80 0.29 0.01 2.29 0.01 0.15 -0.62 113.70 115.04 1t6g s SER 98 Ca 0.41 -0.75 -0.26 0.00 1.31 0.00 0.00 55.95 56.66 1t6g s SER 98 Cb -0.24 0.24 -0.04 0.00 0.21 0.00 0.00 66.02 66.18 1t6g s SER 98 CO 0.29 -0.59 0.82 -1.00 0.41 0.00 0.00 173.24 173.18 1t6g s HIS 99 N -3.38 3.68 0.29 2.43 3.76 -1.09 -1.52 115.29 119.46 1t6g s HIS 99 Ca 0.02 1.50 0.02 0.00 -0.15 0.00 0.00 55.06 56.45 1t6g s HIS 99 Cb 0.04 -2.91 -0.03 0.00 1.11 0.00 0.00 32.58 30.79 1t6g s HIS 99 CO -0.08 0.14 0.29 -0.08 -0.85 0.00 0.00 174.74 174.16 1t6g s THR 100 N 0.46 0.00 -0.08 1.30 -1.32 -0.42 -4.20 115.64 111.38 1t6g s THR 100 Ca 0.42 -1.89 0.03 0.00 -1.21 0.00 0.00 61.69 59.05 1t6g s THR 100 Cb -0.20 -2.51 0.01 0.00 -1.51 0.00 0.00 72.50 68.28 1t6g s THR 100 CO 0.24 0.00 -0.18 -0.13 -2.21 0.00 0.00 174.62 172.33 1t6g s ARG 101 N -3.58 2.38 -0.38 7.08 1.81 -1.26 -1.62 118.95 123.38 1t6g s ARG 101 Ca 0.37 -0.65 -0.13 0.00 -1.72 0.00 0.00 55.73 53.60 1t6g s ARG 101 Cb 0.03 -1.86 0.01 0.00 -0.45 0.00 0.00 34.95 32.68 1t6g s ARG 101 CO 0.21 0.10 0.26 0.12 -0.68 0.00 0.00 175.30 175.31 1t6g s PHE 102 N 0.52 3.23 -0.23 -0.53 5.36 0.70 -4.53 117.98 122.49 1t6g s PHE 102 Ca -0.16 -0.60 -0.06 0.00 -0.96 0.00 0.00 56.93 55.15 1t6g s PHE 102 Cb -0.17 -2.52 -0.03 0.00 -0.34 0.00 0.00 43.02 39.97 1t6g s PHE 102 CO 0.06 -0.55 0.04 0.08 -1.46 0.00 0.00 175.22 173.39 1t6g s VAL 103 N 1.66 4.11 0.00 3.12 1.01 0.53 -0.58 120.40 130.24 1t6g s VAL 103 Ca 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1t6g s VAL 103 Cb -0.19 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.29 1t6g s VAL 103 CO 0.09 0.37 0.00 0.00 0.00 0.00 0.00 175.10 175.56 1t6g n ALA 104 N 4.72 0.00 -2.46 5.51 0.00 -0.59 -4.61 120.51 123.07 1t6g n ALA 104 Ca -0.17 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.03 1t6g n ALA 104 Cb 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.85 1t6g n ALA 104 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1t6g s ASN 105 N 1.68 2.90 0.70 0.00 -0.87 -1.14 -1.22 114.94 116.99 1t6g s ASN 105 Ca 0.00 -0.82 -0.09 0.00 -1.57 0.00 0.00 52.86 50.38 1t6g s ASN 105 Cb 0.00 -0.18 0.04 0.00 -0.02 0.00 0.00 41.25 41.09 1t6g s ASN 105 CO 0.00 0.04 1.04 0.42 -2.57 0.00 0.00 177.10 176.03 1t6g s THR 106 N -1.71 2.83 -0.08 1.60 -4.23 0.70 -0.04 115.64 114.72 1t6g s THR 106 Ca 0.15 0.01 -0.11 0.00 -1.18 0.00 0.00 61.69 60.56 1t6g s THR 106 Cb -0.07 -3.22 0.03 0.00 1.34 0.00 0.00 72.50 70.58 1t6g s THR 106 CO 0.07 -0.25 0.30 0.28 -0.54 0.00 0.00 174.62 174.47 1t6g s THR 107 N -3.27 0.02 -0.50 3.99 -1.32 -0.62 -1.02 115.64 112.91 1t6g s THR 107 Ca 0.58 -0.17 0.15 0.00 -1.21 0.00 0.00 61.69 61.04 1t6g s THR 107 Cb -0.11 -0.48 0.78 0.00 -1.51 0.00 0.00 72.50 71.18 1t6g s THR 107 CO 0.47 -0.09 1.69 -0.90 -2.21 0.00 0.00 174.62 173.58 1t6g n ASP 108 N 2.39 5.38 0.00 8.08 5.75 -1.26 -4.01 116.55 132.89 1t6g n ASP 108 Ca -0.16 -2.78 0.00 0.00 -0.01 0.00 0.00 54.79 51.84 1t6g n ASP 108 Cb 0.57 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 1t6g n ASP 108 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1t6g n GLY 109 N 0.75 -1.78 0.00 6.12 0.00 -1.26 -4.98 105.19 104.04 1t6g n GLY 109 Ca 0.27 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.97 1t6g n GLY 109 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1t6g n SER 110 N 0.00 1.31 -4.93 1.61 3.41 -1.26 -4.73 113.62 109.03 1t6g n SER 110 Ca 0.00 -0.15 -0.29 0.00 -0.26 0.00 0.00 58.87 58.17 1t6g n SER 110 Cb 0.00 0.56 -0.04 0.00 -0.26 0.00 0.00 64.21 64.47 1t6g n SER 110 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1t6g s LYS 111 N -0.82 3.44 0.53 4.33 -0.14 -1.26 -5.06 119.74 120.76 1t6g s LYS 111 Ca 0.00 -0.50 -0.21 0.00 -1.36 0.00 0.00 55.97 53.90 1t6g s LYS 111 Cb 0.00 -3.01 -0.06 0.00 -1.68 0.00 0.00 37.83 33.08 1t6g s LYS 111 CO 0.00 0.58 1.20 -1.25 -0.76 0.00 0.00 175.35 175.12 1t6g s PRO 112 N -2.78 3.36 0.00 -1.68 0.04 -1.26 -3.99 135.00 128.68 1t6g s PRO 112 Ca 0.35 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.23 1t6g s PRO 112 Cb -0.12 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1t6g s PRO 112 CO 0.28 -0.90 0.00 0.28 0.04 0.00 0.00 177.00 176.70 1t6g n VAL 113 N -1.04 0.00 -4.27 -0.36 0.31 -0.19 -4.94 118.33 107.84 1t6g n VAL 113 Ca 0.10 0.09 -0.19 0.00 -0.01 0.00 0.00 64.34 64.33 1t6g n VAL 113 Cb 0.48 -1.05 -0.11 0.00 -0.91 0.00 0.00 33.84 32.25 1t6g n VAL 113 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1t6g s SER 114 N -4.33 2.18 0.58 4.52 0.01 -1.26 -4.95 113.70 110.45 1t6g s SER 114 Ca 0.00 -0.82 -0.21 0.00 1.31 0.00 0.00 55.95 56.23 1t6g s SER 114 Cb 0.00 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.10 1t6g s SER 114 CO 0.00 -0.11 1.33 -0.75 0.41 0.00 0.00 173.24 174.12 1t6g s LYS 115 N -2.70 2.96 -0.02 12.44 2.20 -1.26 -0.21 119.74 133.15 1t6g s LYS 115 Ca 0.11 2.16 -0.06 0.00 -0.36 0.00 0.00 55.97 57.82 1t6g s LYS 115 Cb -0.05 -2.12 0.01 0.00 -1.51 0.00 0.00 37.83 34.15 1t6g s LYS 115 CO 0.04 -1.31 0.13 0.54 -0.36 0.00 0.00 175.35 174.40 1t6g s VAL 116 N -1.34 0.04 -0.29 4.02 0.11 -0.36 -4.71 120.40 117.87 1t6g s VAL 116 Ca 0.75 -0.37 0.01 0.00 -2.93 0.00 0.00 61.98 59.45 1t6g s VAL 116 Cb -0.39 -0.32 0.09 0.00 -1.53 0.00 0.00 36.38 34.23 1t6g s VAL 116 CO 0.45 -0.20 0.02 0.21 -3.33 0.00 0.00 175.10 172.25 1t6g s ASN 117 N -0.68 4.23 -0.24 3.54 3.84 -1.26 -1.55 114.94 122.82 1t6g s ASN 117 Ca -0.08 -1.65 -0.09 0.00 0.21 0.00 0.00 52.86 51.25 1t6g s ASN 117 Cb -0.05 -1.25 -0.04 0.00 -0.55 0.00 0.00 41.25 39.36 1t6g s ASN 117 CO 0.01 -0.34 0.12 -0.69 -2.79 0.00 0.00 177.10 173.41 1t6g s VAL 118 N 1.28 4.91 0.00 -5.21 1.01 0.25 -4.93 120.40 117.72 1t6g s VAL 118 Ca 0.04 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 1t6g s VAL 118 Cb -0.18 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1t6g s VAL 118 CO -0.12 0.35 1.10 -0.83 0.00 0.00 0.00 175.10 175.60 1t6g s GLY 119 N 1.18 2.54 0.05 4.51 0.00 -1.26 -0.22 107.32 114.12 1t6g s GLY 119 Ca 0.06 0.66 0.01 0.00 0.00 0.00 0.00 44.72 45.45 1t6g s GLY 119 CO 0.05 1.93 -0.06 -1.34 0.00 0.00 0.00 173.10 173.67 1t6g s VAL 120 N 1.32 0.48 -0.20 1.40 -7.23 -0.64 -4.86 120.40 110.67 1t6g s VAL 120 Ca 0.55 -1.32 -0.19 0.00 -1.81 0.00 0.00 61.98 59.20 1t6g s VAL 120 Cb -0.25 -0.89 -0.03 0.00 0.56 0.00 0.00 36.38 35.77 1t6g s VAL 120 CO 0.27 -0.57 0.57 -0.76 -0.31 0.00 0.00 175.10 174.29 1t6g s LEU 121 N -2.03 4.14 0.09 1.32 1.43 -1.26 -1.30 118.68 121.07 1t6g s LEU 121 Ca -0.04 0.74 0.08 0.00 -1.03 0.00 0.00 54.13 53.88 1t6g s LEU 121 Cb -0.05 -2.78 -0.03 0.00 0.03 0.00 0.00 46.19 43.36 1t6g s LEU 121 CO -0.02 -0.22 -0.21 0.00 0.23 0.00 0.00 176.35 176.12 1t6g s ALA 122 N 1.78 1.85 0.18 4.21 0.00 -0.58 -4.61 121.76 124.60 1t6g s ALA 122 Ca 0.26 -1.23 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 1t6g s ALA 122 Cb -0.16 -0.28 -0.08 0.00 0.00 0.00 0.00 23.12 22.61 1t6g s ALA 122 CO 0.10 0.39 1.00 0.00 0.00 0.00 0.00 175.76 177.24 1t6g s ALA 123 N -1.07 3.32 -0.29 0.00 0.00 -0.28 -0.68 121.76 122.76 1t6g s ALA 123 Ca 0.07 0.67 -0.19 0.00 0.00 0.00 0.00 51.96 52.52 1t6g s ALA 123 Cb -0.10 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 1t6g s ALA 123 CO 0.04 -0.00 0.56 0.00 0.00 0.00 0.00 175.76 176.36 1t6g s ALA 125 N 2.44 3.30 0.55 0.00 0.00 0.04 -3.75 121.76 124.35 1t6g s ALA 125 Ca 0.23 -1.27 -0.18 0.00 0.00 0.00 0.00 51.96 50.74 1t6g s ALA 125 Cb -0.15 -1.13 -0.05 0.00 0.00 0.00 0.00 23.12 21.79 1t6g s ALA 125 CO 0.11 0.54 1.07 -1.25 0.00 0.00 0.00 175.76 176.23 1t6g s PRO 126 N -2.81 3.44 0.44 0.00 0.04 -1.26 -4.07 135.00 130.78 1t6g s PRO 126 Ca 0.28 1.34 0.28 0.00 0.04 0.00 0.00 61.00 62.93 1t6g s PRO 126 Cb -0.10 -2.04 1.36 0.00 0.04 0.00 0.00 34.50 33.76 1t6g s PRO 126 CO 0.20 -0.73 1.67 0.77 0.04 0.00 0.00 177.00 178.95 1t6g h SER 127 N 0.90 0.27 0.38 6.66 0.02 -1.99 -1.86 113.55 117.94 1t6g h SER 127 Ca -0.48 0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 1t6g h SER 127 Cb 1.23 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.85 1t6g h SER 127 CO 0.58 -0.09 -0.09 0.07 -1.14 0.00 0.00 176.83 176.16 1t6g h LYS 128 N 0.16 0.00 0.00 3.45 2.10 -2.02 -2.40 116.57 117.86 1t6g h LYS 128 Ca 0.75 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.40 1t6g h LYS 128 Cb 2.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.64 1t6g h LYS 128 CO -0.34 0.09 0.00 1.28 -2.00 0.00 0.00 179.45 178.47 1t6g n LEU 129 N -3.52 0.12 0.04 7.07 4.77 -0.70 -2.90 117.00 121.88 1t6g n LEU 129 Ca -0.02 0.53 0.13 0.00 -0.03 0.00 0.00 56.01 56.63 1t6g n LEU 129 Cb 0.22 -0.51 0.53 0.00 -2.33 0.00 0.00 43.42 41.33 1t6g n LEU 129 CO 0.28 -0.30 0.93 0.18 -1.33 0.00 0.00 177.39 177.15 1t6g n LEU 130 N -1.63 0.31 -4.68 2.23 4.77 -0.90 -4.80 117.00 112.30 1t6g n LEU 130 Ca 0.03 0.53 -0.44 0.00 -0.03 0.00 0.00 56.01 56.10 1t6g n LEU 130 Cb 0.19 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 40.81 1t6g n LEU 130 CO 0.15 -0.08 1.07 0.00 -1.33 0.00 0.00 177.39 177.20 1t6g n ALA 131 N -1.61 1.36 -0.49 -1.18 0.00 -1.14 -1.50 120.51 115.95 1t6g n ALA 131 Ca 0.06 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1t6g n ALA 131 Cb 0.37 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1t6g n ALA 131 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1t6g n SER 132 N 2.29 0.00 -4.93 0.00 7.64 -1.26 -4.73 113.62 112.63 1t6g n SER 132 Ca 0.12 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.75 1t6g n SER 132 Cb 0.32 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.53 1t6g n SER 132 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1t6g s LEU 133 N 0.00 3.62 0.61 -3.43 1.43 -0.56 -4.96 118.68 115.38 1t6g s LEU 133 Ca 0.00 0.55 -0.19 0.00 -1.03 0.00 0.00 54.13 53.45 1t6g s LEU 133 Cb 0.00 -3.43 -0.03 0.00 0.03 0.00 0.00 46.19 42.76 1t6g s LEU 133 CO 0.00 -0.68 1.30 -2.84 0.23 0.00 0.00 176.35 174.36 1t6g s PRO 134 N -4.65 2.81 0.14 1.29 0.02 -1.26 -4.92 135.00 128.43 1t6g s PRO 134 Ca 0.48 2.08 -0.34 0.00 0.02 0.00 0.00 61.00 63.23 1t6g s PRO 134 Cb -0.10 -1.99 -0.15 0.00 0.02 0.00 0.00 34.50 32.27 1t6g s PRO 134 CO 0.41 -1.40 1.37 0.54 -0.33 0.00 0.00 177.00 177.58 1t6g n ARG 135 N -1.57 1.52 -0.05 5.54 1.74 -1.26 -1.81 116.66 120.77 1t6g n ARG 135 Ca 0.14 0.54 0.00 0.00 -0.77 0.00 0.00 57.85 57.76 1t6g n ARG 135 Cb 0.47 -2.19 0.00 0.00 -1.02 0.00 0.00 32.46 29.73 1t6g n ARG 135 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1t6g n GLY 136 N 2.58 1.42 3.78 -0.13 0.00 -1.26 -5.03 105.19 106.55 1t6g n GLY 136 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1t6g n GLY 136 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t6g s SER 137 N -3.00 7.33 0.00 1.61 0.01 -0.75 -2.55 113.70 116.36 1t6g s SER 137 Ca 0.00 1.66 0.01 0.00 1.31 0.00 0.00 55.95 58.93 1t6g s SER 137 Cb 0.00 -2.51 0.04 0.00 0.21 0.00 0.00 66.02 63.76 1t6g s SER 137 CO 0.00 0.11 1.02 0.35 0.41 0.00 0.00 173.24 175.14 1t6g n THR 138 N 1.19 0.99 -3.55 1.44 -2.24 -0.41 -4.88 114.28 106.81 1t6g n THR 138 Ca -0.03 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 1t6g n THR 138 Cb 0.49 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1t6g n THR 138 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t6g n GLY 139 N -0.37 -0.78 3.05 3.38 0.00 -1.24 -1.13 105.19 108.11 1t6g n GLY 139 Ca 0.01 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.84 1t6g n GLY 139 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t6g s VAL 140 N -3.00 1.30 -0.54 1.61 1.01 -0.03 -0.87 120.40 119.87 1t6g s VAL 140 Ca 0.00 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.23 1t6g s VAL 140 Cb 0.00 -1.18 0.08 0.00 0.00 0.00 0.00 36.38 35.28 1t6g s VAL 140 CO 0.00 0.39 0.64 0.00 0.00 0.00 0.00 175.10 176.14 1t6g s ALA 141 N 0.68 3.41 0.08 5.51 0.00 0.13 -1.46 121.76 130.12 1t6g s ALA 141 Ca -0.14 -1.98 -0.31 0.00 0.00 0.00 0.00 51.96 49.53 1t6g s ALA 141 Cb -0.16 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.48 1t6g s ALA 141 CO 0.04 -2.13 1.37 0.20 0.00 0.00 0.00 175.76 175.23 1t6g s GLY 142 N 3.09 2.00 -0.16 0.00 0.00 -0.33 -1.54 107.32 110.37 1t6g s GLY 142 Ca 0.13 1.02 0.17 0.00 0.00 0.00 0.00 44.72 46.04 1t6g s GLY 142 CO 0.09 2.35 1.28 1.04 0.00 0.00 0.00 173.10 177.86 1t6g n LEU 143 N 4.33 3.08 -4.77 0.66 4.77 -0.09 -0.61 117.00 124.37 1t6g n LEU 143 Ca 0.12 -3.16 -0.29 0.00 -0.03 0.00 0.00 56.01 52.64 1t6g n LEU 143 Cb 0.43 -0.49 0.13 0.00 -2.33 0.00 0.00 43.42 41.16 1t6g n LEU 143 CO 0.58 0.78 0.70 0.00 -1.33 0.00 0.00 177.39 178.11 1t6g s ALA 144 N -2.91 1.73 -1.28 -1.18 0.00 -0.56 -4.80 121.76 112.77 1t6g s ALA 144 Ca 0.37 -0.37 -0.17 0.00 0.00 0.00 0.00 51.96 51.80 1t6g s ALA 144 Cb 0.32 -3.08 0.10 0.00 0.00 0.00 0.00 23.12 20.45 1t6g s ALA 144 CO 0.04 -2.24 1.66 -1.71 0.00 0.00 0.00 175.76 173.52 1t6g n ASN 145 N -3.76 5.01 -3.69 0.00 4.05 0.01 -4.71 115.26 112.17 1t6g n ASN 145 Ca 0.06 -2.94 -0.12 0.00 0.45 0.00 0.00 54.58 52.04 1t6g n ASN 145 Cb 0.58 -1.70 -0.06 0.00 1.23 0.00 0.00 39.78 39.83 1t6g n ASN 145 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1t6g s SER 146 N 3.82 -0.21 0.55 1.20 0.15 -1.26 -4.74 113.70 113.21 1t6g s SER 146 Ca 0.51 -0.16 0.33 0.00 0.70 0.00 0.00 55.95 57.32 1t6g s SER 146 Cb 0.02 0.42 1.48 0.00 -1.71 0.00 0.00 66.02 66.24 1t6g s SER 146 CO 0.06 -0.71 2.04 1.23 1.20 0.00 0.00 173.24 177.06 1t6g h GLY 147 N 2.87 0.00 -1.55 9.45 0.00 -1.90 -2.12 103.07 109.82 1t6g h GLY 147 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1t6g h GLY 147 CO 0.46 0.00 0.00 1.04 0.00 0.00 0.00 176.54 178.04 1t6g n LEU 148 N -3.26 2.80 -4.74 3.11 4.77 -1.26 -4.30 117.00 114.12 1t6g n LEU 148 Ca -0.01 -1.45 -0.31 0.00 -0.03 0.00 0.00 56.01 54.21 1t6g n LEU 148 Cb 0.27 -0.15 0.11 0.00 -2.33 0.00 0.00 43.42 41.33 1t6g n LEU 148 CO 0.28 0.61 0.69 0.00 -1.33 0.00 0.00 177.39 177.63 1t6g s ALA 149 N -1.19 1.94 0.16 -1.18 0.00 -0.80 -3.78 121.76 116.91 1t6g s ALA 149 Ca 0.26 0.23 -0.16 0.00 0.00 0.00 0.00 51.96 52.29 1t6g s ALA 149 Cb 0.15 -3.28 0.04 0.00 0.00 0.00 0.00 23.12 20.03 1t6g s ALA 149 CO 0.21 -2.07 1.79 1.25 0.00 0.00 0.00 175.76 176.94 1t6g h LEU 150 N -1.35 0.33 -0.49 0.00 5.85 -1.18 -2.14 115.31 116.33 1t6g h LEU 150 Ca -0.45 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.30 1t6g h LEU 150 Cb 1.25 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 1t6g h LEU 150 CO 0.51 0.24 0.30 -0.65 -0.34 0.00 0.00 178.44 178.50 1t6g h PRO 151 N 0.43 0.59 -0.71 5.25 0.11 -1.89 0.22 132.00 135.99 1t6g h PRO 151 Ca 0.16 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.17 1t6g h PRO 151 Cb 0.03 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 30.98 1t6g h PRO 151 CO -0.09 0.39 0.21 0.00 -0.21 0.00 0.00 178.00 178.30 1t6g h ALA 152 N 1.21 1.03 -0.28 -0.75 0.00 -1.77 -0.68 119.26 118.01 1t6g h ALA 152 Ca 0.19 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 1t6g h ALA 152 Cb -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1t6g h ALA 152 CO -0.08 0.65 -0.41 1.96 0.00 0.00 0.00 179.25 181.38 1t6g h GLN 153 N 1.06 0.67 -0.40 0.00 4.20 -0.95 -2.26 115.11 117.43 1t6g h GLN 153 Ca 0.23 -0.35 -0.09 0.00 0.06 0.00 0.00 58.65 58.50 1t6g h GLN 153 Cb 0.31 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 1t6g h GLN 153 CO -0.01 0.95 -0.13 0.28 -0.67 0.00 0.00 178.83 179.26 1t6g h VAL 154 N 0.55 1.26 -0.53 -0.54 2.07 -0.72 -1.78 116.25 116.55 1t6g h VAL 154 Ca 0.04 -1.17 0.01 0.00 0.82 0.00 0.00 66.70 66.40 1t6g h VAL 154 Cb 0.93 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1t6g h VAL 154 CO 0.08 0.39 0.35 0.00 0.02 0.00 0.00 177.57 178.42 1t6g h ALA 155 N 1.20 0.67 -0.04 1.67 0.00 -0.80 0.25 119.26 122.22 1t6g h ALA 155 Ca 0.11 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1t6g h ALA 155 Cb 0.59 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1t6g h ALA 155 CO 0.04 0.11 -0.36 0.66 0.00 0.00 0.00 179.25 179.70 1t6g h SER 156 N 0.72 0.38 -0.12 0.00 4.64 -1.35 -1.85 113.55 115.96 1t6g h SER 156 Ca 0.20 -0.70 -0.19 0.00 -0.47 0.00 0.00 61.79 60.62 1t6g h SER 156 Cb -0.08 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 61.90 1t6g h SER 156 CO -0.04 1.03 -0.62 0.00 -0.87 0.00 0.00 176.83 176.33 1t6g h ALA 157 N 0.36 0.51 -0.02 5.18 0.00 -1.25 -3.19 119.26 120.84 1t6g h ALA 157 Ca -0.03 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1t6g h ALA 157 Cb 1.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1t6g h ALA 157 CO 0.07 0.69 -0.07 1.04 0.00 0.00 0.00 179.25 180.98 1t6g n GLN 158 N -3.96 2.03 -3.63 0.00 1.13 0.07 -4.97 117.38 108.04 1t6g n GLN 158 Ca -0.05 -1.60 -0.22 0.00 -1.94 0.00 0.00 57.00 53.19 1t6g n GLN 158 Cb 0.66 -1.47 0.04 0.00 0.11 0.00 0.00 30.24 29.58 1t6g n GLN 158 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1t6g n LYS 159 N 0.91 -4.15 -3.10 -1.09 5.02 -0.76 -4.66 118.16 110.33 1t6g n LYS 159 Ca 0.14 0.64 -0.13 0.00 -2.02 0.00 0.00 58.31 56.94 1t6g n LYS 159 Cb 0.53 -5.13 -0.03 0.00 -0.02 0.00 0.00 35.03 30.38 1t6g n LYS 159 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1t6g n VAL 160 N -4.13 0.00 -2.68 -0.18 0.24 -0.80 -4.94 118.33 105.84 1t6g n VAL 160 Ca -0.24 -1.01 -0.32 0.00 -2.04 0.00 0.00 64.34 60.72 1t6g n VAL 160 Cb 0.66 0.24 -0.05 0.00 -1.47 0.00 0.00 33.84 33.22 1t6g n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t6g s ALA 161 N -2.39 3.12 -1.26 2.33 0.00 -0.42 -4.60 121.76 118.53 1t6g s ALA 161 Ca 0.02 0.20 -0.18 0.00 0.00 0.00 0.00 51.96 52.00 1t6g s ALA 161 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1t6g s ALA 161 CO 0.02 -0.02 1.97 -1.71 0.00 0.00 0.00 175.76 176.02 1t6g n ASN 162 N -1.08 3.95 -3.62 0.00 4.05 -1.26 -4.07 115.26 113.22 1t6g n ASN 162 Ca 0.06 -2.83 -0.11 0.00 0.45 0.00 0.00 54.58 52.16 1t6g n ASN 162 Cb 0.54 -1.62 -0.07 0.00 1.23 0.00 0.00 39.78 39.86 1t6g n ASN 162 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 1t6g s ARG 163 N 4.27 0.60 0.10 1.20 3.52 -1.26 -1.88 118.95 125.49 1t6g s ARG 163 Ca 0.54 0.56 -0.07 0.00 -0.13 0.00 0.00 55.73 56.64 1t6g s ARG 163 Cb 0.09 0.29 -0.01 0.00 -1.56 0.00 0.00 34.95 33.75 1t6g s ARG 163 CO 0.03 -0.10 0.15 -0.59 -0.81 0.00 0.00 175.30 173.99 1t6g s PHE 164 N -0.05 0.33 -0.05 5.12 -0.12 -0.45 -1.08 117.98 121.67 1t6g s PHE 164 Ca 0.01 -0.76 0.06 0.00 -0.05 0.00 0.00 56.93 56.19 1t6g s PHE 164 Cb -0.04 -0.16 -0.01 0.00 -0.63 0.00 0.00 43.02 42.18 1t6g s PHE 164 CO -0.03 -0.54 -0.23 -1.17 -0.05 0.00 0.00 175.22 173.19 1t6g s LEU 165 N -2.91 2.04 -0.04 -1.99 0.20 0.44 -0.37 118.68 116.05 1t6g s LEU 165 Ca 0.09 -0.47 0.05 0.00 0.69 0.00 0.00 54.13 54.49 1t6g s LEU 165 Cb 0.05 -1.28 -0.01 0.00 -0.43 0.00 0.00 46.19 44.53 1t6g s LEU 165 CO -0.08 0.23 -0.20 -0.76 -0.29 0.00 0.00 176.35 175.25 1t6g s LEU 166 N -0.16 1.98 -0.45 -0.68 1.43 -0.29 -1.31 118.68 119.19 1t6g s LEU 166 Ca -0.02 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 1t6g s LEU 166 Cb -0.13 -1.12 0.14 0.00 0.03 0.00 0.00 46.19 45.11 1t6g s LEU 166 CO 0.03 0.20 0.28 0.00 0.23 0.00 0.00 176.35 177.08 1t6g s LEU 168 N 0.20 4.42 0.33 0.00 1.43 -1.26 -1.45 118.68 122.35 1t6g s LEU 168 Ca 0.20 1.97 -0.05 0.00 -1.03 0.00 0.00 54.13 55.23 1t6g s LEU 168 Cb -0.18 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.40 1t6g s LEU 168 CO -0.04 -0.31 0.60 -2.16 0.23 0.00 0.00 176.35 174.67 1t6g s PRO 169 N 0.43 3.61 0.40 1.29 0.04 -1.26 -1.46 135.00 138.06 1t6g s PRO 169 Ca 0.53 0.02 0.23 0.00 0.04 0.00 0.00 61.00 61.82 1t6g s PRO 169 Cb -0.28 -2.60 0.41 0.00 0.04 0.00 0.00 34.50 32.08 1t6g s PRO 169 CO 0.31 0.13 1.63 1.79 0.04 0.00 0.00 177.00 180.91 1t6g h THR 170 N 1.11 0.00 0.00 1.26 1.35 -1.95 -3.43 112.91 111.25 1t6g h THR 170 Ca -0.48 -0.92 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 1t6g h THR 170 Cb 1.20 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 1t6g h THR 170 CO 0.65 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.53 1t6g n GLY 171 N 1.13 1.90 0.69 5.82 0.00 -1.26 -4.96 105.19 108.51 1t6g n GLY 171 Ca 0.04 -0.61 0.09 0.00 0.00 0.00 0.00 46.02 45.55 1t6g n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6g n GLY 172 N -0.44 -1.99 3.65 -0.02 0.00 -1.26 -4.11 105.19 101.02 1t6g n GLY 172 Ca 0.00 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.26 1t6g n GLY 172 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1t6g s PRO 173 N -2.18 4.17 0.00 1.61 0.04 -1.26 -4.63 135.00 132.74 1t6g s PRO 173 Ca 0.00 1.36 0.00 0.00 0.04 0.00 0.00 61.00 62.40 1t6g s PRO 173 Cb 0.00 -3.72 0.00 0.00 0.04 0.00 0.00 34.50 30.82 1t6g s PRO 173 CO 0.00 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.68 1t6g n GLY 174 N 3.64 0.25 2.90 0.56 0.00 0.63 -0.89 105.19 112.27 1t6g n GLY 174 Ca 0.13 -1.82 -0.17 0.00 0.00 0.00 0.00 46.02 44.16 1t6g n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t6g s VAL 175 N 0.39 0.33 -0.07 1.61 1.01 -0.53 -1.50 120.40 121.64 1t6g s VAL 175 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1t6g s VAL 175 Cb 0.00 -0.34 0.02 0.00 0.00 0.00 0.00 36.38 36.06 1t6g s VAL 175 CO 0.00 0.14 -0.08 0.00 0.00 0.00 0.00 175.10 175.16 1t6g s ALA 176 N 0.43 1.00 -0.11 5.51 0.00 -0.56 0.10 121.76 128.13 1t6g s ALA 176 Ca -0.05 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 51.65 1t6g s ALA 176 Cb -0.08 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.48 1t6g s ALA 176 CO -0.01 -0.07 -0.14 0.42 0.00 0.00 0.00 175.76 175.97 1t6g s ILE 177 N 1.03 1.42 -0.35 0.00 1.01 -0.43 -0.97 121.20 122.91 1t6g s ILE 177 Ca -0.09 -0.58 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 1t6g s ILE 177 Cb -0.14 -1.32 0.02 0.00 0.01 0.00 0.00 42.46 41.02 1t6g s ILE 177 CO -0.00 0.43 0.18 -0.36 0.00 0.00 0.00 174.94 175.18 1t6g s PHE 178 N 1.18 3.22 0.00 3.97 0.08 0.80 -0.42 117.98 126.81 1t6g s PHE 178 Ca -0.03 -0.86 0.00 0.00 0.12 0.00 0.00 56.93 56.16 1t6g s PHE 178 Cb -0.14 -2.39 0.00 0.00 -0.57 0.00 0.00 43.02 39.91 1t6g s PHE 178 CO -0.04 -0.58 0.00 0.41 -0.10 0.00 0.00 175.22 174.90 1t6g n GLY 179 N 4.98 -0.25 5.64 4.36 0.00 -0.25 -0.93 105.19 118.74 1t6g n GLY 179 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1t6g n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6g n GLY 180 N 0.00 -0.30 0.00 -0.02 0.00 -1.24 -1.30 105.19 102.33 1t6g n GLY 180 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1t6g n GLY 180 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6g n GLY 181 N 0.00 0.13 3.72 -0.02 0.00 -1.26 -4.81 105.19 102.95 1t6g n GLY 181 Ca 0.00 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 1t6g n GLY 181 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1t6g n PRO 182 N 0.23 2.03 -2.16 1.61 -0.02 -1.26 -4.90 135.00 130.53 1t6g n PRO 182 Ca 0.00 0.72 -0.42 0.00 -2.02 0.00 0.00 63.50 61.78 1t6g n PRO 182 Cb 0.00 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.01 1t6g n PRO 182 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1t6g s VAL 183 N -1.19 3.52 1.18 -1.45 1.01 -1.26 -4.98 120.40 117.22 1t6g s VAL 183 Ca 0.60 0.96 -0.19 0.00 0.00 0.00 0.00 61.98 63.35 1t6g s VAL 183 Cb -0.50 -3.61 0.28 0.00 0.00 0.00 0.00 36.38 32.55 1t6g s VAL 183 CO 0.58 0.01 1.17 -2.16 0.00 0.00 0.00 175.10 174.70 1t6g s PRO 184 N 2.20 -1.03 -1.18 2.72 0.04 -1.26 -4.48 135.00 132.02 1t6g s PRO 184 Ca 0.66 -0.23 -0.09 0.00 0.04 0.00 0.00 61.00 61.37 1t6g s PRO 184 Cb -0.34 -1.63 -0.02 0.00 0.04 0.00 0.00 34.50 32.55 1t6g s PRO 184 CO 0.28 -3.55 0.80 0.91 0.04 0.00 0.00 177.00 175.47 1t6g n TRP 185 N -4.61 -2.06 0.28 0.56 8.01 -1.26 -4.62 117.44 113.73 1t6g n TRP 185 Ca 0.15 0.70 0.17 0.00 -1.31 0.00 0.00 57.50 57.21 1t6g n TRP 185 Cb 0.60 -3.98 0.93 0.00 -2.01 0.00 0.00 31.31 26.85 1t6g n TRP 185 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1t6g h PRO 186 N -1.67 0.00 -0.42 -0.99 0.13 -1.92 0.16 132.00 127.28 1t6g h PRO 186 Ca -0.63 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.62 1t6g h PRO 186 Cb 1.35 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.46 1t6g h PRO 186 CO 0.50 0.00 0.33 -0.56 -0.23 0.00 0.00 178.00 178.04 1t6g h GLN 187 N 0.00 0.00 0.00 0.86 -0.00 -1.98 -1.15 115.11 112.84 1t6g h GLN 187 Ca 0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.65 1t6g h GLN 187 Cb 0.18 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.65 1t6g h GLN 187 CO -0.00 0.00 -1.49 1.19 -0.00 0.00 0.00 178.83 178.53 1t6g n PHE 188 N -4.26 0.00 -0.04 0.06 3.72 0.44 -4.81 117.46 112.58 1t6g n PHE 188 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 1t6g n PHE 188 Cb 0.52 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 1t6g n PHE 188 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1t6g n THR 189 N -1.92 0.14 0.24 4.37 -2.24 -0.45 -4.69 114.28 109.73 1t6g n THR 189 Ca -0.04 -0.55 0.07 0.00 -2.27 0.00 0.00 64.05 61.26 1t6g n THR 189 Cb 0.34 0.96 0.58 0.00 -2.10 0.00 0.00 70.33 70.12 1t6g n THR 189 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 1t6g h GLN 190 N 0.00 0.00 -0.63 -0.78 3.07 -1.44 -1.28 115.11 114.05 1t6g h GLN 190 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1t6g h GLN 190 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.65 1t6g h GLN 190 CO 0.00 0.11 0.00 0.43 0.09 0.00 0.00 178.83 179.46 1t6g n SER 191 N -4.32 5.11 -4.69 0.06 7.64 -1.26 -5.01 113.62 111.14 1t6g n SER 191 Ca -0.03 -2.79 -0.52 0.00 1.01 0.00 0.00 58.87 56.54 1t6g n SER 191 Cb 0.19 -0.66 -0.06 0.00 -1.01 0.00 0.00 64.21 62.67 1t6g n SER 191 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1t6g n MET 192 N 0.58 1.72 -2.57 1.43 0.00 -0.49 -4.95 117.12 112.84 1t6g n MET 192 Ca 0.24 0.63 -0.34 0.00 0.00 0.00 0.00 57.70 58.23 1t6g n MET 192 Cb 1.07 -2.41 -0.04 0.00 0.00 0.00 0.00 33.22 31.84 1t6g n MET 192 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1t6g s PRO 193 N 3.90 3.87 0.07 2.12 0.04 -1.26 -4.88 135.00 138.86 1t6g s PRO 193 Ca 0.96 1.35 0.08 0.00 0.04 0.00 0.00 61.00 63.42 1t6g s PRO 193 Cb -0.86 -2.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.51 1t6g s PRO 193 CO 0.58 -0.37 -0.21 0.71 0.04 0.00 0.00 177.00 177.75 1t6g s TYR 194 N -1.98 1.80 0.03 0.56 1.51 -1.26 -1.47 117.35 116.55 1t6g s TYR 194 Ca 0.66 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 56.35 1t6g s TYR 194 Cb -0.16 -1.04 -0.02 0.00 -0.11 0.00 0.00 41.96 40.63 1t6g s TYR 194 CO 0.20 0.14 -0.08 -0.08 -1.11 0.00 0.00 175.55 174.62 1t6g s THR 195 N -0.94 0.58 0.44 -0.71 -1.32 -0.50 -4.63 115.64 108.56 1t6g s THR 195 Ca 0.07 -0.87 -0.26 0.00 -1.21 0.00 0.00 61.69 59.42 1t6g s THR 195 Cb -0.09 -0.60 -0.09 0.00 -1.51 0.00 0.00 72.50 70.22 1t6g s THR 195 CO 0.03 -0.22 1.42 -2.84 -2.21 0.00 0.00 174.62 170.79 1t6g s PRO 196 N -1.19 3.78 -0.08 7.08 0.02 -1.26 -0.38 135.00 142.96 1t6g s PRO 196 Ca -0.06 2.40 -0.23 0.00 0.02 0.00 0.00 61.00 63.13 1t6g s PRO 196 Cb -0.08 -2.71 -0.03 0.00 0.02 0.00 0.00 34.50 31.70 1t6g s PRO 196 CO 0.00 -0.74 0.71 -0.51 -0.33 0.00 0.00 177.00 176.13 1t6g s LEU 197 N -2.61 4.29 -0.23 -5.54 1.43 -0.20 -4.50 118.68 111.33 1t6g s LEU 197 Ca 0.59 1.17 -0.07 0.00 -1.03 0.00 0.00 54.13 54.79 1t6g s LEU 197 Cb -0.43 -3.09 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 1t6g s LEU 197 CO 0.56 -0.15 0.07 -0.69 0.23 0.00 0.00 176.35 176.37 1t6g s VAL 198 N 0.98 4.47 -0.14 -1.59 1.01 0.24 -4.75 120.40 120.63 1t6g s VAL 198 Ca 0.37 -0.13 -0.26 0.00 0.00 0.00 0.00 61.98 61.97 1t6g s VAL 198 Cb -0.18 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 1t6g s VAL 198 CO 0.17 0.37 0.84 -0.89 0.00 0.00 0.00 175.10 175.59 1t6g s THR 199 N 1.27 4.89 -0.07 3.92 2.01 -1.26 -3.69 115.64 122.71 1t6g s THR 199 Ca 0.05 1.67 -0.03 0.00 0.31 0.00 0.00 61.69 63.69 1t6g s THR 199 Cb -0.15 -4.15 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 1t6g s THR 199 CO 0.04 0.06 0.07 -0.54 -0.69 0.00 0.00 174.62 173.55 1t6g s LYS 200 N 1.90 3.15 0.24 4.92 1.02 -1.26 -5.08 119.74 124.62 1t6g s LYS 200 Ca 0.40 -0.34 -0.31 0.00 0.02 0.00 0.00 55.97 55.74 1t6g s LYS 200 Cb -0.17 -2.93 -0.11 0.00 -0.52 0.00 0.00 37.83 34.10 1t6g s LYS 200 CO 0.14 0.71 1.58 0.20 -0.92 0.00 0.00 175.35 177.06 1t6g s GLY 201 N -1.16 1.86 0.00 -3.33 0.00 -1.26 -2.47 107.32 100.96 1t6g s GLY 201 Ca 0.16 1.47 0.00 0.00 0.00 0.00 0.00 44.72 46.36 1t6g s GLY 201 CO 0.06 2.57 0.00 0.61 0.00 0.00 0.00 173.10 176.34 1t6g n GLY 202 N 2.88 0.81 2.99 0.20 0.00 -1.26 -5.01 105.19 105.80 1t6g n GLY 202 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1t6g n GLY 202 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t6g s SER 203 N -2.63 0.98 0.00 1.61 0.15 -1.03 -4.97 113.70 107.81 1t6g s SER 203 Ca 0.00 -0.15 0.27 0.00 0.70 0.00 0.00 55.95 56.77 1t6g s SER 203 Cb 0.00 -0.20 0.86 0.00 -1.71 0.00 0.00 66.02 64.97 1t6g s SER 203 CO 0.00 0.07 1.63 -0.81 1.20 0.00 0.00 173.24 175.33 1t6g n PRO 204 N 3.13 1.55 -1.28 5.44 -0.04 -1.26 -4.38 135.00 138.17 1t6g n PRO 204 Ca -0.16 -0.98 -0.30 0.00 -0.04 0.00 0.00 63.50 62.03 1t6g n PRO 204 Cb 0.56 -1.48 0.13 0.00 -0.04 0.00 0.00 33.50 32.67 1t6g n PRO 204 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t6g s ALA 205 N -2.12 1.67 -0.25 0.55 0.00 -1.26 -0.81 121.76 119.54 1t6g s ALA 205 Ca 0.33 -0.11 -0.21 0.00 0.00 0.00 0.00 51.96 51.98 1t6g s ALA 205 Cb 0.20 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 20.14 1t6g s ALA 205 CO 0.38 -2.24 0.65 -1.01 0.00 0.00 0.00 175.76 173.53 1t6g s HIS 206 N -2.99 3.30 0.07 0.00 3.76 -1.26 -4.75 115.29 113.42 1t6g s HIS 206 Ca 0.63 0.86 0.08 0.00 -0.15 0.00 0.00 55.06 56.48 1t6g s HIS 206 Cb -0.17 -2.86 -0.03 0.00 1.11 0.00 0.00 32.58 30.63 1t6g s HIS 206 CO 0.56 -0.31 -0.22 0.71 -0.85 0.00 0.00 174.74 174.63 1t6g s TYR 207 N 2.46 1.88 0.33 1.40 2.02 -1.24 -1.87 117.35 122.34 1t6g s TYR 207 Ca 0.27 -0.39 0.04 0.00 -0.37 0.00 0.00 57.07 56.62 1t6g s TYR 207 Cb -0.15 -1.09 -0.03 0.00 -0.40 0.00 0.00 41.96 40.28 1t6g s TYR 207 CO 0.09 0.14 0.16 0.96 -1.57 0.00 0.00 175.55 175.33 1t6g s ILE 208 N -0.92 0.40 -0.19 2.71 -4.36 0.47 -0.59 121.20 118.72 1t6g s ILE 208 Ca 0.08 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.48 1t6g s ILE 208 Cb -0.09 -2.49 0.03 0.00 1.25 0.00 0.00 42.46 41.16 1t6g s ILE 208 CO 0.03 0.00 -0.16 -0.44 0.24 0.00 0.00 174.94 174.61 1t6g s SER 209 N -3.43 3.31 -0.12 4.36 0.01 -1.26 -1.37 113.70 115.19 1t6g s SER 209 Ca 0.33 -0.78 -0.13 0.00 1.31 0.00 0.00 55.95 56.68 1t6g s SER 209 Cb 0.04 -1.39 -0.05 0.00 0.21 0.00 0.00 66.02 64.84 1t6g s SER 209 CO 0.18 -0.07 0.29 0.00 0.41 0.00 0.00 173.24 174.05 1t6g s ALA 210 N 1.32 3.67 -0.56 1.44 0.00 -1.26 -1.76 121.76 124.60 1t6g s ALA 210 Ca 0.02 -0.44 0.18 0.00 0.00 0.00 0.00 51.96 51.72 1t6g s ALA 210 Cb -0.15 -2.31 -0.23 0.00 0.00 0.00 0.00 23.12 20.43 1t6g s ALA 210 CO -0.10 0.27 0.64 0.54 0.00 0.00 0.00 175.76 177.10 1t6g n ARG 211 N 2.92 0.85 -3.70 0.00 5.12 0.10 -4.34 116.66 117.62 1t6g n ARG 211 Ca -0.14 -0.06 -0.10 0.00 -1.93 0.00 0.00 57.85 55.62 1t6g n ARG 211 Cb 0.52 -1.39 -0.06 0.00 -1.16 0.00 0.00 32.46 30.38 1t6g n ARG 211 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1t6g s SER 212 N -3.23 -0.15 -0.03 0.55 1.04 -1.21 -4.98 113.70 105.68 1t6g s SER 212 Ca 0.02 -0.34 0.03 0.00 0.48 0.00 0.00 55.95 56.15 1t6g s SER 212 Cb 0.13 0.43 -0.00 0.00 0.10 0.00 0.00 66.02 66.68 1t6g s SER 212 CO 0.76 -0.78 -0.13 -0.63 0.98 0.00 0.00 173.24 173.44 1t6g s ILE 213 N -3.52 1.13 -0.06 -1.02 1.01 -1.26 -1.12 121.20 116.36 1t6g s ILE 213 Ca 0.01 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.14 1t6g s ILE 213 Cb 0.02 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.52 1t6g s ILE 213 CO -0.10 0.33 -0.13 -0.69 0.00 0.00 0.00 174.94 174.35 1t6g s VAL 214 N 0.11 1.19 -0.22 2.92 1.01 -0.22 -0.31 120.40 124.89 1t6g s VAL 214 Ca -0.03 -0.54 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 1t6g s VAL 214 Cb -0.10 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1t6g s VAL 214 CO 0.01 0.36 -0.02 -0.69 0.00 0.00 0.00 175.10 174.77 1t6g s VAL 215 N 0.45 3.64 0.00 2.92 1.01 -0.67 -1.00 120.40 126.75 1t6g s VAL 215 Ca -0.11 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.46 1t6g s VAL 215 Cb -0.14 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.58 1t6g s VAL 215 CO 0.03 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.15 1t6g n GLY 216 N 4.66 2.49 0.40 4.51 0.00 0.27 -1.87 105.19 115.65 1t6g n GLY 216 Ca -0.18 0.19 0.04 0.00 0.00 0.00 0.00 46.02 46.07 1t6g n GLY 216 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1t6g n ASP 217 N 10.53 2.14 -4.33 1.61 8.00 -1.26 -4.88 116.55 128.36 1t6g n ASP 217 Ca 0.00 -1.63 -0.33 0.00 0.71 0.00 0.00 54.79 53.53 1t6g n ASP 217 Cb 0.00 -0.08 -0.15 0.00 -0.02 0.00 0.00 41.12 40.88 1t6g n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1t6g s THR 218 N -0.83 2.94 0.29 -3.53 -4.23 -0.78 -5.08 115.64 104.41 1t6g s THR 218 Ca 0.13 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 59.66 1t6g s THR 218 Cb 0.08 -2.24 -0.11 0.00 1.34 0.00 0.00 72.50 71.56 1t6g s THR 218 CO 0.11 0.51 1.56 -0.60 -0.54 0.00 0.00 174.62 175.67 1t6g s ARG 219 N 0.60 4.14 -0.13 3.99 3.52 -1.26 -1.67 118.95 128.14 1t6g s ARG 219 Ca -0.08 2.53 -0.29 0.00 -0.13 0.00 0.00 55.73 57.76 1t6g s ARG 219 Cb -0.16 -3.03 -0.01 0.00 -1.56 0.00 0.00 34.95 30.19 1t6g s ARG 219 CO 0.03 -0.59 1.10 0.08 -0.81 0.00 0.00 175.30 175.11 1t6g s VAL 220 N -0.06 4.55 -0.24 7.11 1.01 0.58 -4.89 120.40 128.45 1t6g s VAL 220 Ca 0.62 1.85 -0.29 0.00 0.00 0.00 0.00 61.98 64.16 1t6g s VAL 220 Cb -0.47 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 31.71 1t6g s VAL 220 CO 0.48 -0.05 1.38 -2.84 0.00 0.00 0.00 175.10 174.06 1t6g s PRO 221 N 2.51 3.97 0.17 2.72 0.02 -1.26 -4.73 135.00 138.40 1t6g s PRO 221 Ca 0.50 1.47 0.11 0.00 0.02 0.00 0.00 61.00 63.10 1t6g s PRO 221 Cb -0.20 -3.89 -0.04 0.00 0.02 0.00 0.00 34.50 30.38 1t6g s PRO 221 CO 0.16 -1.06 -0.23 0.14 -0.33 0.00 0.00 177.00 175.68 1t6g s VAL 222 N 4.36 2.44 1.03 3.83 -7.23 -1.26 -4.83 120.40 118.75 1t6g s VAL 222 Ca 0.60 -1.90 -0.13 0.00 -1.81 0.00 0.00 61.98 58.75 1t6g s VAL 222 Cb -0.20 -2.15 0.16 0.00 0.56 0.00 0.00 36.38 34.74 1t6g s VAL 222 CO 0.23 -0.05 0.77 -2.65 -0.31 0.00 0.00 175.10 173.09 1t6g n PRO 223 N 0.43 -1.18 -1.97 4.82 -0.02 -1.26 -4.88 135.00 130.94 1t6g n PRO 223 Ca -0.14 -0.30 -0.42 0.00 -2.02 0.00 0.00 63.50 60.62 1t6g n PRO 223 Cb 0.55 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.90 1t6g n PRO 223 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1t6g s GLU 224 N -4.17 4.22 0.00 -0.52 2.56 -1.26 -2.11 118.70 117.43 1t6g s GLU 224 Ca 0.64 2.30 0.00 0.00 0.00 0.00 0.00 54.97 57.90 1t6g s GLU 224 Cb -0.22 -3.41 0.00 0.00 2.00 0.00 0.00 34.13 32.50 1t6g s GLU 224 CO 0.63 -0.65 0.00 0.41 -0.56 0.00 0.00 175.26 175.09 1t6g n GLY 225 N 3.84 0.95 0.18 -1.50 0.00 -1.26 -4.92 105.19 102.48 1t6g n GLY 225 Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.10 1t6g n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t6g h ALA 226 N 0.00 0.51 -2.40 4.61 0.00 -1.76 -3.36 119.26 116.85 1t6g h ALA 226 Ca 0.00 0.01 -0.68 0.00 0.00 0.00 0.00 54.91 54.24 1t6g h ALA 226 Cb 0.00 -0.07 -0.18 0.00 0.00 0.00 0.00 17.79 17.54 1t6g h ALA 226 CO 0.00 -0.14 -0.17 -0.51 0.00 0.00 0.00 179.25 178.43 1t6g s LEU 227 N -10.24 4.68 0.34 0.00 1.43 -1.26 -4.73 118.68 108.89 1t6g s LEU 227 Ca -0.13 -0.47 0.05 0.00 -1.03 0.00 0.00 54.13 52.55 1t6g s LEU 227 Cb 0.12 -2.44 -0.07 0.00 0.03 0.00 0.00 46.19 43.83 1t6g s LEU 227 CO 0.72 -0.54 0.03 0.00 0.23 0.00 0.00 176.35 176.79 1t6g s ALA 228 N 2.22 2.57 0.20 4.21 0.00 -1.26 -4.88 121.76 124.82 1t6g s ALA 228 Ca 0.14 -2.10 -0.32 0.00 0.00 0.00 0.00 51.96 49.67 1t6g s ALA 228 Cb -0.16 0.47 -0.13 0.00 0.00 0.00 0.00 23.12 23.30 1t6g s ALA 228 CO 0.14 -0.23 1.64 2.41 0.00 0.00 0.00 175.76 179.72 1t6g n THR 229 N -0.74 0.18 -1.67 0.00 -1.04 -1.26 -1.40 114.28 108.35 1t6g n THR 229 Ca -0.03 -0.04 -0.13 0.00 -2.04 0.00 0.00 64.05 61.80 1t6g n THR 229 Cb 0.66 -1.79 -0.04 0.00 -1.82 0.00 0.00 70.33 67.34 1t6g n THR 229 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1t6g n GLY 230 N 3.45 0.85 0.01 3.41 0.00 -1.24 -4.91 105.19 106.77 1t6g n GLY 230 Ca 0.15 -0.40 0.15 0.00 0.00 0.00 0.00 46.02 45.92 1t6g n GLY 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6g n GLY 231 N -1.26 -1.29 3.25 -0.02 0.00 -0.49 -4.58 105.19 100.79 1t6g n GLY 231 Ca -0.14 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1t6g n GLY 231 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t6g s VAL 232 N -2.66 2.88 0.08 1.61 1.01 -0.47 -0.13 120.40 122.71 1t6g s VAL 232 Ca 0.25 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1t6g s VAL 232 Cb 0.20 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 1t6g s VAL 232 CO 0.48 0.47 0.10 -0.32 0.00 0.00 0.00 175.10 175.84 1t6g s MET 233 N 1.33 2.98 -0.11 2.72 1.75 -0.25 -0.39 119.30 127.32 1t6g s MET 233 Ca 0.04 -0.65 -0.04 0.00 -1.25 0.00 0.00 55.69 53.79 1t6g s MET 233 Cb -0.14 -2.78 -0.04 0.00 2.84 0.00 0.00 34.83 34.71 1t6g s MET 233 CO -0.06 0.57 0.06 -0.51 -0.65 0.00 0.00 175.02 174.43 1t6g s LEU 234 N -2.41 3.92 -0.09 4.11 1.43 -0.78 -0.87 118.68 123.99 1t6g s LEU 234 Ca 0.30 0.27 -0.09 0.00 -1.03 0.00 0.00 54.13 53.58 1t6g s LEU 234 Cb -0.12 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 44.19 1t6g s LEU 234 CO 0.23 0.38 0.26 -0.55 0.23 0.00 0.00 176.35 176.90 1t6g s SER 235 N -0.86 -0.26 -0.10 2.29 0.15 -0.25 -4.53 113.70 110.15 1t6g s SER 235 Ca 0.13 0.48 0.15 0.00 0.70 0.00 0.00 55.95 57.41 1t6g s SER 235 Cb -0.12 0.52 0.49 0.00 -1.71 0.00 0.00 66.02 65.20 1t6g s SER 235 CO 0.03 -0.12 1.41 0.35 1.20 0.00 0.00 173.24 176.10 1t6g n THR 236 N 2.78 1.70 0.05 6.45 -2.24 -1.26 -3.34 114.28 118.41 1t6g n THR 236 Ca -0.14 -1.38 -0.07 0.00 -2.27 0.00 0.00 64.05 60.20 1t6g n THR 236 Cb 0.58 0.12 -0.12 0.00 -2.10 0.00 0.00 70.33 68.82 1t6g n THR 236 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1t6g h ARG 237 N 2.44 0.00 -5.61 -0.78 3.08 -1.93 -3.44 114.38 108.14 1t6g h ARG 237 Ca 0.00 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.60 1t6g h ARG 237 Cb 1.18 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 31.03 1t6g h ARG 237 CO 0.14 0.86 -0.78 -0.51 -1.07 0.00 0.00 179.97 178.61 1t6g s LEU 238 N -6.55 2.35 0.31 3.04 1.43 -1.26 -4.88 118.68 113.13 1t6g s LEU 238 Ca -0.00 -0.74 0.25 0.00 -1.03 0.00 0.00 54.13 52.61 1t6g s LEU 238 Cb 0.09 -0.64 0.59 0.00 0.03 0.00 0.00 46.19 46.27 1t6g s LEU 238 CO 0.82 -0.07 1.70 1.55 0.23 0.00 0.00 176.35 180.57 1t6g h PRO 239 N 3.81 0.00 -6.06 1.29 0.13 -1.88 -0.82 132.00 128.47 1t6g h PRO 239 Ca -0.42 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.19 1t6g h PRO 239 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 1t6g h PRO 239 CO 0.46 0.00 -0.41 1.52 -0.23 0.00 0.00 178.00 179.34 1t6g s TYR 240 N -3.15 2.58 0.02 1.56 -0.85 -1.26 -1.80 117.35 114.44 1t6g s TYR 240 Ca 0.09 -0.56 -0.23 0.00 -0.52 0.00 0.00 57.07 55.85 1t6g s TYR 240 Cb 0.09 -2.08 -0.05 0.00 0.38 0.00 0.00 41.96 40.30 1t6g s TYR 240 CO 0.63 -0.05 0.69 0.08 -1.52 0.00 0.00 175.55 175.37 1t6g s VAL 241 N -2.54 4.83 -0.09 -3.49 1.01 0.60 -3.68 120.40 117.03 1t6g s VAL 241 Ca 0.45 1.45 -0.11 0.00 0.00 0.00 0.00 61.98 63.76 1t6g s VAL 241 Cb -0.01 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 1t6g s VAL 241 CO 0.26 0.38 0.27 -0.76 0.00 0.00 0.00 175.10 175.25 1t6g s LEU 242 N -0.07 4.38 -0.10 3.92 1.43 -0.71 -0.38 118.68 127.16 1t6g s LEU 242 Ca 0.35 0.65 0.02 0.00 -1.03 0.00 0.00 54.13 54.12 1t6g s LEU 242 Cb -0.19 -2.32 0.01 0.00 0.03 0.00 0.00 46.19 43.72 1t6g s LEU 242 CO 0.20 0.30 -0.15 -0.76 0.23 0.00 0.00 176.35 176.18 1t6g s LEU 243 N -0.68 1.69 0.44 1.79 1.43 -0.22 -0.61 118.68 122.52 1t6g s LEU 243 Ca 0.18 -0.39 -0.26 0.00 -1.03 0.00 0.00 54.13 52.63 1t6g s LEU 243 Cb -0.14 -1.02 -0.09 0.00 0.03 0.00 0.00 46.19 44.97 1t6g s LEU 243 CO 0.07 0.02 1.43 -1.14 0.23 0.00 0.00 176.35 176.97 1t6g n ARG 244 N 4.09 2.29 -0.23 1.70 0.63 -0.51 -1.14 116.66 123.49 1t6g n ARG 244 Ca -0.20 0.81 0.16 0.00 -0.92 0.00 0.00 57.85 57.70 1t6g n ARG 244 Cb 0.51 -2.63 0.46 0.00 0.45 0.00 0.00 32.46 31.26 1t6g n ARG 244 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1t6g h PRO 245 N 2.37 0.50 0.00 -0.14 0.11 -1.84 0.98 132.00 133.97 1t6g h PRO 245 Ca -0.51 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 1t6g h PRO 245 Cb 1.27 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1t6g h PRO 245 CO 0.61 0.33 -0.13 0.38 -0.21 0.00 0.00 178.00 178.98 1t6g h ASP 246 N 0.51 0.00 0.13 -2.05 2.03 -1.89 -2.51 116.42 112.64 1t6g h ASP 246 Ca 0.44 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 56.38 1t6g h ASP 246 Cb 0.93 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.38 1t6g h ASP 246 CO -0.18 0.13 -2.16 0.52 -1.03 0.00 0.00 179.24 176.52 1t6g n VAL 247 N -3.64 1.61 -0.04 4.15 0.31 0.13 -4.48 118.33 116.37 1t6g n VAL 247 Ca -0.02 -0.68 -0.08 0.00 -0.01 0.00 0.00 64.34 63.55 1t6g n VAL 247 Cb 0.25 -1.35 -0.02 0.00 -0.91 0.00 0.00 33.84 31.81 1t6g n VAL 247 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1t6g h TYR 248 N 0.03 -0.62 0.62 3.52 3.20 -0.79 -2.17 116.97 120.76 1t6g h TYR 248 Ca -0.47 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.41 1t6g h TYR 248 Cb 2.02 0.31 -0.00 0.00 1.54 0.00 0.00 36.73 40.59 1t6g h TYR 248 CO 0.04 -0.31 -0.37 -0.09 -1.64 0.00 0.00 178.16 175.79 1t6g h ARG 249 N -0.25 -0.90 -0.49 1.82 9.65 -1.68 0.12 114.38 122.65 1t6g h ARG 249 Ca 0.13 0.06 -0.05 0.00 -1.10 0.00 0.00 59.98 59.02 1t6g h ARG 249 Cb 0.45 0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 29.21 1t6g h ARG 249 CO -0.37 -0.60 0.09 -1.00 2.80 0.00 0.00 179.97 180.89 1t6g h PRO 250 N -0.93 0.76 -0.04 0.20 0.13 -1.78 -1.47 132.00 128.86 1t6g h PRO 250 Ca -0.08 -0.16 -0.01 0.00 -0.87 0.00 0.00 66.00 64.88 1t6g h PRO 250 Cb 0.75 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.77 1t6g h PRO 250 CO 0.09 0.71 -0.02 1.25 -0.23 0.00 0.00 178.00 179.80 1t6g h LEU 251 N 0.73 0.09 -0.62 1.56 6.46 -1.22 -1.42 115.31 120.90 1t6g h LEU 251 Ca 0.16 -0.40 -0.10 0.00 -0.12 0.00 0.00 57.88 57.42 1t6g h LEU 251 Cb 0.31 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.20 1t6g h LEU 251 CO 0.00 0.47 -0.02 -0.03 -0.62 0.00 0.00 178.44 178.24 1t6g h MET 252 N -0.29 1.06 -0.89 1.25 4.05 -0.73 -1.10 114.93 118.28 1t6g h MET 252 Ca 0.01 -0.35 -0.00 0.00 -0.28 0.00 0.00 59.70 59.08 1t6g h MET 252 Cb 0.43 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.10 1t6g h MET 252 CO 0.01 1.05 0.54 -0.44 0.23 0.00 0.00 176.91 178.29 1t6g h ASP 253 N 0.96 1.07 -0.65 1.39 3.32 -1.26 -0.18 116.42 121.07 1t6g h ASP 253 Ca 0.17 -0.07 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 1t6g h ASP 253 Cb 0.58 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1t6g h ASP 253 CO 0.03 0.82 0.06 0.00 -1.72 0.00 0.00 179.24 178.43 1t6g h ALA 254 N 1.29 0.87 -0.11 3.45 0.00 -0.86 -1.98 119.26 121.92 1t6g h ALA 254 Ca 0.32 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1t6g h ALA 254 Cb -0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 1t6g h ALA 254 CO -0.06 0.67 -0.03 0.35 0.00 0.00 0.00 179.25 180.18 1t6g h PHE 255 N 1.02 0.25 -0.14 0.00 3.04 -0.88 -1.43 116.94 118.79 1t6g h PHE 255 Ca 0.19 -0.05 -0.15 0.00 3.98 0.00 0.00 57.97 61.94 1t6g h PHE 255 Cb 0.50 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.94 1t6g h PHE 255 CO 0.04 0.53 -0.55 1.79 -2.02 0.00 0.00 178.31 178.09 1t6g h THR 256 N -0.11 1.34 -0.15 4.41 1.35 -1.03 0.11 112.91 118.83 1t6g h THR 256 Ca 0.03 -1.83 -0.01 0.00 -0.55 0.00 0.00 66.41 64.05 1t6g h THR 256 Cb 0.45 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 68.70 1t6g h THR 256 CO 0.01 0.56 0.04 0.50 -0.25 0.00 0.00 175.52 176.38 1t6g h LYS 257 N 0.33 0.23 -0.59 4.72 3.64 -1.36 -0.77 116.57 122.76 1t6g h LYS 257 Ca 0.00 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 1t6g h LYS 257 Cb 1.07 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 1t6g h LYS 257 CO 0.10 0.36 0.16 0.00 -2.27 0.00 0.00 179.45 177.80 1t6g h ALA 258 N 0.86 0.78 -0.68 5.00 0.00 -1.10 -2.52 119.26 121.60 1t6g h ALA 258 Ca 0.05 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1t6g h ALA 258 Cb 0.23 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1t6g h ALA 258 CO -0.00 0.47 0.21 1.25 0.00 0.00 0.00 179.25 181.18 1t6g h LEU 259 N 0.85 1.00 -2.16 0.00 5.85 -0.94 -2.40 115.31 117.51 1t6g h LEU 259 Ca 0.19 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1t6g h LEU 259 Cb 0.33 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1t6g h LEU 259 CO -0.00 0.94 -0.07 0.00 -0.34 0.00 0.00 178.44 178.97 1t6g h ALA 260 N 1.09 1.31 -0.01 1.25 0.00 -0.85 -2.91 119.26 119.13 1t6g h ALA 260 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1t6g h ALA 260 Cb 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1t6g h ALA 260 CO -0.01 0.09 -0.14 0.00 0.00 0.00 0.00 179.25 179.19 1t6g n ALA 261 N -2.26 2.84 -1.91 0.00 0.00 -0.91 -4.78 120.51 113.49 1t6g n ALA 261 Ca -0.02 -0.45 -0.31 0.00 0.00 0.00 0.00 53.44 52.65 1t6g n ALA 261 Cb 0.18 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 1t6g n ALA 261 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1t6g s GLN 262 N -2.25 3.84 0.00 0.00 -0.21 -1.10 -5.10 119.66 114.84 1t6g s GLN 262 Ca 0.30 0.82 0.00 0.00 0.02 0.00 0.00 55.36 56.50 1t6g s GLN 262 Cb 0.20 -2.17 0.00 0.00 1.00 0.00 0.00 33.01 32.04 1t6g s GLN 262 CO 0.43 -0.29 0.24 0.41 -2.12 0.00 0.00 175.29 173.96 1t6g n GLY 266 N -1.79 0.40 3.69 3.09 0.00 -1.26 -4.66 105.19 104.67 1t6g n GLY 266 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1t6g n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t6g s ALA 267 N -1.21 1.49 0.49 4.61 0.00 -1.26 -4.95 121.76 120.94 1t6g s ALA 267 Ca 0.00 0.20 -0.22 0.00 0.00 0.00 0.00 51.96 51.94 1t6g s ALA 267 Cb 0.00 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 1t6g s ALA 267 CO 0.00 -2.47 1.02 -2.30 0.00 0.00 0.00 175.76 172.01 1t6g n PRO 268 N -4.00 1.26 -3.42 0.00 -0.02 -1.26 -5.00 135.00 122.56 1t6g n PRO 268 Ca 0.08 0.46 -0.37 0.00 -2.02 0.00 0.00 63.50 61.66 1t6g n PRO 268 Cb 0.54 -2.12 -0.06 0.00 -0.02 0.00 0.00 33.50 31.83 1t6g n PRO 268 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1t6g s VAL 269 N -1.36 4.93 0.20 -1.45 1.01 -1.26 -4.79 120.40 117.67 1t6g s VAL 269 Ca 0.67 0.83 -0.32 0.00 0.00 0.00 0.00 61.98 63.16 1t6g s VAL 269 Cb -0.50 -3.74 -0.14 0.00 0.00 0.00 0.00 36.38 32.00 1t6g s VAL 269 CO 0.54 0.41 1.35 0.00 0.00 0.00 0.00 175.10 177.39 1t6g n ALA 270 N 1.29 0.39 -4.02 5.51 0.00 -1.22 -4.82 120.51 117.64 1t6g n ALA 270 Ca -0.09 0.44 -0.30 0.00 0.00 0.00 0.00 53.44 53.48 1t6g n ALA 270 Cb 0.52 -2.19 -0.16 0.00 0.00 0.00 0.00 19.45 17.62 1t6g n ALA 270 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1t6g s ARG 271 N -0.17 2.28 0.45 0.00 3.52 -1.26 -4.93 118.95 118.83 1t6g s ARG 271 Ca 0.72 -0.66 -0.23 0.00 -0.13 0.00 0.00 55.73 55.43 1t6g s ARG 271 Cb -0.74 -2.23 -0.08 0.00 -1.56 0.00 0.00 34.95 30.34 1t6g s ARG 271 CO 0.49 -0.29 1.14 0.00 -0.81 0.00 0.00 175.30 175.83 1t6g s ALA 272 N 1.44 3.00 0.30 6.12 0.00 -1.26 -1.52 121.76 129.85 1t6g s ALA 272 Ca 0.03 0.89 0.03 0.00 0.00 0.00 0.00 51.96 52.91 1t6g s ALA 272 Cb -0.14 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.56 1t6g s ALA 272 CO -0.10 -0.57 0.08 0.14 0.00 0.00 0.00 175.76 175.30 1t6g s VAL 273 N -1.56 0.93 0.26 0.00 -7.23 0.21 -4.81 120.40 108.21 1t6g s VAL 273 Ca 0.62 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.49 1t6g s VAL 273 Cb -0.27 -2.72 -0.13 0.00 0.56 0.00 0.00 36.38 33.81 1t6g s VAL 273 CO 0.33 0.00 1.39 1.21 -0.31 0.00 0.00 175.10 177.72 1t6g n GLU 274 N -0.61 2.07 -2.19 4.82 2.13 -1.26 -4.28 120.64 121.32 1t6g n GLU 274 Ca -0.01 0.73 -0.37 0.00 0.66 0.00 0.00 57.16 58.17 1t6g n GLU 274 Cb 0.66 -2.38 -0.00 0.00 0.27 0.00 0.00 31.44 29.99 1t6g n GLU 274 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1t6g s ALA 275 N -0.24 2.95 -0.23 4.31 0.00 -1.26 -4.81 121.76 122.47 1t6g s ALA 275 Ca 0.66 0.99 -0.06 0.00 0.00 0.00 0.00 51.96 53.55 1t6g s ALA 275 Cb -0.63 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.06 1t6g s ALA 275 CO 0.52 -0.76 0.02 0.08 0.00 0.00 0.00 175.76 175.62 1t6g s VAL 276 N -1.51 3.96 0.45 0.00 1.01 -1.26 -5.01 120.40 118.04 1t6g s VAL 276 Ca 0.65 -0.30 -0.25 0.00 0.00 0.00 0.00 61.98 62.08 1t6g s VAL 276 Cb -0.30 -2.82 -0.08 0.00 0.00 0.00 0.00 36.38 33.17 1t6g s VAL 276 CO 0.36 0.39 1.40 0.00 0.00 0.00 0.00 175.10 177.25 1t6g n ALA 277 N 4.71 1.89 0.87 5.51 0.00 -1.26 -0.95 120.51 131.27 1t6g n ALA 277 Ca -0.17 0.24 0.05 0.00 0.00 0.00 0.00 53.44 53.57 1t6g n ALA 277 Cb 0.51 -2.37 0.15 0.00 0.00 0.00 0.00 19.45 17.74 1t6g n ALA 277 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1t6g n PRO 278 N -0.20 1.86 -2.18 0.00 -0.04 -1.26 -5.11 135.00 128.07 1t6g n PRO 278 Ca 0.06 -1.22 -0.31 0.00 -0.04 0.00 0.00 63.50 61.99 1t6g n PRO 278 Cb 0.41 -1.31 -0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1t6g n PRO 278 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1t6g s PHE 279 N -1.57 3.57 -0.09 0.54 0.08 -0.13 -4.94 117.98 115.44 1t6g s PHE 279 Ca 0.23 1.23 0.14 0.00 0.12 0.00 0.00 56.93 58.65 1t6g s PHE 279 Cb 0.12 -2.65 -0.21 0.00 -0.57 0.00 0.00 43.02 39.71 1t6g s PHE 279 CO 0.15 -0.51 0.19 0.41 -0.10 0.00 0.00 175.22 175.36 1t6g n GLY 280 N -2.30 -0.73 2.78 4.36 0.00 -1.26 -4.28 105.19 103.76 1t6g n GLY 280 Ca 0.05 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.53 1t6g n GLY 280 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t6g s VAL 281 N -2.71 0.43 0.05 1.61 1.01 -1.26 -4.77 120.40 114.76 1t6g s VAL 281 Ca -0.07 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1t6g s VAL 281 Cb 0.07 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 1t6g s VAL 281 CO 0.63 0.26 -0.07 0.00 0.00 0.00 0.00 175.10 175.92 1t6g s TYR 283 N -1.63 1.33 -0.10 0.00 2.02 0.49 -0.62 117.35 118.85 1t6g s TYR 283 Ca -0.08 -0.50 -0.29 0.00 -0.37 0.00 0.00 57.07 55.83 1t6g s TYR 283 Cb -0.08 -0.73 -0.05 0.00 -0.40 0.00 0.00 41.96 40.70 1t6g s TYR 283 CO -0.00 0.10 1.62 0.34 -1.57 0.00 0.00 175.55 176.04 1t6g s ASP 284 N -2.04 6.62 0.55 2.29 -1.08 -0.58 -1.35 116.67 121.08 1t6g s ASP 284 Ca 0.03 2.07 0.31 0.00 -0.52 0.00 0.00 52.55 54.44 1t6g s ASP 284 Cb -0.08 -2.53 1.57 0.00 -1.46 0.00 0.00 42.92 40.41 1t6g s ASP 284 CO 0.03 -0.99 2.09 0.71 0.52 0.00 0.00 175.17 177.53 1t6g h THR 285 N 5.70 0.35 0.00 1.71 1.35 -1.55 -1.11 112.91 119.36 1t6g h THR 285 Ca -0.37 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1t6g h THR 285 Cb 1.17 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 1t6g h THR 285 CO 0.96 0.08 0.00 0.11 -0.25 0.00 0.00 175.52 176.42 1t6g h LYS 286 N 0.00 0.00 -0.48 4.72 1.57 -1.91 -2.76 116.57 117.71 1t6g h LYS 286 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1t6g h LYS 286 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1t6g h LYS 286 CO 0.01 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.14 1t6g n THR 287 N -2.46 1.12 -4.98 -0.16 -2.24 -0.42 -4.79 114.28 100.36 1t6g n THR 287 Ca -0.00 -1.06 -0.32 0.00 -2.27 0.00 0.00 64.05 60.39 1t6g n THR 287 Cb 0.12 0.44 -0.14 0.00 -2.10 0.00 0.00 70.33 68.65 1t6g n THR 287 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1t6g s LEU 288 N -1.15 2.53 0.00 3.22 1.43 -1.04 -3.37 118.68 120.30 1t6g s LEU 288 Ca 0.34 -0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 53.09 1t6g s LEU 288 Cb 0.19 -1.51 0.07 0.00 0.03 0.00 0.00 46.19 44.96 1t6g s LEU 288 CO 0.21 0.28 0.43 0.61 0.23 0.00 0.00 176.35 178.11 1t6g n GLY 289 N 2.75 -0.07 3.29 -3.19 0.00 -1.26 -4.89 105.19 101.82 1t6g n GLY 289 Ca -0.17 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 43.89 1t6g n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t6g s ASN 290 N -2.65 0.08 0.13 1.61 2.20 -1.26 -0.43 114.94 114.62 1t6g s ASN 290 Ca 0.26 -0.83 -0.01 0.00 -0.94 0.00 0.00 52.86 51.34 1t6g s ASN 290 Cb -0.01 0.40 0.01 0.00 -2.00 0.00 0.00 41.25 39.65 1t6g s ASN 290 CO 0.18 -0.84 0.20 -0.46 -2.94 0.00 0.00 177.10 173.24 1t6g n ASN 291 N -0.17 -0.55 0.09 3.54 0.23 -0.39 -4.74 115.26 113.27 1t6g n ASN 291 Ca -0.09 -1.69 0.09 0.00 -0.53 0.00 0.00 54.58 52.36 1t6g n ASN 291 Cb 0.63 1.01 0.41 0.00 -2.08 0.00 0.00 39.78 39.75 1t6g n ASN 291 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1t6g n LEU 292 N 0.00 0.42 -0.72 -4.53 4.77 -1.26 -1.64 117.00 114.04 1t6g n LEU 292 Ca -0.00 0.63 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 1t6g n LEU 292 Cb 0.22 -0.60 0.27 0.00 -2.33 0.00 0.00 43.42 40.98 1t6g n LEU 292 CO 0.11 -0.56 0.71 0.61 -1.33 0.00 0.00 177.39 176.92 1t6g n GLY 293 N -0.42 0.49 0.00 -0.72 0.00 -1.26 -4.90 105.19 98.38 1t6g n GLY 293 Ca 0.01 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1t6g n GLY 293 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6g n GLY 294 N 1.29 0.24 3.62 -0.02 0.00 -0.65 -1.91 105.19 107.76 1t6g n GLY 294 Ca 0.16 -2.10 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 1t6g n GLY 294 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1t6g n TYR 295 N 0.00 1.14 -2.81 1.61 4.01 -1.26 -1.26 117.16 118.59 1t6g n TYR 295 Ca 0.00 0.50 -0.44 0.00 -0.16 0.00 0.00 57.90 57.81 1t6g n TYR 295 Cb 0.00 -2.21 0.00 0.00 -0.31 0.00 0.00 39.34 36.82 1t6g n TYR 295 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1t6g n ALA 296 N -0.89 4.01 -2.48 -0.72 0.00 0.43 -3.57 120.51 117.29 1t6g n ALA 296 Ca 0.10 -4.19 -0.23 0.00 0.00 0.00 0.00 53.44 49.12 1t6g n ALA 296 Cb 0.42 -3.14 -0.10 0.00 0.00 0.00 0.00 19.45 16.63 1t6g n ALA 296 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1t6g s VAL 297 N 1.85 1.95 0.19 0.00 -7.23 -1.26 -4.49 120.40 111.40 1t6g s VAL 297 Ca 0.44 -2.17 -0.33 0.00 -1.81 0.00 0.00 61.98 58.11 1t6g s VAL 297 Cb -0.00 -2.54 -0.13 0.00 0.56 0.00 0.00 36.38 34.27 1t6g s VAL 297 CO 0.01 -0.26 1.64 -2.65 -0.31 0.00 0.00 175.10 173.54 1t6g n PRO 298 N -0.68 2.47 -1.81 4.82 -0.02 -1.26 -4.74 135.00 133.78 1t6g n PRO 298 Ca -0.05 0.89 -0.39 0.00 -2.02 0.00 0.00 63.50 61.93 1t6g n PRO 298 Cb 0.63 -2.69 0.03 0.00 -0.02 0.00 0.00 33.50 31.45 1t6g n PRO 298 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1t6g s ASN 299 N 1.00 5.62 -0.06 2.55 0.01 -1.26 -4.78 114.94 118.03 1t6g s ASN 299 Ca 0.76 2.84 0.03 0.00 -0.71 0.00 0.00 52.86 55.78 1t6g s ASN 299 Cb -0.59 -2.64 0.01 0.00 0.41 0.00 0.00 41.25 38.43 1t6g s ASN 299 CO 0.36 -1.34 -0.14 -0.69 -1.51 0.00 0.00 177.10 173.78 1t6g s VAL 300 N -1.25 1.25 -0.03 1.60 1.01 -0.88 -0.56 120.40 121.53 1t6g s VAL 300 Ca 0.66 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 62.12 1t6g s VAL 300 Cb -0.42 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 1t6g s VAL 300 CO 0.52 0.37 -0.20 -1.10 0.00 0.00 0.00 175.10 174.69 1t6g s GLN 301 N 0.41 1.87 -0.27 2.72 1.11 -0.17 -0.30 119.66 125.04 1t6g s GLN 301 Ca -0.11 -0.73 -0.09 0.00 0.01 0.00 0.00 55.36 54.44 1t6g s GLN 301 Cb -0.14 -1.70 -0.03 0.00 -1.01 0.00 0.00 33.01 30.13 1t6g s GLN 301 CO 0.03 0.37 0.13 -0.51 0.01 0.00 0.00 175.29 175.33 1t6g s LEU 302 N -0.27 3.80 -0.51 2.90 1.43 -0.27 -1.05 118.68 124.71 1t6g s LEU 302 Ca 0.02 -0.22 -0.28 0.00 -1.03 0.00 0.00 54.13 52.62 1t6g s LEU 302 Cb -0.10 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 44.14 1t6g s LEU 302 CO 0.01 -0.08 1.14 -0.83 0.23 0.00 0.00 176.35 176.82 1t6g s GLY 303 N 1.66 1.26 0.15 -3.19 0.00 -0.27 -1.16 107.32 105.76 1t6g s GLY 303 Ca 0.06 -0.62 -0.01 0.00 0.00 0.00 0.00 44.72 44.15 1t6g s GLY 303 CO 0.07 2.42 0.33 1.08 0.00 0.00 0.00 173.10 176.99 1t6g s LEU 304 N 4.56 4.28 0.17 0.66 1.43 -0.65 -0.72 118.68 128.42 1t6g s LEU 304 Ca 0.45 0.38 -0.32 0.00 -1.03 0.00 0.00 54.13 53.61 1t6g s LEU 304 Cb -0.07 -3.11 -0.16 0.00 0.03 0.00 0.00 46.19 42.87 1t6g s LEU 304 CO 0.29 0.04 1.06 0.47 0.23 0.00 0.00 176.35 178.45 1t6g n ASP 305 N -0.25 0.91 0.00 2.29 8.00 -0.72 -1.86 116.55 124.92 1t6g n ASP 305 Ca -0.05 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.60 1t6g n ASP 305 Cb 0.53 -1.17 0.00 0.00 -0.02 0.00 0.00 41.12 40.46 1t6g n ASP 305 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1t6g n GLY 306 N 1.88 1.73 0.67 0.44 0.00 -1.26 -4.34 105.19 104.30 1t6g n GLY 306 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1t6g n GLY 306 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6g n GLY 307 N -1.51 0.77 3.73 -0.02 0.00 -0.78 -4.98 105.19 102.40 1t6g n GLY 307 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1t6g n GLY 307 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t6g s SER 308 N -2.42 4.97 -0.03 1.61 0.01 -1.24 -4.95 113.70 111.65 1t6g s SER 308 Ca 0.00 -0.49 0.01 0.00 1.31 0.00 0.00 55.95 56.78 1t6g s SER 308 Cb 0.00 -1.07 -0.03 0.00 0.21 0.00 0.00 66.02 65.13 1t6g s SER 308 CO 0.00 -0.04 -0.03 -1.81 0.41 0.00 0.00 173.24 171.77 1t6g s ASP 309 N -3.76 4.95 -0.34 2.44 1.01 -1.26 -1.64 116.67 118.07 1t6g s ASP 309 Ca 0.33 -0.01 -0.18 0.00 0.71 0.00 0.00 52.55 53.40 1t6g s ASP 309 Cb -0.07 -1.28 -0.01 0.00 1.01 0.00 0.00 42.92 42.58 1t6g s ASP 309 CO 0.22 0.32 0.49 0.86 0.21 0.00 0.00 175.17 177.26 1t6g s TRP 310 N -0.98 3.19 0.00 4.23 -0.11 -0.31 -4.93 118.94 120.04 1t6g s TRP 310 Ca 0.16 0.18 -0.01 0.00 1.22 0.00 0.00 56.10 57.65 1t6g s TRP 310 Cb -0.11 -2.86 -0.04 0.00 -1.50 0.00 0.00 33.47 28.95 1t6g s TRP 310 CO 0.06 -0.50 0.14 0.95 -4.62 0.00 0.00 176.95 172.99 1t6g s THR 311 N 2.32 5.13 -0.10 5.86 -4.23 -1.26 -1.12 115.64 122.25 1t6g s THR 311 Ca 0.18 -0.30 0.03 0.00 -1.18 0.00 0.00 61.69 60.42 1t6g s THR 311 Cb -0.16 -3.39 0.00 0.00 1.34 0.00 0.00 72.50 70.30 1t6g s THR 311 CO 0.13 0.31 -0.21 -0.04 -0.54 0.00 0.00 174.62 174.27 1t6g s MET 312 N -1.94 2.69 0.24 3.99 -1.94 0.59 -5.00 119.30 117.93 1t6g s MET 312 Ca 0.26 -0.75 0.01 0.00 -1.71 0.00 0.00 55.69 53.50 1t6g s MET 312 Cb -0.12 -2.08 0.01 0.00 2.01 0.00 0.00 34.83 34.65 1t6g s MET 312 CO 0.18 0.12 0.10 0.25 -0.01 0.00 0.00 175.02 175.66 1t6g n THR 313 N 3.67 0.00 -0.26 2.05 -2.24 -1.26 -2.08 114.28 114.16 1t6g n THR 313 Ca -0.20 -1.01 0.18 0.00 -2.27 0.00 0.00 64.05 60.75 1t6g n THR 313 Cb 0.52 -0.08 0.47 0.00 -2.10 0.00 0.00 70.33 69.15 1t6g n THR 313 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1t6g h GLY 314 N 0.40 1.04 2.00 3.38 0.00 -1.58 0.55 103.07 108.84 1t6g h GLY 314 Ca -0.17 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1t6g h GLY 314 CO 0.27 -0.01 0.00 0.07 0.00 0.00 0.00 176.54 176.87 1t6g h LYS 315 N 0.48 0.00 0.00 4.80 2.10 -1.67 -1.92 116.57 120.36 1t6g h LYS 315 Ca 0.49 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.92 1t6g h LYS 315 Cb 1.11 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.40 1t6g h LYS 315 CO -0.21 0.00 -2.02 0.09 -2.00 0.00 0.00 179.45 175.31 1t6g n ASN 316 N -2.93 1.03 -0.27 7.07 3.02 0.05 -4.68 115.26 118.53 1t6g n ASN 316 Ca -0.01 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.62 1t6g n ASN 316 Cb 0.20 1.14 -0.02 0.00 -0.61 0.00 0.00 39.78 40.49 1t6g n ASN 316 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1t6g n SER 317 N -2.46 1.39 -4.07 6.41 3.41 -0.40 -4.48 113.62 113.42 1t6g n SER 317 Ca -0.20 -1.19 -0.22 0.00 -0.26 0.00 0.00 58.87 57.00 1t6g n SER 317 Cb 0.87 0.60 -0.15 0.00 -0.26 0.00 0.00 64.21 65.27 1t6g n SER 317 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1t6g s MET 318 N -2.00 1.13 -0.17 4.33 -1.94 -0.74 -0.08 119.30 119.83 1t6g s MET 318 Ca 0.11 -0.44 0.00 0.00 -1.71 0.00 0.00 55.69 53.66 1t6g s MET 318 Cb 0.12 -1.06 0.01 0.00 2.01 0.00 0.00 34.83 35.91 1t6g s MET 318 CO 0.45 0.23 -0.17 0.08 -0.01 0.00 0.00 175.02 175.60 1t6g s VAL 319 N -0.13 2.43 -0.24 -6.03 1.01 0.22 -4.75 120.40 112.91 1t6g s VAL 319 Ca 0.02 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 60.87 1t6g s VAL 319 Cb -0.07 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 1t6g s VAL 319 CO 0.00 0.52 1.40 -1.81 0.00 0.00 0.00 175.10 175.21 1t6g s ASP 320 N 1.04 6.63 -0.19 3.32 -0.00 -1.26 -0.57 116.67 125.65 1t6g s ASP 320 Ca -0.01 1.47 0.11 0.00 -0.00 0.00 0.00 52.55 54.11 1t6g s ASP 320 Cb -0.15 -2.54 -0.19 0.00 -0.00 0.00 0.00 42.92 40.05 1t6g s ASP 320 CO -0.05 -1.07 -0.03 1.33 -0.00 0.00 0.00 175.17 175.36 1t6g n VAL 321 N 6.08 1.20 -3.55 -1.27 0.24 -0.99 -4.99 118.33 115.05 1t6g n VAL 321 Ca 0.16 -0.64 -0.08 0.00 -2.04 0.00 0.00 64.34 61.74 1t6g n VAL 321 Cb 0.46 -0.80 -0.02 0.00 -1.47 0.00 0.00 33.84 32.01 1t6g n VAL 321 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1t6g s LYS 322 N -2.42 1.03 -0.15 7.34 -2.85 -1.22 -5.06 119.74 116.42 1t6g s LYS 322 Ca -0.16 -0.43 -0.39 0.00 -1.00 0.00 0.00 55.97 53.99 1t6g s LYS 322 Cb 0.06 0.44 -0.16 0.00 -2.06 0.00 0.00 37.83 36.11 1t6g s LYS 322 CO 0.63 -0.46 1.60 0.94 0.10 0.00 0.00 175.35 178.17 1t6g n GLN 323 N -0.32 1.16 -0.06 1.78 -0.06 -1.26 -1.48 117.38 117.14 1t6g n GLN 323 Ca -0.10 0.42 0.00 0.00 -2.00 0.00 0.00 57.00 55.33 1t6g n GLN 323 Cb 0.62 -2.09 0.00 0.00 -4.06 0.00 0.00 30.24 24.71 1t6g n GLN 323 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1t6g n GLY 324 N 3.61 1.16 2.90 1.69 0.00 -1.26 -5.04 105.19 108.25 1t6g n GLY 324 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 1t6g n GLY 324 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t6g s THR 325 N -2.47 0.65 0.01 2.61 2.01 -0.55 -1.33 115.64 116.57 1t6g s THR 325 Ca 0.00 -0.16 0.06 0.00 0.31 0.00 0.00 61.69 61.90 1t6g s THR 325 Cb 0.00 -0.68 -0.02 0.00 0.01 0.00 0.00 72.50 71.81 1t6g s THR 325 CO 0.00 0.26 -0.19 0.00 -0.69 0.00 0.00 174.62 174.00 1t6g s ALA 326 N 1.10 1.60 0.05 7.40 0.00 -0.45 -2.34 121.76 129.12 1t6g s ALA 326 Ca -0.08 -0.90 0.07 0.00 0.00 0.00 0.00 51.96 51.05 1t6g s ALA 326 Cb -0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 1t6g s ALA 326 CO -0.01 0.38 -0.15 0.00 0.00 0.00 0.00 175.76 175.98 1t6g s VAL 328 N -1.00 3.44 -0.12 0.00 1.01 0.11 -0.61 120.40 123.23 1t6g s VAL 328 Ca 0.16 0.97 0.01 0.00 0.00 0.00 0.00 61.98 63.12 1t6g s VAL 328 Cb -0.11 -3.62 0.16 0.00 0.00 0.00 0.00 36.38 32.81 1t6g s VAL 328 CO 0.07 0.04 1.31 0.00 0.00 0.00 0.00 175.10 176.52 1t6g n ALA 329 N 4.58 3.41 -3.86 5.51 0.00 0.88 -4.62 120.51 126.41 1t6g n ALA 329 Ca 0.12 -0.73 -0.34 0.00 0.00 0.00 0.00 53.44 52.49 1t6g n ALA 329 Cb 0.43 -1.12 -0.15 0.00 0.00 0.00 0.00 19.45 18.61 1t6g n ALA 329 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1t6g s PHE 330 N -0.83 3.01 -0.05 0.00 0.08 -1.26 -0.29 117.98 118.64 1t6g s PHE 330 Ca 0.14 -1.64 0.06 0.00 0.12 0.00 0.00 56.93 55.61 1t6g s PHE 330 Cb 0.12 -2.01 -0.01 0.00 -0.57 0.00 0.00 43.02 40.55 1t6g s PHE 330 CO 0.02 -0.76 -0.24 0.08 -0.10 0.00 0.00 175.22 174.23 1t6g s VAL 331 N 1.30 1.93 0.14 -0.44 1.01 0.49 -4.72 120.40 120.11 1t6g s VAL 331 Ca 0.01 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.68 1t6g s VAL 331 Cb -0.16 -1.63 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 1t6g s VAL 331 CO -0.07 0.54 1.14 -0.70 0.00 0.00 0.00 175.10 176.01 1t6g s GLU 332 N -0.21 4.53 0.41 2.72 2.12 -1.26 -1.05 118.70 125.96 1t6g s GLU 332 Ca -0.01 1.74 -0.26 0.00 0.36 0.00 0.00 54.97 56.80 1t6g s GLU 332 Cb -0.13 -3.30 -0.09 0.00 0.26 0.00 0.00 34.13 30.87 1t6g s GLU 332 CO 0.03 -0.05 1.41 -1.64 -0.54 0.00 0.00 175.26 174.47 1t6g s MET 333 N 0.10 3.91 0.06 4.30 -1.94 -0.29 -4.83 119.30 120.60 1t6g s MET 333 Ca 0.53 2.40 0.01 0.00 -1.71 0.00 0.00 55.69 56.91 1t6g s MET 333 Cb -0.29 -2.80 -0.04 0.00 2.01 0.00 0.00 34.83 33.71 1t6g s MET 333 CO 0.33 -0.63 0.17 0.15 -0.01 0.00 0.00 175.02 175.03 1t6g s LYS 334 N -2.26 3.28 -1.38 2.03 1.02 -1.26 -4.57 119.74 116.59 1t6g s LYS 334 Ca 0.57 -0.50 0.00 0.00 0.02 0.00 0.00 55.97 56.06 1t6g s LYS 334 Cb -0.43 -2.95 0.00 0.00 -0.52 0.00 0.00 37.83 33.92 1t6g s LYS 334 CO 0.57 0.61 0.00 0.41 -0.92 0.00 0.00 175.35 176.01 1t6g n GLY 335 N 0.43 0.91 2.80 -3.33 0.00 -1.26 -5.00 105.19 99.73 1t6g n GLY 335 Ca -0.07 -0.35 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 1t6g n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t6g s VAL 336 N -2.57 0.45 0.45 1.61 1.01 -1.26 -5.14 120.40 114.95 1t6g s VAL 336 Ca 0.00 0.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.80 1t6g s VAL 336 Cb 0.00 -0.58 -0.07 0.00 0.00 0.00 0.00 36.38 35.73 1t6g s VAL 336 CO 0.00 0.26 1.24 0.00 0.00 0.00 0.00 175.10 176.60 1t6g s ALA 337 N 1.81 3.05 0.09 5.51 0.00 -1.26 -4.60 121.76 126.36 1t6g s ALA 337 Ca 0.03 1.09 -0.36 0.00 0.00 0.00 0.00 51.96 52.72 1t6g s ALA 337 Cb -0.13 -3.44 -0.16 0.00 0.00 0.00 0.00 23.12 19.39 1t6g s ALA 337 CO -0.05 -0.82 1.45 0.00 0.00 0.00 0.00 175.76 176.35 1t6g n ALA 338 N -0.35 -0.12 -1.00 0.00 0.00 -1.26 -2.06 120.51 115.72 1t6g n ALA 338 Ca 0.06 0.48 -0.00 0.00 0.00 0.00 0.00 53.44 53.98 1t6g n ALA 338 Cb 0.46 -2.19 -0.00 0.00 0.00 0.00 0.00 19.45 17.72 1t6g n ALA 338 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t6g n GLY 339 N 2.95 0.47 3.55 0.00 0.00 -1.26 -4.87 105.19 106.03 1t6g n GLY 339 Ca 0.18 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1t6g n GLY 339 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1t6g s ASP 340 N -2.21 6.08 0.00 1.61 -1.08 -0.87 -4.87 116.67 115.32 1t6g s ASP 340 Ca 0.00 -0.42 0.05 0.00 -0.52 0.00 0.00 52.55 51.66 1t6g s ASP 340 Cb 0.00 -2.56 0.24 0.00 -1.46 0.00 0.00 42.92 39.14 1t6g s ASP 340 CO 0.00 -1.88 1.13 0.61 0.52 0.00 0.00 175.17 175.54 1t6g n GLY 341 N 5.50 -0.62 0.17 2.66 0.00 -1.26 -1.80 105.19 109.84 1t6g n GLY 341 Ca 0.07 -0.02 0.04 0.00 0.00 0.00 0.00 46.02 46.11 1t6g n GLY 341 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1t6g h ARG 342 N 0.00 0.00 -6.27 1.61 3.08 -1.99 -3.44 114.38 107.36 1t6g h ARG 342 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 1t6g h ARG 342 Cb 0.08 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1t6g h ARG 342 CO 0.00 0.44 -0.24 0.00 -1.07 0.00 0.00 179.97 179.10 1t6g s ALA 343 N -3.45 3.72 0.60 0.04 0.00 -0.74 -5.08 121.76 116.84 1t6g s ALA 343 Ca 0.01 -0.49 -0.19 0.00 0.00 0.00 0.00 51.96 51.29 1t6g s ALA 343 Cb 0.10 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.97 1t6g s ALA 343 CO 0.71 0.59 1.22 -2.14 0.00 0.00 0.00 175.76 176.14 1t6g s PRO 344 N -2.78 2.93 0.19 0.00 0.02 -1.26 -4.92 135.00 129.18 1t6g s PRO 344 Ca 0.43 1.87 -0.05 0.00 0.02 0.00 0.00 61.00 63.27 1t6g s PRO 344 Cb -0.12 -1.93 0.12 0.00 0.02 0.00 0.00 34.50 32.59 1t6g s PRO 344 CO 0.24 -1.25 1.56 0.00 -0.33 0.00 0.00 177.00 177.22 1t6g h ALA 345 N 0.87 0.76 -3.64 -1.55 0.00 -0.81 -3.39 119.26 111.49 1t6g h ALA 345 Ca -0.51 -0.43 -0.35 0.00 0.00 0.00 0.00 54.91 53.63 1t6g h ALA 345 Cb 1.30 -0.12 -0.32 0.00 0.00 0.00 0.00 17.79 18.65 1t6g h ALA 345 CO 0.55 0.66 -0.75 0.08 0.00 0.00 0.00 179.25 179.78 1t6g s VAL 346 N -4.36 0.33 -0.30 0.00 1.01 -0.94 -1.42 120.40 114.72 1t6g s VAL 346 Ca -0.09 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.83 1t6g s VAL 346 Cb 0.12 -0.35 0.07 0.00 0.00 0.00 0.00 36.38 36.22 1t6g s VAL 346 CO 0.85 0.15 -0.02 -0.63 0.00 0.00 0.00 175.10 175.44 1t6g s ILE 347 N 0.54 2.42 0.32 2.22 1.01 0.22 -1.10 121.20 126.82 1t6g s ILE 347 Ca -0.06 -1.84 -0.28 0.00 0.00 0.00 0.00 60.65 58.47 1t6g s ILE 347 Cb -0.09 -2.54 -0.10 0.00 0.01 0.00 0.00 42.46 39.74 1t6g s ILE 347 CO -0.01 -0.26 1.16 -0.76 0.00 0.00 0.00 174.94 175.08 1t6g s LEU 348 N 1.07 4.45 0.00 2.97 1.43 -0.05 -1.73 118.68 126.82 1t6g s LEU 348 Ca -0.01 2.38 0.00 0.00 -1.03 0.00 0.00 54.13 55.47 1t6g s LEU 348 Cb -0.20 -3.72 0.00 0.00 0.03 0.00 0.00 46.19 42.31 1t6g s LEU 348 CO -0.05 -0.34 0.00 0.61 0.23 0.00 0.00 176.35 176.80 1t6g n GLY 349 N 0.97 4.50 0.16 -3.19 0.00 -1.24 -1.09 105.19 105.29 1t6g n GLY 349 Ca 0.00 -2.15 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 1t6g n GLY 349 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1t6g h GLY 350 N 0.00 0.51 1.97 -0.02 0.00 -1.14 -2.34 103.07 102.04 1t6g h GLY 350 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1t6g h GLY 350 CO 0.00 0.26 0.00 0.00 0.00 0.00 0.00 176.54 176.80 1t6g n ALA 351 N -2.27 1.85 0.43 3.60 0.00 -0.75 -1.33 120.51 122.05 1t6g n ALA 351 Ca -0.02 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.47 1t6g n ALA 351 Cb 0.13 -1.30 0.01 0.00 0.00 0.00 0.00 19.45 18.30 1t6g n ALA 351 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1t6g n GLN 352 N -1.48 0.38 0.04 0.00 3.00 -0.91 -3.99 117.38 114.42 1t6g n GLN 352 Ca 0.05 0.01 0.11 0.00 -0.01 0.00 0.00 57.00 57.16 1t6g n GLN 352 Cb 0.21 -1.64 -0.04 0.00 0.00 0.00 0.00 30.24 28.78 1t6g n GLN 352 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1t6g n MET 353 N -2.13 0.45 -1.74 -1.09 2.81 -0.55 -4.90 117.12 109.97 1t6g n MET 353 Ca 0.01 -0.02 -0.41 0.00 -1.81 0.00 0.00 57.70 55.47 1t6g n MET 353 Cb 0.47 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.35 1t6g n MET 353 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1t6g n GLU 354 N -2.21 2.36 -2.17 0.03 1.02 -0.44 -2.28 120.64 116.95 1t6g n GLU 354 Ca -0.00 0.83 -0.20 0.00 -0.02 0.00 0.00 57.16 57.77 1t6g n GLU 354 Cb 0.50 -2.51 -0.03 0.00 -0.02 0.00 0.00 31.44 29.37 1t6g n GLU 354 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1t6g n ASP 355 N 0.47 -5.58 -4.50 1.62 8.00 -0.53 -4.97 116.55 111.05 1t6g n ASP 355 Ca 0.03 0.15 -0.33 0.00 0.71 0.00 0.00 54.79 55.35 1t6g n ASP 355 Cb 0.38 -4.73 -0.12 0.00 -0.02 0.00 0.00 41.12 36.62 1t6g n ASP 355 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1t6g s PHE 356 N -2.91 2.73 -0.27 1.24 0.40 -0.97 -1.19 117.98 117.01 1t6g s PHE 356 Ca 0.00 -0.13 -0.22 0.00 -0.60 0.00 0.00 56.93 55.98 1t6g s PHE 356 Cb 0.00 -1.61 -0.01 0.00 0.51 0.00 0.00 43.02 41.91 1t6g s PHE 356 CO 0.00 0.24 0.70 0.08 0.70 0.00 0.00 175.22 176.94 1t6g s VAL 357 N -0.80 4.91 -0.18 -0.44 1.01 0.04 -4.21 120.40 120.72 1t6g s VAL 357 Ca 0.13 1.18 -0.01 0.00 0.00 0.00 0.00 61.98 63.27 1t6g s VAL 357 Cb -0.11 -4.02 -0.00 0.00 0.00 0.00 0.00 36.38 32.25 1t6g s VAL 357 CO 0.02 -0.08 -0.12 -0.76 0.00 0.00 0.00 175.10 174.17 1t6g s LEU 358 N 2.68 2.61 -0.52 3.92 1.43 -0.01 -1.30 118.68 127.50 1t6g s LEU 358 Ca 0.29 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 52.87 1t6g s LEU 358 Cb -0.15 -1.62 0.13 0.00 0.03 0.00 0.00 46.19 44.58 1t6g s LEU 358 CO 0.10 0.05 0.38 -0.62 0.23 0.00 0.00 176.35 176.48 1t6g s ASP 359 N 1.05 5.66 -0.85 2.29 2.15 -0.09 -1.14 116.67 125.74 1t6g s ASP 359 Ca -0.00 -2.15 -0.21 0.00 0.43 0.00 0.00 52.55 50.61 1t6g s ASP 359 Cb -0.15 -1.98 0.09 0.00 -0.30 0.00 0.00 42.92 40.58 1t6g s ASP 359 CO -0.03 -0.61 1.15 -0.36 -0.17 0.00 0.00 175.17 175.15 1t6g s PHE 360 N 1.00 2.80 -0.51 -5.34 0.40 0.51 -1.06 117.98 115.77 1t6g s PHE 360 Ca 0.09 -0.92 -0.14 0.00 -0.60 0.00 0.00 56.93 55.36 1t6g s PHE 360 Cb -0.23 -4.40 0.12 0.00 0.51 0.00 0.00 43.02 39.02 1t6g s PHE 360 CO -0.02 -1.67 0.45 0.34 0.70 0.00 0.00 175.22 175.01 1t6g s ASP 361 N 3.92 6.06 0.00 1.36 -1.08 -0.52 -1.34 116.67 125.08 1t6g s ASP 361 Ca 0.32 -1.75 0.28 0.00 -0.52 0.00 0.00 52.55 50.89 1t6g s ASP 361 Cb -0.08 -2.16 1.16 0.00 -1.46 0.00 0.00 42.92 40.38 1t6g s ASP 361 CO -0.02 -0.79 1.81 0.23 0.52 0.00 0.00 175.17 176.92 1t6g n MET 362 N 5.16 1.16 -0.08 4.34 2.81 -0.79 -0.76 117.12 128.96 1t6g n MET 362 Ca -0.12 -0.55 -0.15 0.00 -1.81 0.00 0.00 57.70 55.07 1t6g n MET 362 Cb 0.41 -1.49 -0.09 0.00 -0.71 0.00 0.00 33.22 31.34 1t6g n MET 362 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1t6g h GLU 363 N 1.35 0.00 -0.00 0.03 5.08 -1.90 -3.35 114.58 115.78 1t6g h GLU 363 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1t6g h GLU 363 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1t6g h GLU 363 CO 0.00 0.74 -0.01 1.63 -1.00 0.00 0.00 179.01 180.37 1t6g n LYS 364 N -4.55 0.51 -3.69 2.33 5.02 -1.25 -4.95 118.16 111.59 1t6g n LYS 364 Ca -0.19 -0.02 -0.25 0.00 -2.02 0.00 0.00 58.31 55.84 1t6g n LYS 364 Cb 0.49 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.03 1t6g n LYS 364 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1t6g n LYS 365 N -1.22 -3.19 -3.80 1.97 5.02 0.06 -4.93 118.16 112.07 1t6g n LYS 365 Ca 0.15 0.56 -0.11 0.00 -2.02 0.00 0.00 58.31 56.89 1t6g n LYS 365 Cb 0.23 -4.80 -0.08 0.00 -0.02 0.00 0.00 35.03 30.36 1t6g n LYS 365 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1t6g s ARG 366 N -5.90 0.71 -0.19 1.97 1.70 -0.59 -1.03 118.95 115.62 1t6g s ARG 366 Ca 0.20 -0.48 -0.02 0.00 -0.47 0.00 0.00 55.73 54.96 1t6g s ARG 366 Cb -0.06 0.31 -0.00 0.00 -0.57 0.00 0.00 34.95 34.62 1t6g s ARG 366 CO 0.83 -0.21 -0.10 -1.17 -1.08 0.00 0.00 175.30 173.57 1t6g s LEU 367 N -1.87 2.69 -0.01 -1.89 2.96 0.49 -1.44 118.68 119.61 1t6g s LEU 367 Ca -0.07 -0.43 -0.16 0.00 -0.22 0.00 0.00 54.13 53.24 1t6g s LEU 367 Cb -0.02 -1.65 -0.06 0.00 0.50 0.00 0.00 46.19 44.96 1t6g s LEU 367 CO -0.02 0.03 0.46 -0.83 -1.32 0.00 0.00 176.35 174.67 1t6g s GLY 368 N 1.14 2.50 -0.28 7.98 0.00 -0.22 -1.41 107.32 117.03 1t6g s GLY 368 Ca 0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 44.72 44.53 1t6g s GLY 368 CO -0.03 0.35 0.12 -0.11 0.00 0.00 0.00 173.10 173.44 1t6g s PHE 369 N -0.71 0.43 -0.37 1.90 -0.71 -0.55 -0.91 117.98 117.06 1t6g s PHE 369 Ca 0.25 -0.92 -0.06 0.00 -1.04 0.00 0.00 56.93 55.16 1t6g s PHE 369 Cb -0.17 -0.96 0.06 0.00 -1.21 0.00 0.00 43.02 40.75 1t6g s PHE 369 CO 0.14 -0.81 0.16 -1.12 -1.34 0.00 0.00 175.22 172.24 1t6g s SER 370 N 2.06 5.37 0.02 1.98 0.01 -0.42 -4.24 113.70 118.48 1t6g s SER 370 Ca 0.09 -1.40 -0.30 0.00 1.31 0.00 0.00 55.95 55.64 1t6g s SER 370 Cb -0.16 -1.89 -0.06 0.00 0.21 0.00 0.00 66.02 64.12 1t6g s SER 370 CO -0.34 -0.42 1.47 -0.60 0.41 0.00 0.00 173.24 173.75 1t6g s ARG 371 N 1.36 4.26 0.50 12.44 3.52 -1.26 -0.78 118.95 138.98 1t6g s ARG 371 Ca 0.01 2.06 -0.22 0.00 -0.13 0.00 0.00 55.73 57.45 1t6g s ARG 371 Cb -0.21 -3.58 -0.06 0.00 -1.56 0.00 0.00 34.95 29.54 1t6g s ARG 371 CO 0.01 -0.62 1.23 -0.51 -0.81 0.00 0.00 175.30 174.60 1t6g s LEU 372 N 2.46 3.92 0.90 -0.88 1.43 -0.33 -4.96 118.68 121.22 1t6g s LEU 372 Ca 0.66 2.45 -0.12 0.00 -1.03 0.00 0.00 54.13 56.10 1t6g s LEU 372 Cb -0.34 -4.29 0.13 0.00 0.03 0.00 0.00 46.19 41.72 1t6g s LEU 372 CO 0.28 -1.18 1.09 -2.16 0.23 0.00 0.00 176.35 174.61 1t6g s PRO 373 N -2.83 1.26 0.46 1.29 0.04 -1.26 -4.92 135.00 129.04 1t6g s PRO 373 Ca 0.67 0.77 0.18 0.00 0.04 0.00 0.00 61.00 62.67 1t6g s PRO 373 Cb -0.32 -1.81 1.11 0.00 0.04 0.00 0.00 34.50 33.52 1t6g s PRO 373 CO 0.38 -2.23 2.01 1.12 0.04 0.00 0.00 177.00 178.32 1t6g h HIS 374 N -1.54 0.00 -0.00 0.56 2.07 -1.95 -2.47 115.15 111.82 1t6g h HIS 374 Ca -0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.02 1t6g h HIS 374 Cb 1.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.27 1t6g h HIS 374 CO 0.42 0.18 -0.04 1.97 -3.07 0.00 0.00 177.93 177.38 1t6g n PHE 375 N -4.13 0.00 -3.63 6.12 1.16 -1.26 -4.83 117.46 110.89 1t6g n PHE 375 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.56 1t6g n PHE 375 Cb 0.25 -0.16 0.00 0.00 -1.61 0.00 0.00 39.48 37.96 1t6g n PHE 375 CO 0.00 0.00 0.00 -2.37 -1.87 0.00 0.00 176.76 172.52 1t6g n THR 376 N -1.00 0.00 0.00 1.97 5.66 -0.93 -5.17 114.28 114.81 1t6g n THR 376 Ca 0.17 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.17 1t6g n THR 376 Cb 0.23 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 1t6g n THR 376 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1t6g n GLY 377 N 2.45 0.15 0.28 1.09 0.00 -1.26 -4.84 105.19 103.05 1t6g n GLY 377 Ca 0.00 -0.96 -0.06 0.00 0.00 0.00 0.00 46.02 45.00 1t6g n GLY 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t6g n GLY 379 N -0.44 1.64 2.54 0.00 0.00 -1.26 -1.42 105.19 106.25 1t6g n GLY 379 Ca 0.01 0.80 0.00 0.00 0.00 0.00 0.00 46.02 46.83 1t6g n GLY 379 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6g n GLY 380 N 4.35 0.34 0.00 -0.02 0.00 -0.07 -4.85 105.19 104.93 1t6g n GLY 380 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.34 1t6g n GLY 380 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22