#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hs0 s LEU 2 N 0.00 2.36 -0.11 0.00 2.96 -1.12 -4.94 118.68 117.82 3hs0 s LEU 2 Ca 0.00 -1.18 0.00 0.00 -0.22 0.00 0.00 54.13 52.73 3hs0 s LEU 2 Cb 0.00 -1.06 -0.02 0.00 0.50 0.00 0.00 46.19 45.61 3hs0 s LEU 2 CO 0.00 -0.27 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.34 3hs0 s TYR 3 N 1.48 2.84 -0.05 5.38 2.02 -1.26 -0.45 117.35 127.31 3hs0 s TYR 3 Ca -0.03 -0.43 0.04 0.00 -0.37 0.00 0.00 57.07 56.27 3hs0 s TYR 3 Cb -0.18 -1.81 0.00 0.00 -0.40 0.00 0.00 41.96 39.57 3hs0 s TYR 3 CO -0.08 -0.06 -0.16 0.95 -1.57 0.00 0.00 175.55 174.64 3hs0 s THR 4 N 0.04 1.35 -0.27 -0.71 -4.23 -0.57 -1.28 115.64 109.97 3hs0 s THR 4 Ca -0.04 -0.65 -0.03 0.00 -1.18 0.00 0.00 61.69 59.79 3hs0 s THR 4 Cb -0.14 -1.18 0.02 0.00 1.34 0.00 0.00 72.50 72.53 3hs0 s THR 4 CO 0.04 0.40 -0.01 -0.22 -0.54 0.00 0.00 174.62 174.28 3hs0 s LEU 5 N 0.24 3.43 -0.13 4.79 2.96 0.55 -1.01 118.68 129.52 3hs0 s LEU 5 Ca -0.08 -0.82 -0.01 0.00 -0.22 0.00 0.00 54.13 53.00 3hs0 s LEU 5 Cb -0.13 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 3hs0 s LEU 5 CO 0.03 -0.15 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.17 3hs0 s ILE 6 N 1.38 3.27 0.10 6.68 1.01 0.66 -1.88 121.20 132.42 3hs0 s ILE 6 Ca 0.01 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 3hs0 s ILE 6 Cb -0.17 -2.39 -0.02 0.00 0.01 0.00 0.00 42.46 39.90 3hs0 s ILE 6 CO -0.02 0.52 0.12 0.42 0.00 0.00 0.00 174.94 175.98 3hs0 s THR 7 N 0.30 0.15 0.45 2.92 -4.23 -0.28 -0.71 115.64 114.23 3hs0 s THR 7 Ca -0.08 -1.50 -0.25 0.00 -1.18 0.00 0.00 61.69 58.68 3hs0 s THR 7 Cb -0.15 -1.57 -0.08 0.00 1.34 0.00 0.00 72.50 72.03 3hs0 s THR 7 CO 0.05 -0.67 1.39 -2.84 -0.54 0.00 0.00 174.62 172.01 3hs0 s PRO 8 N -3.92 3.71 0.36 3.99 0.02 -1.26 0.12 135.00 138.01 3hs0 s PRO 8 Ca 0.10 2.33 0.27 0.00 0.02 0.00 0.00 61.00 63.72 3hs0 s PRO 8 Cb 0.06 -2.64 1.13 0.00 0.02 0.00 0.00 34.50 33.07 3hs0 s PRO 8 CO -0.07 -0.76 1.81 0.00 -0.33 0.00 0.00 177.00 177.64 3hs0 h ALA 9 N 2.34 1.00 -3.40 -1.55 0.00 -1.26 -3.40 119.26 112.98 3hs0 h ALA 9 Ca -0.51 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.00 3hs0 h ALA 9 Cb 1.26 0.00 -0.35 0.00 0.00 0.00 0.00 17.79 18.70 3hs0 h ALA 9 CO 0.61 0.00 -0.77 0.08 0.00 0.00 0.00 179.25 179.18 3hs0 s VAL 10 N -3.45 0.42 -0.06 0.00 1.01 -1.26 -3.70 120.40 113.36 3hs0 s VAL 10 Ca 0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 3hs0 s VAL 10 Cb 0.09 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 3hs0 s VAL 10 CO 0.43 0.22 0.12 -0.76 0.00 0.00 0.00 175.10 175.11 3hs0 s LEU 11 N 1.28 4.14 0.04 3.92 1.43 0.03 -4.98 118.68 124.54 3hs0 s LEU 11 Ca -0.06 0.31 0.02 0.00 -1.03 0.00 0.00 54.13 53.37 3hs0 s LEU 11 Cb -0.13 -2.22 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 3hs0 s LEU 11 CO -0.02 0.34 0.05 -0.13 0.23 0.00 0.00 176.35 176.81 3hs0 s ARG 12 N -1.41 2.86 0.34 1.70 0.52 -1.26 -0.70 118.95 121.00 3hs0 s ARG 12 Ca 0.20 -0.63 -0.16 0.00 -0.52 0.00 0.00 55.73 54.62 3hs0 s ARG 12 Cb -0.12 -2.72 -0.09 0.00 0.52 0.00 0.00 34.95 32.54 3hs0 s ARG 12 CO 0.10 0.60 0.77 0.95 0.02 0.00 0.00 175.30 177.74 3hs0 s THR 13 N -1.24 4.64 -1.55 0.02 -4.23 -1.05 -4.21 115.64 108.02 3hs0 s THR 13 Ca 0.24 1.02 -0.04 0.00 -1.18 0.00 0.00 61.69 61.73 3hs0 s THR 13 Cb -0.12 -3.61 0.01 0.00 1.34 0.00 0.00 72.50 70.12 3hs0 s THR 13 CO 0.16 -0.22 0.49 0.47 -0.54 0.00 0.00 174.62 174.98 3hs0 n ASP 14 N -0.44 -5.75 -3.74 3.99 8.00 -0.46 -4.19 116.55 113.96 3hs0 n ASP 14 Ca 0.04 -0.24 -0.14 0.00 0.71 0.00 0.00 54.79 55.16 3hs0 n ASP 14 Cb 0.53 -4.68 -0.09 0.00 -0.02 0.00 0.00 41.12 36.86 3hs0 n ASP 14 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3hs0 s THR 15 N -3.11 0.04 0.13 -3.53 -1.32 -1.26 -4.99 115.64 101.60 3hs0 s THR 15 Ca 0.26 -0.36 -0.30 0.00 -1.21 0.00 0.00 61.69 60.08 3hs0 s THR 15 Cb -0.12 -0.63 -0.07 0.00 -1.51 0.00 0.00 72.50 70.17 3hs0 s THR 15 CO 0.32 -0.20 1.24 -1.61 -2.21 0.00 0.00 174.62 172.17 3hs0 s GLU 16 N -1.06 4.43 -0.24 7.08 2.02 -1.26 -4.49 118.70 125.17 3hs0 s GLU 16 Ca -0.11 1.89 -0.03 0.00 0.02 0.00 0.00 54.97 56.74 3hs0 s GLU 16 Cb -0.04 -3.28 0.08 0.00 0.10 0.00 0.00 34.13 30.99 3hs0 s GLU 16 CO 0.04 -0.23 0.08 -1.21 0.02 0.00 0.00 175.26 173.97 3hs0 s GLU 17 N 0.48 0.43 0.35 1.61 0.41 -0.28 -4.95 118.70 116.75 3hs0 s GLU 17 Ca 0.57 -0.53 -0.27 0.00 -0.41 0.00 0.00 54.97 54.33 3hs0 s GLU 17 Cb -0.33 -1.77 -0.09 0.00 -1.78 0.00 0.00 34.13 30.16 3hs0 s GLU 17 CO 0.33 -0.82 1.17 -0.65 -0.49 0.00 0.00 175.26 174.80 3hs0 s GLN 18 N 1.93 4.30 0.50 1.61 -0.21 -1.26 -0.80 119.66 125.72 3hs0 s GLN 18 Ca 0.05 1.89 0.03 0.00 0.02 0.00 0.00 55.36 57.35 3hs0 s GLN 18 Cb -0.17 -2.91 -0.01 0.00 1.00 0.00 0.00 33.01 30.92 3hs0 s GLN 18 CO -0.20 -0.12 0.09 0.96 -2.12 0.00 0.00 175.29 173.90 3hs0 s ILE 19 N -1.29 1.42 -0.08 1.08 -4.36 -0.88 -4.55 121.20 112.54 3hs0 s ILE 19 Ca 0.52 -1.88 -0.00 0.00 -0.26 0.00 0.00 60.65 59.02 3hs0 s ILE 19 Cb -0.33 -2.30 0.02 0.00 1.25 0.00 0.00 42.46 41.10 3hs0 s ILE 19 CO 0.42 0.00 -0.05 -0.22 0.24 0.00 0.00 174.94 175.33 3hs0 s LEU 20 N -3.94 1.01 -0.10 0.37 2.96 0.12 -3.71 118.68 115.39 3hs0 s LEU 20 Ca 0.16 -0.19 0.04 0.00 -0.22 0.00 0.00 54.13 53.92 3hs0 s LEU 20 Cb 0.02 -0.63 -0.00 0.00 0.50 0.00 0.00 46.19 46.08 3hs0 s LEU 20 CO 0.09 -0.13 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.07 3hs0 s VAL 21 N 1.61 2.06 0.07 1.68 1.01 -0.65 -0.25 120.40 125.93 3hs0 s VAL 21 Ca 0.01 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 61.02 3hs0 s VAL 21 Cb -0.13 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 3hs0 s VAL 21 CO -0.05 0.56 -0.13 -1.61 0.00 0.00 0.00 175.10 173.87 3hs0 s GLU 22 N 0.29 0.79 -0.13 2.72 2.02 -0.18 -1.80 118.70 122.41 3hs0 s GLU 22 Ca -0.18 -0.95 0.01 0.00 0.02 0.00 0.00 54.97 53.88 3hs0 s GLU 22 Cb -0.18 -0.74 0.02 0.00 0.10 0.00 0.00 34.13 33.33 3hs0 s GLU 22 CO 0.08 0.16 -0.15 0.00 0.02 0.00 0.00 175.26 175.37 3hs0 s ALA 23 N -1.37 1.82 -0.14 5.21 0.00 -0.72 -1.52 121.76 125.05 3hs0 s ALA 23 Ca -0.02 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 51.07 3hs0 s ALA 23 Cb -0.10 -0.94 -0.02 0.00 0.00 0.00 0.00 23.12 22.06 3hs0 s ALA 23 CO 0.02 -0.20 -0.09 -1.01 0.00 0.00 0.00 175.76 174.48 3hs0 s HIS 24 N 1.18 2.91 -0.17 0.00 0.09 0.41 -4.45 115.29 115.26 3hs0 s HIS 24 Ca -0.02 -0.48 0.00 0.00 -0.00 0.00 0.00 55.06 54.57 3hs0 s HIS 24 Cb -0.14 -1.90 0.00 0.00 -0.00 0.00 0.00 32.58 30.54 3hs0 s HIS 24 CO -0.05 -0.12 0.00 0.41 -0.00 0.00 0.00 174.74 174.97 3hs0 n GLY 25 N 3.52 0.52 2.94 -2.22 0.00 -1.26 -2.50 105.19 106.18 3hs0 n GLY 25 Ca -0.18 -0.84 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 3hs0 n GLY 25 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hs0 s ASP 26 N -2.83 0.68 -0.01 1.61 -1.08 -1.26 -4.04 116.67 109.75 3hs0 s ASP 26 Ca 0.00 -0.10 0.01 0.00 -0.52 0.00 0.00 52.55 51.94 3hs0 s ASP 26 Cb 0.00 -0.16 0.01 0.00 -1.46 0.00 0.00 42.92 41.32 3hs0 s ASP 26 CO 0.00 0.03 0.73 -1.54 0.52 0.00 0.00 175.17 174.91 3hs0 n SER 27 N 3.26 0.76 -4.65 -0.34 3.41 -1.26 -4.91 113.62 109.89 3hs0 n SER 27 Ca -0.17 -1.49 -0.43 0.00 -0.26 0.00 0.00 58.87 56.52 3hs0 n SER 27 Cb 0.56 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.46 3hs0 n SER 27 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3hs0 s THR 28 N -0.45 4.61 0.11 6.66 2.01 -1.26 -4.54 115.64 122.78 3hs0 s THR 28 Ca 0.01 1.91 -0.32 0.00 0.31 0.00 0.00 61.69 63.60 3hs0 s THR 28 Cb 0.01 -4.34 -0.12 0.00 0.01 0.00 0.00 72.50 68.06 3hs0 s THR 28 CO 0.00 -0.29 1.76 -2.65 -0.69 0.00 0.00 174.62 172.76 3hs0 n PRO 29 N 6.53 2.53 -4.56 4.92 -0.02 -1.26 -4.90 135.00 138.24 3hs0 n PRO 29 Ca 0.12 0.92 -0.26 0.00 -2.02 0.00 0.00 63.50 62.26 3hs0 n PRO 29 Cb 0.46 -2.77 -0.10 0.00 -0.02 0.00 0.00 33.50 31.08 3hs0 n PRO 29 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3hs0 s LYS 30 N 2.28 1.88 -0.10 -0.52 1.02 0.52 -5.00 119.74 119.82 3hs0 s LYS 30 Ca 0.82 -2.11 -0.00 0.00 0.02 0.00 0.00 55.97 54.70 3hs0 s LYS 30 Cb -0.57 -1.09 0.02 0.00 -0.52 0.00 0.00 37.83 35.67 3hs0 s LYS 30 CO 0.39 -0.26 -0.06 -0.65 -0.92 0.00 0.00 175.35 173.85 3hs0 s GLN 31 N -3.81 1.29 -0.09 1.68 -0.21 -1.26 -1.60 119.66 115.66 3hs0 s GLN 31 Ca 0.27 -0.17 -0.02 0.00 0.02 0.00 0.00 55.36 55.46 3hs0 s GLN 31 Cb 0.06 -1.40 -0.03 0.00 1.00 0.00 0.00 33.01 32.64 3hs0 s GLN 31 CO 0.13 -0.25 0.02 -0.51 -2.12 0.00 0.00 175.29 172.56 3hs0 s LEU 32 N 1.68 3.69 -0.19 2.90 1.43 0.74 -4.61 118.68 124.31 3hs0 s LEU 32 Ca 0.03 0.18 -0.08 0.00 -1.03 0.00 0.00 54.13 53.24 3hs0 s LEU 32 Cb -0.13 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 3hs0 s LEU 32 CO -0.06 0.38 0.07 -1.81 0.23 0.00 0.00 176.35 175.16 3hs0 s ASP 33 N -0.93 5.63 -0.20 2.29 1.01 -0.60 -1.11 116.67 122.76 3hs0 s ASP 33 Ca 0.14 0.06 0.01 0.00 0.71 0.00 0.00 52.55 53.46 3hs0 s ASP 33 Cb -0.11 -1.97 0.04 0.00 1.01 0.00 0.00 42.92 41.88 3hs0 s ASP 33 CO 0.03 0.14 -0.11 -0.63 0.21 0.00 0.00 175.17 174.81 3hs0 s ILE 34 N 0.55 1.69 0.25 0.77 1.01 -0.92 -1.89 121.20 122.67 3hs0 s ILE 34 Ca 0.04 -1.03 0.11 0.00 0.00 0.00 0.00 60.65 59.77 3hs0 s ILE 34 Cb -0.13 -1.75 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 3hs0 s ILE 34 CO 0.01 0.19 -0.12 -0.36 0.00 0.00 0.00 174.94 174.66 3hs0 s PHE 35 N 1.38 2.48 -0.09 3.97 0.08 -0.91 -1.87 117.98 123.02 3hs0 s PHE 35 Ca -0.01 -0.28 -0.00 0.00 0.12 0.00 0.00 56.93 56.75 3hs0 s PHE 35 Cb -0.16 -1.11 0.02 0.00 -0.57 0.00 0.00 43.02 41.20 3hs0 s PHE 35 CO -0.08 0.64 -0.05 0.08 -0.10 0.00 0.00 175.22 175.70 3hs0 s VAL 36 N -2.26 0.80 0.28 -0.44 1.01 -0.21 -1.80 120.40 117.77 3hs0 s VAL 36 Ca 0.29 -0.16 0.09 0.00 0.00 0.00 0.00 61.98 62.20 3hs0 s VAL 36 Cb -0.06 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 3hs0 s VAL 36 CO 0.16 0.32 0.01 -1.00 0.00 0.00 0.00 175.10 174.60 3hs0 s HIS 37 N 1.66 2.68 0.77 5.22 3.76 -0.41 -0.17 115.29 128.80 3hs0 s HIS 37 Ca 0.03 -0.26 -0.11 0.00 -0.15 0.00 0.00 55.06 54.56 3hs0 s HIS 37 Cb -0.13 -1.27 0.05 0.00 1.11 0.00 0.00 32.58 32.34 3hs0 s HIS 37 CO -0.06 0.57 1.08 0.16 -0.85 0.00 0.00 174.74 175.65 3hs0 s ASP 38 N -3.70 4.64 -0.01 1.40 -4.77 -1.25 -0.82 116.67 112.17 3hs0 s ASP 38 Ca 0.32 1.59 0.07 0.00 -3.30 0.00 0.00 52.55 51.23 3hs0 s ASP 38 Cb -0.05 -2.35 -0.02 0.00 -1.09 0.00 0.00 42.92 39.41 3hs0 s ASP 38 CO 0.20 -1.91 -0.22 0.12 0.70 0.00 0.00 175.17 174.05 3hs0 s PHE 39 N -3.01 2.00 -2.38 2.11 5.36 -1.18 -2.26 117.98 118.62 3hs0 s PHE 39 Ca 0.60 -0.38 0.24 0.00 -0.96 0.00 0.00 56.93 56.44 3hs0 s PHE 39 Cb -0.16 -1.27 0.31 0.00 -0.34 0.00 0.00 43.02 41.56 3hs0 s PHE 39 CO 0.55 -0.02 1.30 -2.30 -1.46 0.00 0.00 175.22 173.30 3hs0 n PRO 40 N 2.44 1.59 -0.05 10.12 -0.02 -1.26 -4.65 135.00 143.16 3hs0 n PRO 40 Ca -0.16 -1.23 0.02 0.00 -2.02 0.00 0.00 63.50 60.11 3hs0 n PRO 40 Cb 0.52 -1.47 0.33 0.00 -0.02 0.00 0.00 33.50 32.86 3hs0 n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hs0 h ARG 41 N 3.01 0.65 -1.36 -0.52 3.08 -1.99 -3.46 114.38 113.78 3hs0 h ARG 41 Ca 0.00 -0.07 -0.38 0.00 0.07 0.00 0.00 59.98 59.60 3hs0 h ARG 41 Cb 0.77 -0.13 -0.13 0.00 0.08 0.00 0.00 29.97 30.56 3hs0 h ARG 41 CO 0.00 0.50 -0.36 1.63 -1.07 0.00 0.00 179.97 180.67 3hs0 n LYS 42 N -4.39 -1.46 -0.27 0.04 5.02 -0.96 -4.85 118.16 111.29 3hs0 n LYS 42 Ca 0.04 1.08 -0.06 0.00 -2.02 0.00 0.00 58.31 57.35 3hs0 n LYS 42 Cb 0.12 -5.46 0.06 0.00 -0.02 0.00 0.00 35.03 29.73 3hs0 n LYS 42 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 3hs0 h GLN 43 N 0.00 1.04 -5.82 1.97 4.20 -1.89 -3.45 115.11 111.16 3hs0 h GLN 43 Ca -0.39 -0.14 -0.53 0.00 0.06 0.00 0.00 58.65 57.66 3hs0 h GLN 43 Cb 1.23 -0.20 -0.14 0.00 0.30 0.00 0.00 27.48 28.67 3hs0 h GLN 43 CO 0.55 0.79 -0.73 -1.59 -0.67 0.00 0.00 178.83 177.19 3hs0 s LYS 44 N -5.78 1.52 -0.23 1.46 -2.85 -1.26 -5.09 119.74 107.51 3hs0 s LYS 44 Ca -0.13 -1.70 -0.09 0.00 -1.00 0.00 0.00 55.97 53.05 3hs0 s LYS 44 Cb 0.15 -1.40 -0.04 0.00 -2.06 0.00 0.00 37.83 34.47 3hs0 s LYS 44 CO 0.80 0.22 0.11 0.99 0.10 0.00 0.00 175.35 177.57 3hs0 s THR 45 N -2.78 4.93 -0.11 3.79 2.01 -1.26 -3.75 115.64 118.47 3hs0 s THR 45 Ca 0.27 0.03 0.06 0.00 0.31 0.00 0.00 61.69 62.36 3hs0 s THR 45 Cb -0.02 -3.28 -0.24 0.00 0.01 0.00 0.00 72.50 68.97 3hs0 s THR 45 CO 0.11 0.37 0.39 0.18 -0.69 0.00 0.00 174.62 174.98 3hs0 n LEU 46 N 4.25 1.50 -3.72 4.42 4.32 0.76 -4.96 117.00 123.57 3hs0 n LEU 46 Ca -0.16 0.23 -0.14 0.00 -0.02 0.00 0.00 56.01 55.92 3hs0 n LEU 46 Cb 0.52 -0.29 -0.08 0.00 -1.62 0.00 0.00 43.42 41.95 3hs0 n LEU 46 CO 0.34 0.61 0.09 0.12 -1.22 0.00 0.00 177.39 177.33 3hs0 s PHE 47 N -2.56 -0.27 -0.25 -1.77 5.36 -1.16 -4.71 117.98 112.62 3hs0 s PHE 47 Ca -0.14 0.43 -0.25 0.00 -0.96 0.00 0.00 56.93 56.00 3hs0 s PHE 47 Cb 0.07 0.15 0.07 0.00 -0.34 0.00 0.00 43.02 42.98 3hs0 s PHE 47 CO 0.79 -0.43 0.73 -1.14 -1.46 0.00 0.00 175.22 173.71 3hs0 s GLN 48 N -1.28 0.85 0.32 10.12 0.74 -1.25 -1.05 119.66 128.11 3hs0 s GLN 48 Ca -0.13 0.93 -0.07 0.00 0.05 0.00 0.00 55.36 56.14 3hs0 s GLN 48 Cb -0.04 0.41 0.03 0.00 1.10 0.00 0.00 33.01 34.51 3hs0 s GLN 48 CO 0.05 -0.12 0.55 -2.37 -0.55 0.00 0.00 175.29 172.86 3hs0 n THR 49 N 2.54 0.00 -3.74 -0.34 5.66 -0.78 -5.01 114.28 112.62 3hs0 n THR 49 Ca -0.14 -1.18 -0.14 0.00 -3.05 0.00 0.00 64.05 59.54 3hs0 n THR 49 Cb 0.55 0.90 -0.14 0.00 -1.55 0.00 0.00 70.33 70.09 3hs0 n THR 49 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3hs0 s ARG 50 N -2.37 0.10 0.03 1.09 3.52 -1.26 -2.17 118.95 117.90 3hs0 s ARG 50 Ca 0.19 0.42 0.06 0.00 -0.13 0.00 0.00 55.73 56.27 3hs0 s ARG 50 Cb -0.03 -0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.16 3hs0 s ARG 50 CO 0.14 -0.18 -0.18 0.14 -0.81 0.00 0.00 175.30 174.41 3hs0 s VAL 51 N 1.32 1.40 -0.25 7.11 -7.23 -0.27 -4.96 120.40 117.52 3hs0 s VAL 51 Ca -0.08 -1.05 -0.16 0.00 -1.81 0.00 0.00 61.98 58.88 3hs0 s VAL 51 Cb -0.11 -1.23 -0.04 0.00 0.56 0.00 0.00 36.38 35.56 3hs0 s VAL 51 CO -0.06 0.15 0.40 -1.81 -0.31 0.00 0.00 175.10 173.47 3hs0 s ASP 52 N -1.05 6.32 -0.30 4.85 1.01 -1.26 -0.18 116.67 126.06 3hs0 s ASP 52 Ca 0.05 0.37 -0.07 0.00 0.71 0.00 0.00 52.55 53.61 3hs0 s ASP 52 Cb -0.08 -2.23 0.00 0.00 1.01 0.00 0.00 42.92 41.63 3hs0 s ASP 52 CO 0.01 -0.18 0.10 -0.32 0.21 0.00 0.00 175.17 174.99 3hs0 s MET 53 N 1.96 3.18 0.21 8.23 -2.45 -0.62 -4.96 119.30 124.85 3hs0 s MET 53 Ca 0.17 -0.81 0.02 0.00 -1.25 0.00 0.00 55.69 53.82 3hs0 s MET 53 Cb -0.16 -3.41 -0.05 0.00 1.25 0.00 0.00 34.83 32.46 3hs0 s MET 53 CO 0.09 -0.42 0.02 0.54 1.05 0.00 0.00 175.02 176.30 3hs0 s ASN 54 N 1.53 1.44 0.57 1.11 2.20 -1.26 -0.35 114.94 120.17 3hs0 s ASN 54 Ca 0.03 -1.23 0.33 0.00 -0.94 0.00 0.00 52.86 51.04 3hs0 s ASN 54 Cb -0.17 0.09 1.69 0.00 -2.00 0.00 0.00 41.25 40.86 3hs0 s ASN 54 CO 0.03 -0.58 2.14 -0.65 -2.94 0.00 0.00 177.10 175.10 3hs0 h PRO 55 N 2.55 0.00 0.00 3.55 0.11 -1.92 -0.87 132.00 135.41 3hs0 h PRO 55 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3hs0 h PRO 55 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3hs0 h PRO 55 CO 0.63 0.06 0.00 0.00 -0.21 0.00 0.00 178.00 178.48 3hs0 h ALA 56 N 1.94 1.00 -0.16 -0.75 0.00 -1.96 -2.11 119.26 117.22 3hs0 h ALA 56 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hs0 h ALA 56 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3hs0 h ALA 56 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3hs0 n GLY 57 N -0.45 1.06 0.76 0.00 0.00 -0.43 -4.96 105.19 101.17 3hs0 n GLY 57 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 3hs0 n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hs0 n GLY 58 N 0.52 0.76 3.03 -0.02 0.00 -0.79 -3.61 105.19 105.08 3hs0 n GLY 58 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 3hs0 n GLY 58 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3hs0 n MET 59 N -2.18 -5.39 -3.68 1.61 0.00 -0.63 -4.84 117.12 102.00 3hs0 n MET 59 Ca 0.00 0.73 -0.19 0.00 0.00 0.00 0.00 57.70 58.24 3hs0 n MET 59 Cb 0.00 -5.32 -0.17 0.00 0.00 0.00 0.00 33.22 27.73 3hs0 n MET 59 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 175.97 174.80 3hs0 s LEU 60 N -5.96 0.22 0.02 4.03 0.20 -1.24 -1.75 118.68 114.21 3hs0 s LEU 60 Ca 0.37 0.12 0.08 0.00 0.69 0.00 0.00 54.13 55.40 3hs0 s LEU 60 Cb -0.16 -0.05 -0.02 0.00 -0.43 0.00 0.00 46.19 45.52 3hs0 s LEU 60 CO 0.46 -0.23 -0.24 0.68 -0.29 0.00 0.00 176.35 176.73 3hs0 s VAL 61 N 2.04 1.93 -0.47 1.68 -7.23 -0.75 -4.90 120.40 112.72 3hs0 s VAL 61 Ca 0.03 -1.21 0.03 0.00 -1.81 0.00 0.00 61.98 59.01 3hs0 s VAL 61 Cb -0.12 -1.64 0.15 0.00 0.56 0.00 0.00 36.38 35.33 3hs0 s VAL 61 CO -0.04 0.38 0.29 0.42 -0.31 0.00 0.00 175.10 175.85 3hs0 s THR 62 N -0.72 1.35 -0.01 5.32 -4.23 -1.26 -1.63 115.64 114.46 3hs0 s THR 62 Ca 0.10 -2.76 -0.25 0.00 -1.18 0.00 0.00 61.69 57.60 3hs0 s THR 62 Cb -0.09 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.77 3hs0 s THR 62 CO 0.01 -0.98 0.76 -2.84 -0.54 0.00 0.00 174.62 171.03 3hs0 s PRO 63 N 0.09 4.47 0.18 3.99 0.02 -1.24 -4.79 135.00 137.72 3hs0 s PRO 63 Ca 0.21 1.01 -0.30 0.00 0.02 0.00 0.00 61.00 61.95 3hs0 s PRO 63 Cb -0.17 -3.41 -0.07 0.00 0.02 0.00 0.00 34.50 30.87 3hs0 s PRO 63 CO -0.06 0.16 0.99 0.95 -0.33 0.00 0.00 177.00 178.72 3hs0 s THR 64 N 0.39 4.18 0.35 0.99 -4.23 -1.26 -2.06 115.64 113.99 3hs0 s THR 64 Ca 0.39 1.96 0.09 0.00 -1.18 0.00 0.00 61.69 62.96 3hs0 s THR 64 Cb -0.19 -4.25 -0.06 0.00 1.34 0.00 0.00 72.50 69.33 3hs0 s THR 64 CO 0.21 0.38 -0.08 0.27 -0.54 0.00 0.00 174.62 174.86 3hs0 s ILE 65 N -0.52 2.27 -0.10 2.99 -4.36 0.02 -4.88 121.20 116.62 3hs0 s ILE 65 Ca 0.45 -2.17 -0.07 0.00 -0.26 0.00 0.00 60.65 58.60 3hs0 s ILE 65 Cb -0.26 -2.68 0.04 0.00 1.25 0.00 0.00 42.46 40.81 3hs0 s ILE 65 CO 0.32 -0.19 0.25 -0.70 0.24 0.00 0.00 174.94 174.86 3hs0 s GLU 66 N -3.62 0.25 -0.39 0.37 2.12 -1.26 -1.12 118.70 115.05 3hs0 s GLU 66 Ca 0.33 0.45 0.02 0.00 0.36 0.00 0.00 54.97 56.13 3hs0 s GLU 66 Cb 0.03 0.01 0.11 0.00 0.26 0.00 0.00 34.13 34.54 3hs0 s GLU 66 CO 0.17 -0.10 0.13 0.42 -0.54 0.00 0.00 175.26 175.34 3hs0 s ILE 67 N 0.70 2.64 -0.01 -3.70 1.01 -1.26 -4.61 121.20 115.97 3hs0 s ILE 67 Ca -0.05 -2.38 -0.36 0.00 0.00 0.00 0.00 60.65 57.86 3hs0 s ILE 67 Cb -0.06 -2.88 -0.14 0.00 0.01 0.00 0.00 42.46 39.39 3hs0 s ILE 67 CO -0.04 -0.65 1.64 -2.65 0.00 0.00 0.00 174.94 173.23 3hs0 n PRO 68 N 4.21 1.72 0.00 2.79 -0.02 -1.26 -1.35 135.00 141.09 3hs0 n PRO 68 Ca 0.03 0.63 0.03 0.00 -2.02 0.00 0.00 63.50 62.16 3hs0 n PRO 68 Cb 0.41 -2.37 0.12 0.00 -0.02 0.00 0.00 33.50 31.64 3hs0 n PRO 68 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hs0 n ALA 69 N 4.45 1.36 -0.06 3.55 0.00 -1.26 -3.02 120.51 125.53 3hs0 n ALA 69 Ca 0.21 -0.02 -0.06 0.00 0.00 0.00 0.00 53.44 53.56 3hs0 n ALA 69 Cb 0.24 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.55 3hs0 n ALA 69 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3hs0 h LYS 70 N 0.00 0.00 0.00 0.00 1.57 -2.02 -3.37 116.57 112.75 3hs0 h LYS 70 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hs0 h LYS 70 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3hs0 h LYS 70 CO 0.00 0.35 0.00 0.39 -0.57 0.00 0.00 179.45 179.62 3hs0 n GLU 71 N -4.68 0.06 -3.59 3.15 -0.58 -1.17 -4.35 120.64 109.48 3hs0 n GLU 71 Ca -0.07 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.38 3hs0 n GLU 71 Cb 0.23 -1.35 -0.15 0.00 -0.57 0.00 0.00 31.44 29.60 3hs0 n GLU 71 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3hs0 s VAL 72 N -2.00 0.15 -0.30 2.62 0.11 -1.26 -5.04 120.40 114.68 3hs0 s VAL 72 Ca 0.02 -0.85 -0.17 0.00 -2.93 0.00 0.00 61.98 58.04 3hs0 s VAL 72 Cb 0.01 -1.10 0.21 0.00 -1.53 0.00 0.00 36.38 33.97 3hs0 s VAL 72 CO 0.01 -0.67 1.30 -0.94 -3.33 0.00 0.00 175.10 171.47 3hs0 s SER 73 N 1.99 -0.02 0.36 3.54 1.04 -1.26 -4.99 113.70 114.37 3hs0 s SER 73 Ca 0.08 0.02 -0.07 0.00 0.48 0.00 0.00 55.95 56.47 3hs0 s SER 73 Cb -0.16 1.01 -0.06 0.00 0.10 0.00 0.00 66.02 66.91 3hs0 s SER 73 CO -0.32 -0.00 -0.27 0.59 0.98 0.00 0.00 173.24 174.22 3hs0 n ASN 79 N 3.59 -2.24 -3.87 7.02 3.02 -1.26 -5.25 115.26 116.27 3hs0 n ASN 79 Ca -0.13 0.11 -0.12 0.00 -0.03 0.00 0.00 54.58 54.41 3hs0 n ASN 79 Cb 0.56 -0.31 -0.13 0.00 -0.61 0.00 0.00 39.78 39.29 3hs0 n ASN 79 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3hs0 s GLN 80 N -0.72 0.09 0.34 3.52 -1.52 -1.26 -5.12 119.66 114.99 3hs0 s GLN 80 Ca 0.17 -0.03 0.06 0.00 -1.95 0.00 0.00 55.36 53.61 3hs0 s GLN 80 Cb -0.10 0.04 -0.07 0.00 -0.22 0.00 0.00 33.01 32.67 3hs0 s GLN 80 CO 0.32 -0.01 0.01 0.71 -0.25 0.00 0.00 175.29 176.07 3hs0 s TYR 81 N -0.19 2.15 0.02 0.91 2.02 -1.26 -2.15 117.35 118.85 3hs0 s TYR 81 Ca -0.02 -0.80 -0.04 0.00 -0.37 0.00 0.00 57.07 55.83 3hs0 s TYR 81 Cb -0.02 -1.41 -0.01 0.00 -0.40 0.00 0.00 41.96 40.13 3hs0 s TYR 81 CO 0.00 0.22 0.07 0.14 -1.57 0.00 0.00 175.55 174.41 3hs0 s VAL 82 N -3.03 0.11 -0.14 0.71 -7.23 -0.68 -3.11 120.40 107.02 3hs0 s VAL 82 Ca 0.35 -0.89 -0.02 0.00 -1.81 0.00 0.00 61.98 59.61 3hs0 s VAL 82 Cb 0.08 -0.51 -0.02 0.00 0.56 0.00 0.00 36.38 36.49 3hs0 s VAL 82 CO 0.16 -0.49 -0.09 0.54 -0.31 0.00 0.00 175.10 174.91 3hs0 s VAL 83 N -1.75 3.42 -0.34 1.32 0.11 -0.00 -1.23 120.40 121.92 3hs0 s VAL 83 Ca -0.12 -0.53 -0.12 0.00 -2.93 0.00 0.00 61.98 58.27 3hs0 s VAL 83 Cb -0.07 -2.47 -0.01 0.00 -1.53 0.00 0.00 36.38 32.31 3hs0 s VAL 83 CO -0.01 0.51 0.23 -0.69 -3.33 0.00 0.00 175.10 171.81 3hs0 s VAL 84 N 0.37 5.13 -0.04 2.04 1.01 -0.91 -1.29 120.40 126.71 3hs0 s VAL 84 Ca -0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 3hs0 s VAL 84 Cb -0.15 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 3hs0 s VAL 84 CO 0.04 -0.03 0.06 -1.10 0.00 0.00 0.00 175.10 174.07 3hs0 s GLN 85 N 1.69 3.06 -0.22 2.72 -0.21 -0.74 -2.71 119.66 123.25 3hs0 s GLN 85 Ca 0.06 -0.43 -0.03 0.00 0.02 0.00 0.00 55.36 54.97 3hs0 s GLN 85 Cb -0.18 -2.86 0.07 0.00 1.00 0.00 0.00 33.01 31.04 3hs0 s GLN 85 CO 0.10 0.68 0.06 0.08 -2.12 0.00 0.00 175.29 174.08 3hs0 s VAL 86 N -1.08 0.47 0.34 1.09 1.01 -0.56 -2.15 120.40 119.52 3hs0 s VAL 86 Ca 0.19 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.59 3hs0 s VAL 86 Cb -0.12 -1.08 -0.06 0.00 0.00 0.00 0.00 36.38 35.13 3hs0 s VAL 86 CO 0.09 -0.33 -0.03 0.42 0.00 0.00 0.00 175.10 175.25 3hs0 s THR 87 N 1.87 2.53 0.00 3.92 -4.23 -0.79 -1.92 115.64 117.01 3hs0 s THR 87 Ca 0.02 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.47 3hs0 s THR 87 Cb -0.17 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.94 3hs0 s THR 87 CO -0.13 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.34 3hs0 n GLY 88 N -0.89 -0.68 3.57 3.99 0.00 -0.88 -1.56 105.19 108.74 3hs0 n GLY 88 Ca -0.05 -1.25 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 3hs0 n GLY 88 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hs0 n PRO 89 N -0.83 1.64 -1.33 1.61 -0.02 -1.26 -1.38 135.00 133.44 3hs0 n PRO 89 Ca 0.00 0.39 -0.02 0.00 -2.02 0.00 0.00 63.50 61.85 3hs0 n PRO 89 Cb 0.00 -3.15 -0.01 0.00 -0.02 0.00 0.00 33.50 30.32 3hs0 n PRO 89 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3hs0 n GLN 90 N 8.74 -0.16 -3.70 -0.52 6.02 -1.26 -5.03 117.38 121.47 3hs0 n GLN 90 Ca 0.33 0.45 -0.26 0.00 -0.01 0.00 0.00 57.00 57.52 3hs0 n GLN 90 Cb 0.43 -4.06 -0.17 0.00 1.02 0.00 0.00 30.24 27.47 3hs0 n GLN 90 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hs0 s VAL 91 N -2.09 0.25 -0.19 5.09 1.01 -0.48 -5.04 120.40 118.96 3hs0 s VAL 91 Ca 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 61.73 3hs0 s VAL 91 Cb 0.00 -0.73 0.05 0.00 0.00 0.00 0.00 36.38 35.70 3hs0 s VAL 91 CO 0.00 -0.12 -0.01 -0.13 0.00 0.00 0.00 175.10 174.83 3hs0 s ARG 92 N 1.99 1.12 -0.03 2.72 0.52 -1.25 -2.06 118.95 121.96 3hs0 s ARG 92 Ca 0.01 -0.58 0.04 0.00 -0.52 0.00 0.00 55.73 54.69 3hs0 s ARG 92 Cb -0.16 -2.16 -0.00 0.00 0.52 0.00 0.00 34.95 33.15 3hs0 s ARG 92 CO -0.07 -0.56 -0.15 -0.51 0.02 0.00 0.00 175.30 174.03 3hs0 s LEU 93 N 1.68 1.91 -0.01 2.53 1.43 -0.81 -4.89 118.68 120.52 3hs0 s LEU 93 Ca -0.02 -0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 52.78 3hs0 s LEU 93 Cb -0.17 -0.83 0.01 0.00 0.03 0.00 0.00 46.19 45.22 3hs0 s LEU 93 CO -0.07 0.14 0.02 -0.70 0.23 0.00 0.00 176.35 175.97 3hs0 s GLU 94 N -0.03 0.02 -0.11 1.70 2.12 -1.26 -1.50 118.70 119.63 3hs0 s GLU 94 Ca -0.01 0.05 -0.05 0.00 0.36 0.00 0.00 54.97 55.32 3hs0 s GLU 94 Cb -0.09 -0.02 0.05 0.00 0.26 0.00 0.00 34.13 34.33 3hs0 s GLU 94 CO 0.01 -0.02 0.25 0.21 -0.54 0.00 0.00 175.26 175.17 3hs0 s LYS 95 N 0.14 0.18 0.02 4.30 2.47 -1.10 -4.92 119.74 120.83 3hs0 s LYS 95 Ca -0.01 0.62 -0.26 0.00 -1.56 0.00 0.00 55.97 54.76 3hs0 s LYS 95 Cb -0.02 -0.09 -0.05 0.00 -1.46 0.00 0.00 37.83 36.22 3hs0 s LYS 95 CO -0.00 -0.22 0.82 0.08 0.16 0.00 0.00 175.35 176.19 3hs0 s VAL 96 N 1.76 4.80 0.03 4.02 1.01 -1.26 -2.13 120.40 128.62 3hs0 s VAL 96 Ca -0.05 1.73 0.05 0.00 0.00 0.00 0.00 61.98 63.71 3hs0 s VAL 96 Cb -0.11 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 3hs0 s VAL 96 CO -0.08 0.29 -0.15 -0.69 0.00 0.00 0.00 175.10 174.47 3hs0 s VAL 97 N 0.36 1.16 0.19 2.92 1.01 -0.37 -4.94 120.40 120.73 3hs0 s VAL 97 Ca 0.42 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 3hs0 s VAL 97 Cb -0.20 -1.02 -0.08 0.00 0.00 0.00 0.00 36.38 35.07 3hs0 s VAL 97 CO 0.24 0.10 1.11 -0.22 0.00 0.00 0.00 175.10 176.33 3hs0 s LEU 98 N -0.93 4.49 0.09 3.92 2.96 -1.24 -1.68 118.68 126.29 3hs0 s LEU 98 Ca 0.03 2.13 -0.01 0.00 -0.22 0.00 0.00 54.13 56.06 3hs0 s LEU 98 Cb -0.07 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 3hs0 s LEU 98 CO 0.01 -0.23 0.26 -0.22 -1.32 0.00 0.00 176.35 174.84 3hs0 s LEU 99 N -0.48 4.33 -0.02 -0.68 2.96 -0.91 -0.79 118.68 123.09 3hs0 s LEU 99 Ca 0.49 0.33 0.00 0.00 -0.22 0.00 0.00 54.13 54.73 3hs0 s LEU 99 Cb -0.30 -3.03 0.02 0.00 0.50 0.00 0.00 46.19 43.38 3hs0 s LEU 99 CO 0.36 0.13 0.00 -0.55 -1.32 0.00 0.00 176.35 174.97 3hs0 s SER 100 N -2.59 0.32 0.00 3.68 0.15 0.12 -4.76 113.70 110.64 3hs0 s SER 100 Ca 0.36 -0.02 0.29 0.00 0.70 0.00 0.00 55.95 57.28 3hs0 s SER 100 Cb -0.13 -0.17 1.20 0.00 -1.71 0.00 0.00 66.02 65.22 3hs0 s SER 100 CO 0.27 -0.09 1.83 -1.22 1.20 0.00 0.00 173.24 175.24 3hs0 n TYR 101 N 3.99 0.00 -2.56 3.44 4.01 -1.26 -2.53 117.16 122.25 3hs0 n TYR 101 Ca -0.25 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.06 3hs0 n TYR 101 Cb 0.51 -0.03 -0.00 0.00 -0.31 0.00 0.00 39.34 39.51 3hs0 n TYR 101 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3hs0 s GLN 102 N -2.10 3.90 0.29 -0.72 -0.21 -1.26 -4.74 119.66 114.82 3hs0 s GLN 102 Ca 0.38 -1.88 0.03 0.00 0.02 0.00 0.00 55.36 53.90 3hs0 s GLN 102 Cb 0.21 -5.51 0.68 0.00 1.00 0.00 0.00 33.01 29.39 3hs0 s GLN 102 CO 0.38 -2.31 1.74 0.77 -2.12 0.00 0.00 175.29 173.74 3hs0 h SER 103 N 7.86 0.55 -3.47 5.90 0.02 -1.81 -3.45 113.55 119.16 3hs0 h SER 103 Ca 0.42 0.12 -0.15 0.00 -0.84 0.00 0.00 61.79 61.33 3hs0 h SER 103 Cb 0.89 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.43 3hs0 h SER 103 CO 1.45 0.16 0.06 -1.54 -1.14 0.00 0.00 176.83 175.82 3hs0 n SER 104 N -4.90 -1.82 -4.68 3.07 3.41 -1.26 -4.80 113.62 102.64 3hs0 n SER 104 Ca 0.21 -2.73 -0.39 0.00 -0.26 0.00 0.00 58.87 55.70 3hs0 n SER 104 Cb 0.56 3.17 -0.06 0.00 -0.26 0.00 0.00 64.21 67.62 3hs0 n SER 104 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3hs0 s PHE 105 N -2.60 3.42 -0.04 7.33 0.08 -1.26 -4.97 117.98 119.95 3hs0 s PHE 105 Ca 0.22 0.85 -0.02 0.00 0.12 0.00 0.00 56.93 58.10 3hs0 s PHE 105 Cb -0.03 -2.66 -0.04 0.00 -0.57 0.00 0.00 43.02 39.72 3hs0 s PHE 105 CO 0.16 -0.03 0.10 -0.51 -0.10 0.00 0.00 175.22 174.85 3hs0 s LEU 106 N 1.35 4.04 -0.00 -0.37 1.43 -1.26 -2.51 118.68 121.36 3hs0 s LEU 106 Ca 0.26 0.25 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 3hs0 s LEU 106 Cb -0.15 -2.24 -0.01 0.00 0.03 0.00 0.00 46.19 43.82 3hs0 s LEU 106 CO 0.10 0.31 -0.07 -0.36 0.23 0.00 0.00 176.35 176.57 3hs0 s PHE 107 N -1.14 0.62 -0.12 0.29 0.08 -0.57 -4.76 117.98 112.37 3hs0 s PHE 107 Ca 0.21 -0.14 -0.03 0.00 0.12 0.00 0.00 56.93 57.09 3hs0 s PHE 107 Cb -0.12 -0.40 -0.03 0.00 -0.57 0.00 0.00 43.02 41.90 3hs0 s PHE 107 CO 0.11 -0.01 -0.03 0.42 -0.10 0.00 0.00 175.22 175.61 3hs0 s ILE 108 N -0.24 4.03 -0.07 0.64 1.01 -1.26 -1.03 121.20 124.28 3hs0 s ILE 108 Ca 0.02 -0.33 0.03 0.00 0.00 0.00 0.00 60.65 60.37 3hs0 s ILE 108 Cb -0.03 -2.73 -0.02 0.00 0.01 0.00 0.00 42.46 39.69 3hs0 s ILE 108 CO -0.00 0.54 -0.16 -1.58 0.00 0.00 0.00 174.94 173.74 3hs0 s GLN 109 N -0.15 2.69 0.22 2.79 0.74 -0.46 -4.78 119.66 120.71 3hs0 s GLN 109 Ca 0.03 -0.73 0.12 0.00 0.05 0.00 0.00 55.36 54.83 3hs0 s GLN 109 Cb -0.13 -2.40 -0.05 0.00 1.10 0.00 0.00 33.01 31.54 3hs0 s GLN 109 CO 0.02 0.50 -0.22 0.95 -0.55 0.00 0.00 175.29 175.99 3hs0 s THR 110 N -0.42 2.43 0.32 -0.34 -4.23 -1.26 -1.49 115.64 110.65 3hs0 s THR 110 Ca 0.05 -2.14 0.18 0.00 -1.18 0.00 0.00 61.69 58.60 3hs0 s THR 110 Cb -0.12 -2.20 0.15 0.00 1.34 0.00 0.00 72.50 71.67 3hs0 s THR 110 CO 0.02 -0.21 1.85 -2.24 -0.54 0.00 0.00 174.62 173.50 3hs0 h ASP 111 N 2.88 0.00 -5.24 3.99 2.03 -1.91 -3.45 116.42 114.72 3hs0 h ASP 111 Ca -0.44 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 55.76 3hs0 h ASP 111 Cb 1.22 0.00 -0.12 0.00 -0.83 0.00 0.00 39.33 39.60 3hs0 h ASP 111 CO 0.52 0.31 -0.30 -0.54 -1.03 0.00 0.00 179.24 178.20 3hs0 s LYS 112 N -4.00 1.14 0.01 4.15 1.02 -1.26 -4.90 119.74 115.89 3hs0 s LYS 112 Ca -0.02 -1.13 0.22 0.00 0.02 0.00 0.00 55.97 55.06 3hs0 s LYS 112 Cb 0.13 0.38 -0.14 0.00 -0.52 0.00 0.00 37.83 37.69 3hs0 s LYS 112 CO 0.68 -0.42 0.86 0.41 -0.92 0.00 0.00 175.35 175.96 3hs0 n GLY 113 N -0.21 -1.08 2.80 -3.33 0.00 -1.26 -4.89 105.19 97.22 3hs0 n GLY 113 Ca -0.08 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.29 3hs0 n GLY 113 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3hs0 s ILE 114 N -3.20 -0.03 0.18 -0.61 2.07 -1.26 -1.08 121.20 117.27 3hs0 s ILE 114 Ca 0.03 0.15 0.08 0.00 -1.41 0.00 0.00 60.65 59.49 3hs0 s ILE 114 Cb 0.15 -0.07 -0.04 0.00 0.13 0.00 0.00 42.46 42.63 3hs0 s ILE 114 CO 0.85 0.07 -0.16 -0.31 -1.91 0.00 0.00 174.94 173.47 3hs0 s TYR 115 N 0.75 1.75 0.13 3.50 2.02 0.81 -4.95 117.35 121.35 3hs0 s TYR 115 Ca -0.06 -0.51 0.03 0.00 -0.37 0.00 0.00 57.07 56.16 3hs0 s TYR 115 Cb -0.09 -0.85 -0.04 0.00 -0.40 0.00 0.00 41.96 40.58 3hs0 s TYR 115 CO -0.02 0.33 0.18 0.95 -1.57 0.00 0.00 175.55 175.42 3hs0 s THR 116 N -2.41 4.84 0.22 -0.71 -4.23 -1.26 -1.22 115.64 110.87 3hs0 s THR 116 Ca 0.18 -0.83 -0.32 0.00 -1.18 0.00 0.00 61.69 59.54 3hs0 s THR 116 Cb -0.04 -3.44 -0.14 0.00 1.34 0.00 0.00 72.50 70.22 3hs0 s THR 116 CO 0.07 -0.03 1.34 -2.65 -0.54 0.00 0.00 174.62 172.80 3hs0 n PRO 117 N -0.19 1.80 -0.36 3.99 -0.02 -1.26 -3.05 135.00 135.91 3hs0 n PRO 117 Ca -0.08 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3hs0 n PRO 117 Cb 0.53 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 3hs0 n PRO 117 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hs0 n GLY 118 N 2.12 0.79 3.33 -1.23 0.00 -1.01 -4.77 105.19 104.41 3hs0 n GLY 118 Ca 0.12 -0.30 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 3hs0 n GLY 118 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hs0 s SER 119 N -2.27 2.59 0.18 1.61 1.04 -1.17 -4.88 113.70 110.80 3hs0 s SER 119 Ca 0.00 -0.90 -0.30 0.00 0.48 0.00 0.00 55.95 55.23 3hs0 s SER 119 Cb 0.00 -0.14 -0.08 0.00 0.10 0.00 0.00 66.02 65.90 3hs0 s SER 119 CO 0.00 -0.08 1.17 -2.16 0.98 0.00 0.00 173.24 173.16 3hs0 s PRO 120 N -2.99 4.52 -0.66 4.02 0.04 -1.26 -2.20 135.00 136.46 3hs0 s PRO 120 Ca 0.17 1.83 -0.13 0.00 0.04 0.00 0.00 61.00 62.91 3hs0 s PRO 120 Cb -0.04 -3.25 0.17 0.00 0.04 0.00 0.00 34.50 31.41 3hs0 s PRO 120 CO 0.06 -0.05 0.59 0.08 0.04 0.00 0.00 177.00 177.72 3hs0 s VAL 121 N -0.08 5.15 0.41 -0.36 1.01 0.77 -4.98 120.40 122.31 3hs0 s VAL 121 Ca 0.52 -2.06 -0.24 0.00 0.00 0.00 0.00 61.98 60.20 3hs0 s VAL 121 Cb -0.32 -4.26 -0.09 0.00 0.00 0.00 0.00 36.38 31.72 3hs0 s VAL 121 CO 0.36 -0.93 1.06 -0.76 0.00 0.00 0.00 175.10 174.83 3hs0 s LEU 122 N 0.83 4.11 0.13 3.92 1.43 -1.26 -2.89 118.68 124.95 3hs0 s LEU 122 Ca 0.11 2.05 -0.18 0.00 -1.03 0.00 0.00 54.13 55.08 3hs0 s LEU 122 Cb -0.20 -4.21 0.04 0.00 0.03 0.00 0.00 46.19 41.85 3hs0 s LEU 122 CO -0.03 -0.54 0.45 -0.72 0.23 0.00 0.00 176.35 175.74 3hs0 s TYR 123 N -1.68 -0.28 0.03 0.29 -0.85 -1.26 -2.80 117.35 110.81 3hs0 s TYR 123 Ca 0.59 -0.01 0.03 0.00 -0.52 0.00 0.00 57.07 57.15 3hs0 s TYR 123 Cb -0.22 0.33 -0.02 0.00 0.38 0.00 0.00 41.96 42.43 3hs0 s TYR 123 CO 0.27 -0.74 -0.10 1.03 -1.52 0.00 0.00 175.55 174.50 3hs0 s ARG 124 N -3.79 0.65 -0.10 -3.49 0.52 -0.56 -4.80 118.95 107.37 3hs0 s ARG 124 Ca 0.03 -0.64 -0.01 0.00 -0.52 0.00 0.00 55.73 54.59 3hs0 s ARG 124 Cb 0.01 -0.55 -0.03 0.00 0.52 0.00 0.00 34.95 34.90 3hs0 s ARG 124 CO -0.12 0.13 -0.06 0.08 0.02 0.00 0.00 175.30 175.35 3hs0 s VAL 125 N -0.92 3.73 0.05 3.52 1.01 -1.26 -1.36 120.40 125.18 3hs0 s VAL 125 Ca -0.03 -0.45 0.06 0.00 0.00 0.00 0.00 61.98 61.56 3hs0 s VAL 125 Cb -0.07 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 3hs0 s VAL 125 CO 0.01 0.56 -0.13 -0.36 0.00 0.00 0.00 175.10 175.18 3hs0 s PHE 126 N -0.34 2.69 0.18 5.22 0.08 -0.20 -4.90 117.98 120.71 3hs0 s PHE 126 Ca 0.05 -0.18 0.10 0.00 0.12 0.00 0.00 56.93 57.03 3hs0 s PHE 126 Cb -0.12 -1.48 -0.04 0.00 -0.57 0.00 0.00 43.02 40.80 3hs0 s PHE 126 CO 0.02 0.34 -0.19 0.45 -0.10 0.00 0.00 175.22 175.74 3hs0 s SER 127 N -1.69 3.72 0.20 1.36 0.15 -1.26 -1.52 113.70 114.67 3hs0 s SER 127 Ca 0.17 -0.75 0.26 0.00 0.70 0.00 0.00 55.95 56.34 3hs0 s SER 127 Cb -0.11 -0.42 0.75 0.00 -1.71 0.00 0.00 66.02 64.53 3hs0 s SER 127 CO 0.08 0.12 1.72 0.23 1.20 0.00 0.00 173.24 176.60 3hs0 n MET 128 N 0.27 0.27 -3.55 5.44 2.81 -1.04 -4.94 117.12 116.37 3hs0 n MET 128 Ca -0.12 0.20 -0.09 0.00 -1.81 0.00 0.00 57.70 55.88 3hs0 n MET 128 Cb 0.55 -1.80 -0.02 0.00 -0.71 0.00 0.00 33.22 31.25 3hs0 n MET 128 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 3hs0 s ASP 129 N -4.52 -0.40 -0.03 7.83 3.84 -1.26 -5.05 116.67 117.08 3hs0 s ASP 129 Ca 0.10 -0.14 -0.03 0.00 -0.00 0.00 0.00 52.55 52.48 3hs0 s ASP 129 Cb 0.12 0.53 0.01 0.00 -1.38 0.00 0.00 42.92 42.20 3hs0 s ASP 129 CO 0.61 -0.90 0.08 -1.00 -0.00 0.00 0.00 175.17 173.97 3hs0 s HIS 130 N -3.50 -0.07 0.00 2.11 3.76 -1.26 -5.02 115.29 111.31 3hs0 s HIS 130 Ca 0.05 0.16 0.00 0.00 -0.15 0.00 0.00 55.06 55.13 3hs0 s HIS 130 Cb -0.02 0.01 0.00 0.00 1.11 0.00 0.00 32.58 33.69 3hs0 s HIS 130 CO -0.07 -0.07 0.00 1.63 -0.85 0.00 0.00 174.74 175.38 3hs0 n LYS 137 N 2.84 1.96 -4.31 1.40 4.76 -1.26 -5.06 118.16 118.49 3hs0 n LYS 137 Ca -0.14 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 54.96 3hs0 n LYS 137 Cb 0.59 -0.81 -0.12 0.00 -1.84 0.00 0.00 35.03 32.85 3hs0 n LYS 137 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3hs0 s THR 138 N -1.62 4.01 0.09 -0.18 2.01 -1.26 -4.81 115.64 113.87 3hs0 s THR 138 Ca 0.00 -0.31 0.06 0.00 0.31 0.00 0.00 61.69 61.75 3hs0 s THR 138 Cb 0.00 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 3hs0 s THR 138 CO 0.00 0.48 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.65 3hs0 s VAL 139 N 0.44 3.58 -0.15 3.82 1.01 -1.12 -4.19 120.40 123.80 3hs0 s VAL 139 Ca -0.03 -1.13 -0.03 0.00 0.00 0.00 0.00 61.98 60.80 3hs0 s VAL 139 Cb -0.14 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 3hs0 s VAL 139 CO 0.02 0.15 -0.04 -0.63 0.00 0.00 0.00 175.10 174.60 3hs0 s ILE 140 N -1.21 3.84 -0.21 2.22 -1.09 0.25 0.14 121.20 125.14 3hs0 s ILE 140 Ca 0.22 -0.38 0.01 0.00 -2.23 0.00 0.00 60.65 58.27 3hs0 s ILE 140 Cb -0.11 -2.67 0.04 0.00 -1.58 0.00 0.00 42.46 38.14 3hs0 s ILE 140 CO 0.14 0.50 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.55 3hs0 s VAL 141 N 0.27 1.77 -0.01 2.92 1.01 0.05 -1.24 120.40 125.18 3hs0 s VAL 141 Ca -0.03 -1.09 0.04 0.00 0.00 0.00 0.00 61.98 60.90 3hs0 s VAL 141 Cb -0.14 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 3hs0 s VAL 141 CO 0.03 0.19 -0.13 -1.61 0.00 0.00 0.00 175.10 173.58 3hs0 s GLU 142 N 1.34 2.40 -0.16 2.72 2.02 0.06 -1.73 118.70 125.35 3hs0 s GLU 142 Ca -0.02 -0.78 -0.05 0.00 0.02 0.00 0.00 54.97 54.15 3hs0 s GLU 142 Cb -0.16 -2.37 -0.03 0.00 0.10 0.00 0.00 34.13 31.67 3hs0 s GLU 142 CO -0.08 0.59 -0.01 -0.06 0.02 0.00 0.00 175.26 175.72 3hs0 s PHE 143 N -0.87 3.08 0.04 1.61 0.40 -0.12 -0.56 117.98 121.56 3hs0 s PHE 143 Ca 0.14 -0.21 0.08 0.00 -0.60 0.00 0.00 56.93 56.34 3hs0 s PHE 143 Cb -0.11 -1.99 -0.03 0.00 0.51 0.00 0.00 43.02 41.40 3hs0 s PHE 143 CO 0.04 0.01 -0.23 -0.65 0.70 0.00 0.00 175.22 175.09 3hs0 s GLN 144 N 0.37 1.95 0.65 0.44 -0.21 -0.14 -1.61 119.66 121.13 3hs0 s GLN 144 Ca -0.02 -1.04 -0.07 0.00 0.02 0.00 0.00 55.36 54.25 3hs0 s GLN 144 Cb -0.14 -2.08 0.03 0.00 1.00 0.00 0.00 33.01 31.82 3hs0 s GLN 144 CO 0.02 0.53 0.98 0.95 -2.12 0.00 0.00 175.29 175.65 3hs0 s THR 145 N -0.84 3.03 0.59 -0.19 -4.23 -0.37 -1.82 115.64 111.82 3hs0 s THR 145 Ca 0.13 -0.05 0.29 0.00 -1.18 0.00 0.00 61.69 60.87 3hs0 s THR 145 Cb -0.10 -3.26 0.36 0.00 1.34 0.00 0.00 72.50 70.84 3hs0 s THR 145 CO 0.03 -0.28 2.08 -0.65 -0.54 0.00 0.00 174.62 175.26 3hs0 h PRO 146 N -0.42 0.00 -0.01 3.99 0.11 -1.88 0.51 132.00 134.30 3hs0 h PRO 146 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3hs0 h PRO 146 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3hs0 h PRO 146 CO 0.61 0.00 -0.08 0.39 -0.21 0.00 0.00 178.00 178.71 3hs0 n GLU 147 N -3.77 1.22 -0.40 1.05 4.71 -1.26 -4.92 120.64 117.27 3hs0 n GLU 147 Ca 0.02 -0.62 0.00 0.00 -0.01 0.00 0.00 57.16 56.55 3hs0 n GLU 147 Cb 0.36 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.30 3hs0 n GLU 147 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3hs0 n GLY 148 N 1.21 0.77 3.75 0.62 0.00 0.18 -5.06 105.19 106.66 3hs0 n GLY 148 Ca 0.17 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 3hs0 n GLY 148 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hs0 s ILE 149 N -2.00 4.55 -0.40 -0.61 -1.09 -1.25 -4.74 121.20 115.65 3hs0 s ILE 149 Ca 0.00 1.77 -0.27 0.00 -2.23 0.00 0.00 60.65 59.93 3hs0 s ILE 149 Cb 0.00 -4.18 0.02 0.00 -1.58 0.00 0.00 42.46 36.72 3hs0 s ILE 149 CO 0.00 0.40 0.99 -0.22 -1.23 0.00 0.00 174.94 174.88 3hs0 s LEU 150 N -0.39 3.92 0.00 2.97 2.96 -1.26 -1.24 118.68 125.64 3hs0 s LEU 150 Ca 0.40 0.51 0.04 0.00 -0.22 0.00 0.00 54.13 54.86 3hs0 s LEU 150 Cb -0.22 -3.34 -0.00 0.00 0.50 0.00 0.00 46.19 43.13 3hs0 s LEU 150 CO 0.26 -0.98 0.41 1.33 -1.32 0.00 0.00 176.35 176.04 3hs0 n VAL 151 N 6.24 0.00 -3.66 1.68 0.24 -0.63 -5.00 118.33 117.20 3hs0 n VAL 151 Ca 0.08 -0.46 -0.14 0.00 -2.04 0.00 0.00 64.34 61.79 3hs0 n VAL 151 Cb 0.48 1.05 -0.08 0.00 -1.47 0.00 0.00 33.84 33.82 3hs0 n VAL 151 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3hs0 s SER 152 N -0.85 -0.65 -0.28 -1.34 0.15 -1.22 -4.96 113.70 104.55 3hs0 s SER 152 Ca 0.03 1.26 0.01 0.00 0.70 0.00 0.00 55.95 57.95 3hs0 s SER 152 Cb 0.03 1.27 0.16 0.00 -1.71 0.00 0.00 66.02 65.78 3hs0 s SER 152 CO 0.11 -0.22 0.46 -0.55 1.20 0.00 0.00 173.24 174.24 3hs0 s SER 153 N 0.35 -0.25 0.08 5.45 0.15 -1.26 -0.95 113.70 117.27 3hs0 s SER 153 Ca -0.00 0.10 0.09 0.00 0.70 0.00 0.00 55.95 56.84 3hs0 s SER 153 Cb -0.04 1.42 -0.03 0.00 -1.71 0.00 0.00 66.02 65.66 3hs0 s SER 153 CO 0.01 -0.31 -0.23 0.20 1.20 0.00 0.00 173.24 174.10 3hs0 s ASN 154 N 2.64 3.50 -0.04 5.45 0.01 -0.71 -4.95 114.94 120.84 3hs0 s ASN 154 Ca 0.13 -0.58 -0.30 0.00 -0.71 0.00 0.00 52.86 51.40 3hs0 s ASN 154 Cb -0.13 -0.40 -0.02 0.00 0.41 0.00 0.00 41.25 41.10 3hs0 s ASN 154 CO -0.24 0.23 0.98 -0.44 -1.51 0.00 0.00 177.10 176.12 3hs0 s SER 155 N -1.63 7.32 0.11 -1.22 0.01 -1.26 -0.77 113.70 116.26 3hs0 s SER 155 Ca 0.14 1.60 0.09 0.00 1.31 0.00 0.00 55.95 59.09 3hs0 s SER 155 Cb -0.10 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.53 3hs0 s SER 155 CO 0.05 -0.32 -0.23 -0.69 0.41 0.00 0.00 173.24 172.47 3hs0 s VAL 156 N 1.33 1.88 -0.12 3.43 1.01 0.12 -4.97 120.40 123.08 3hs0 s VAL 156 Ca 0.50 -1.62 -0.01 0.00 0.00 0.00 0.00 61.98 60.86 3hs0 s VAL 156 Cb -0.20 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 3hs0 s VAL 156 CO 0.24 -0.03 -0.09 -0.62 0.00 0.00 0.00 175.10 174.60 3hs0 s ASP 157 N -1.98 4.35 0.00 3.32 -1.08 -1.26 -2.81 116.67 117.21 3hs0 s ASP 157 Ca 0.09 -0.20 0.00 0.00 -0.52 0.00 0.00 52.55 51.92 3hs0 s ASP 157 Cb -0.10 -1.49 0.00 0.00 -1.46 0.00 0.00 42.92 39.87 3hs0 s ASP 157 CO 0.05 0.22 0.28 0.18 0.52 0.00 0.00 175.17 176.42 3hs0 n LEU 158 N 3.14 0.82 0.00 -1.34 4.32 -1.26 -1.98 117.00 120.70 3hs0 n LEU 158 Ca -0.18 -0.41 0.00 0.00 -0.02 0.00 0.00 56.01 55.40 3hs0 n LEU 158 Cb 0.53 -0.15 0.00 0.00 -1.62 0.00 0.00 43.42 42.17 3hs0 n LEU 158 CO 0.30 0.14 -0.41 0.59 -1.22 0.00 0.00 177.39 176.79 3hs0 n ASN 159 N 0.77 1.25 -4.36 -1.43 3.02 -1.26 -4.91 115.26 108.34 3hs0 n ASN 159 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 3hs0 n ASN 159 Cb 0.14 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.18 3hs0 n ASN 159 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3hs0 s PHE 160 N -1.93 2.98 0.13 3.10 5.36 -0.84 -5.09 117.98 121.69 3hs0 s PHE 160 Ca 0.00 -0.74 0.11 0.00 -0.96 0.00 0.00 56.93 55.33 3hs0 s PHE 160 Cb 0.00 -2.09 -0.04 0.00 -0.34 0.00 0.00 43.02 40.55 3hs0 s PHE 160 CO 0.00 -0.42 -0.25 -0.06 -1.46 0.00 0.00 175.22 173.02 3hs0 s PHE 161 N 1.28 2.21 -0.48 10.12 0.08 -1.26 -4.16 117.98 125.76 3hs0 s PHE 161 Ca 0.03 -0.39 -0.14 0.00 0.12 0.00 0.00 56.93 56.55 3hs0 s PHE 161 Cb -0.14 -1.19 0.09 0.00 -0.57 0.00 0.00 43.02 41.21 3hs0 s PHE 161 CO -0.01 0.33 0.41 -1.58 -0.10 0.00 0.00 175.22 174.27 3hs0 s TRP 162 N -1.16 3.27 0.21 0.36 0.52 -1.26 -5.01 118.94 115.88 3hs0 s TRP 162 Ca 0.13 -1.17 -0.32 0.00 0.02 0.00 0.00 56.10 54.77 3hs0 s TRP 162 Cb -0.10 -3.35 -0.11 0.00 -1.15 0.00 0.00 33.47 28.76 3hs0 s TRP 162 CO 0.06 -0.88 1.67 -2.14 0.02 0.00 0.00 176.95 175.68 3hs0 s PRO 163 N 1.58 4.14 0.13 4.98 0.02 -1.26 -4.97 135.00 139.63 3hs0 s PRO 163 Ca 0.04 2.55 -0.30 0.00 0.02 0.00 0.00 61.00 63.31 3hs0 s PRO 163 Cb -0.26 -3.08 -0.06 0.00 0.02 0.00 0.00 34.50 31.12 3hs0 s PRO 163 CO 0.05 -0.70 1.03 -0.47 -0.33 0.00 0.00 177.00 176.58 3hs0 s TYR 164 N 0.95 3.70 -0.38 6.54 5.04 -1.14 -4.85 117.35 127.21 3hs0 s TYR 164 Ca 0.72 1.69 -0.11 0.00 -2.44 0.00 0.00 57.07 56.93 3hs0 s TYR 164 Cb -0.48 -3.17 0.04 0.00 0.35 0.00 0.00 41.96 38.70 3hs0 s TYR 164 CO 0.35 -0.22 0.21 -0.80 -1.34 0.00 0.00 175.55 173.75 3hs0 s ASN 165 N 0.03 5.71 0.14 4.32 -0.87 -1.26 -0.16 114.94 122.85 3hs0 s ASN 165 Ca 0.49 -1.08 -0.31 0.00 -1.57 0.00 0.00 52.86 50.39 3hs0 s ASN 165 Cb -0.26 -2.01 -0.08 0.00 -0.02 0.00 0.00 41.25 38.87 3hs0 s ASN 165 CO 0.32 -0.41 1.33 -0.76 -2.57 0.00 0.00 177.10 175.01 3hs0 s LEU 166 N 1.53 4.39 0.45 0.60 1.43 -0.93 -4.98 118.68 121.17 3hs0 s LEU 166 Ca 0.02 2.31 -0.23 0.00 -1.03 0.00 0.00 54.13 55.20 3hs0 s LEU 166 Cb -0.20 -3.60 -0.08 0.00 0.03 0.00 0.00 46.19 42.35 3hs0 s LEU 166 CO 0.06 -0.57 1.19 -2.84 0.23 0.00 0.00 176.35 174.41 3hs0 s PRO 167 N 0.59 3.79 0.63 1.29 0.02 -1.26 -2.42 135.00 137.64 3hs0 s PRO 167 Ca 0.60 1.84 0.31 0.00 0.02 0.00 0.00 61.00 63.78 3hs0 s PRO 167 Cb -0.36 -2.47 1.70 0.00 0.02 0.00 0.00 34.50 33.39 3hs0 s PRO 167 CO 0.33 -0.54 2.03 -0.44 -0.33 0.00 0.00 177.00 178.05 3hs0 h ASP 168 N 2.17 0.00 -2.60 2.53 3.32 -1.91 -3.05 116.42 116.88 3hs0 h ASP 168 Ca -0.49 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 55.94 3hs0 h ASP 168 Cb 1.25 0.00 -0.42 0.00 0.22 0.00 0.00 39.33 40.38 3hs0 h ASP 168 CO 0.61 0.00 -0.55 -0.11 -1.72 0.00 0.00 179.24 177.47 3hs0 n LEU 169 N -3.37 3.52 -4.48 1.55 7.94 -1.26 -4.74 117.00 116.17 3hs0 n LEU 169 Ca 0.01 -5.34 -0.25 0.00 -1.11 0.00 0.00 56.01 49.32 3hs0 n LEU 169 Cb 0.39 -0.73 -0.10 0.00 0.53 0.00 0.00 43.42 43.51 3hs0 n LEU 169 CO 0.21 1.92 -0.48 0.54 -1.11 0.00 0.00 177.39 178.47 3hs0 s VAL 170 N -2.05 2.54 -0.05 1.96 0.11 -1.16 -5.09 120.40 116.67 3hs0 s VAL 170 Ca 0.33 -2.27 -0.30 0.00 -2.93 0.00 0.00 61.98 56.82 3hs0 s VAL 170 Cb 0.06 -2.31 -0.05 0.00 -1.53 0.00 0.00 36.38 32.55 3hs0 s VAL 170 CO -0.08 -0.33 1.47 -0.55 -3.33 0.00 0.00 175.10 172.29 3hs0 s SER 171 N -3.32 6.79 0.35 3.54 0.15 -1.26 -5.00 113.70 114.96 3hs0 s SER 171 Ca 0.28 2.10 -0.21 0.00 0.70 0.00 0.00 55.95 58.82 3hs0 s SER 171 Cb -0.06 -2.55 -0.10 0.00 -1.71 0.00 0.00 66.02 61.61 3hs0 s SER 171 CO 0.14 -0.81 0.87 -0.76 1.20 0.00 0.00 173.24 173.89 3hs0 s LEU 172 N 3.16 4.12 0.00 3.45 1.43 -1.26 -4.81 118.68 124.78 3hs0 s LEU 172 Ca 0.66 1.60 0.00 0.00 -1.03 0.00 0.00 54.13 55.36 3hs0 s LEU 172 Cb -0.31 -4.18 0.00 0.00 0.03 0.00 0.00 46.19 41.74 3hs0 s LEU 172 CO 0.26 -0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.25 3hs0 n GLY 173 N -0.08 0.75 3.30 -3.19 0.00 -0.60 -4.87 105.19 100.50 3hs0 n GLY 173 Ca 0.04 -1.71 -0.38 0.00 0.00 0.00 0.00 46.02 43.97 3hs0 n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hs0 s THR 174 N -3.40 3.98 0.54 2.61 2.01 -1.26 0.11 115.64 120.22 3hs0 s THR 174 Ca 0.00 -1.04 -0.09 0.00 0.31 0.00 0.00 61.69 60.87 3hs0 s THR 174 Cb 0.00 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 69.24 3hs0 s THR 174 CO 0.00 -0.18 0.90 0.26 -0.69 0.00 0.00 174.62 174.91 3hs0 s TRP 175 N 1.44 3.58 -0.04 4.92 0.52 0.37 -3.92 118.94 125.81 3hs0 s TRP 175 Ca -0.01 1.06 0.06 0.00 0.02 0.00 0.00 56.10 57.23 3hs0 s TRP 175 Cb -0.19 -2.51 -0.02 0.00 -1.15 0.00 0.00 33.47 29.60 3hs0 s TRP 175 CO 0.04 -0.45 -0.21 1.03 0.02 0.00 0.00 176.95 177.38 3hs0 s ARG 176 N -4.84 2.39 -0.21 4.98 0.52 -0.75 -2.30 118.95 118.74 3hs0 s ARG 176 Ca 0.51 -0.83 -0.06 0.00 -0.52 0.00 0.00 55.73 54.84 3hs0 s ARG 176 Cb -0.11 -2.21 -0.03 0.00 0.52 0.00 0.00 34.95 33.12 3hs0 s ARG 176 CO 0.47 0.54 0.02 0.42 0.02 0.00 0.00 175.30 176.78 3hs0 s ILE 177 N -0.54 4.15 -0.17 1.52 1.01 -0.25 -0.96 121.20 125.96 3hs0 s ILE 177 Ca 0.07 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.49 3hs0 s ILE 177 Cb -0.11 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 39.48 3hs0 s ILE 177 CO 0.01 0.41 -0.18 -0.69 0.00 0.00 0.00 174.94 174.48 3hs0 s VAL 178 N 1.04 2.25 -0.15 2.92 1.01 0.28 -0.17 120.40 127.58 3hs0 s VAL 178 Ca 0.03 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 3hs0 s VAL 178 Cb -0.14 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 3hs0 s VAL 178 CO 0.02 0.53 -0.06 0.00 0.00 0.00 0.00 175.10 175.59 3hs0 s ALA 179 N 1.14 2.91 0.01 5.51 0.00 -0.11 -0.76 121.76 130.46 3hs0 s ALA 179 Ca 0.01 -0.84 -0.10 0.00 0.00 0.00 0.00 51.96 51.04 3hs0 s ALA 179 Cb -0.14 -1.46 0.01 0.00 0.00 0.00 0.00 23.12 21.52 3hs0 s ALA 179 CO -0.08 0.24 0.20 -1.59 0.00 0.00 0.00 175.76 174.53 3hs0 s LYS 180 N 0.32 0.59 0.47 0.00 -2.85 -0.37 -0.96 119.74 116.94 3hs0 s LYS 180 Ca -0.05 -0.41 -0.21 0.00 -1.00 0.00 0.00 55.97 54.29 3hs0 s LYS 180 Cb -0.15 0.25 -0.08 0.00 -2.06 0.00 0.00 37.83 35.79 3hs0 s LYS 180 CO 0.04 -0.16 1.07 0.71 0.10 0.00 0.00 175.35 177.11 3hs0 s TYR 181 N -1.69 3.01 0.00 1.78 2.02 -1.26 -0.58 117.35 120.63 3hs0 s TYR 181 Ca -0.12 1.59 0.00 0.00 -0.37 0.00 0.00 57.07 58.17 3hs0 s TYR 181 Cb -0.05 -3.15 0.00 0.00 -0.40 0.00 0.00 41.96 38.36 3hs0 s TYR 181 CO 0.01 -0.95 0.68 0.39 -1.57 0.00 0.00 175.55 174.11 3hs0 n GLU 182 N -0.71 0.00 -0.56 -0.62 1.02 -1.26 -1.30 120.64 117.21 3hs0 n GLU 182 Ca 0.08 0.68 0.06 0.00 -0.02 0.00 0.00 57.16 57.96 3hs0 n GLU 182 Cb 0.51 -1.06 0.28 0.00 -0.02 0.00 0.00 31.44 31.15 3hs0 n GLU 182 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3hs0 n HIS 183 N -2.36 1.32 -2.85 -0.32 8.25 -1.26 -4.91 115.22 113.10 3hs0 n HIS 183 Ca 0.00 -0.48 -0.42 0.00 -0.26 0.00 0.00 57.72 56.56 3hs0 n HIS 183 Cb 0.00 -0.32 -0.04 0.00 1.12 0.00 0.00 29.99 30.76 3hs0 n HIS 183 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3hs0 s SER 184 N -0.64 7.03 0.37 0.41 0.15 -0.42 -4.87 113.70 115.74 3hs0 s SER 184 Ca 0.38 1.27 0.16 0.00 0.70 0.00 0.00 55.95 58.45 3hs0 s SER 184 Cb 0.27 -2.48 0.71 0.00 -1.71 0.00 0.00 66.02 62.81 3hs0 s SER 184 CO 0.14 -0.40 1.78 -0.65 1.20 0.00 0.00 173.24 175.31 3hs0 h PRO 185 N 7.24 0.00 -6.85 5.44 0.11 -1.91 -3.44 132.00 132.59 3hs0 h PRO 185 Ca -0.30 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.33 3hs0 h PRO 185 Cb 1.14 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3hs0 h PRO 185 CO 0.84 0.40 0.22 -1.21 -0.21 0.00 0.00 178.00 178.04 3hs0 s GLU 186 N -3.88 4.20 0.18 1.05 2.02 -1.26 -5.07 118.70 115.94 3hs0 s GLU 186 Ca -0.02 0.95 -0.18 0.00 0.02 0.00 0.00 54.97 55.75 3hs0 s GLU 186 Cb 0.13 -2.45 0.03 0.00 0.10 0.00 0.00 34.13 31.94 3hs0 s GLU 186 CO 0.70 0.14 0.50 0.54 0.02 0.00 0.00 175.26 177.17 3hs0 s ASN 187 N -2.06 -0.29 -0.14 -0.19 2.20 -1.26 -4.54 114.94 108.67 3hs0 s ASN 187 Ca 0.55 -0.39 -0.03 0.00 -0.94 0.00 0.00 52.86 52.05 3hs0 s ASN 187 Cb -0.12 0.56 -0.03 0.00 -2.00 0.00 0.00 41.25 39.66 3hs0 s ASN 187 CO 0.17 -1.00 -0.03 -0.47 -2.94 0.00 0.00 177.10 172.83 3hs0 s TYR 188 N -3.84 3.04 -0.14 1.54 5.04 -0.13 -4.99 117.35 117.87 3hs0 s TYR 188 Ca 0.07 -0.17 0.02 0.00 -2.44 0.00 0.00 57.07 54.55 3hs0 s TYR 188 Cb -0.00 -1.91 0.00 0.00 0.35 0.00 0.00 41.96 40.40 3hs0 s TYR 188 CO -0.06 0.09 -0.19 0.99 -1.34 0.00 0.00 175.55 175.04 3hs0 s THR 189 N 0.04 2.35 0.26 4.34 2.01 -1.26 -0.94 115.64 122.44 3hs0 s THR 189 Ca 0.01 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.19 3hs0 s THR 189 Cb -0.13 -1.95 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 3hs0 s THR 189 CO 0.03 0.54 0.16 0.00 -0.69 0.00 0.00 174.62 174.65 3hs0 s ALA 190 N 0.68 3.52 0.11 7.40 0.00 0.76 -4.96 121.76 129.27 3hs0 s ALA 190 Ca -0.09 -1.50 0.08 0.00 0.00 0.00 0.00 51.96 50.44 3hs0 s ALA 190 Cb -0.16 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 3hs0 s ALA 190 CO 0.02 0.23 -0.19 0.71 0.00 0.00 0.00 175.76 176.52 3hs0 s TYR 191 N -2.20 1.68 -0.11 0.00 2.02 -1.26 -1.09 117.35 116.40 3hs0 s TYR 191 Ca 0.33 -0.44 -0.19 0.00 -0.37 0.00 0.00 57.07 56.40 3hs0 s TYR 191 Cb -0.07 -0.91 0.04 0.00 -0.40 0.00 0.00 41.96 40.63 3hs0 s TYR 191 CO 0.24 0.20 0.47 -0.59 -1.57 0.00 0.00 175.55 174.30 3hs0 s PHE 192 N -1.40 -0.46 0.06 2.71 -0.12 -0.97 -4.88 117.98 112.92 3hs0 s PHE 192 Ca 0.07 0.97 -0.14 0.00 -0.05 0.00 0.00 56.93 57.78 3hs0 s PHE 192 Cb -0.09 0.20 -0.06 0.00 -0.63 0.00 0.00 43.02 42.44 3hs0 s PHE 192 CO 0.04 -0.36 0.46 -0.51 -0.05 0.00 0.00 175.22 174.80 3hs0 s ASP 193 N -0.48 6.81 -0.19 1.98 1.01 -0.24 -0.48 116.67 125.09 3hs0 s ASP 193 Ca -0.06 0.99 -0.00 0.00 0.71 0.00 0.00 52.55 54.19 3hs0 s ASP 193 Cb -0.03 -2.26 0.01 0.00 1.01 0.00 0.00 42.92 41.65 3hs0 s ASP 193 CO 0.04 0.24 -0.16 -0.69 0.21 0.00 0.00 175.17 174.81 3hs0 s VAL 194 N -1.24 2.45 0.03 -1.27 1.01 0.12 -0.14 120.40 121.37 3hs0 s VAL 194 Ca 0.30 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 3hs0 s VAL 194 Cb -0.16 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 3hs0 s VAL 194 CO 0.16 0.51 0.04 -0.13 0.00 0.00 0.00 175.10 175.68 3hs0 s ARG 195 N 1.29 0.51 -1.28 2.72 1.81 -0.36 -1.56 118.95 122.07 3hs0 s ARG 195 Ca 0.04 -0.77 -0.08 0.00 -1.72 0.00 0.00 55.73 53.20 3hs0 s ARG 195 Cb -0.14 0.19 0.16 0.00 -0.45 0.00 0.00 34.95 34.72 3hs0 s ARG 195 CO -0.09 -0.11 2.01 1.63 -0.68 0.00 0.00 175.30 178.06 3hs0 n LYS 196 N 0.93 3.97 -4.75 3.54 5.02 -1.26 -4.10 118.16 121.50 3hs0 n LYS 196 Ca -0.20 -3.56 -0.33 0.00 -2.02 0.00 0.00 58.31 52.20 3hs0 n LYS 196 Cb 0.58 -2.81 -0.13 0.00 -0.02 0.00 0.00 35.03 32.64 3hs0 n LYS 196 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3hs0 s TYR 197 N -0.28 2.82 -0.10 2.13 5.04 -1.26 -5.11 117.35 120.59 3hs0 s TYR 197 Ca 0.43 -0.34 -0.11 0.00 -2.44 0.00 0.00 57.07 54.61 3hs0 s TYR 197 Cb 0.12 -1.76 -0.05 0.00 0.35 0.00 0.00 41.96 40.62 3hs0 s TYR 197 CO -0.02 0.02 0.25 0.08 -1.34 0.00 0.00 175.55 174.54 3hs0 s VAL 198 N -0.18 5.32 -0.05 3.14 1.01 -1.26 -4.94 120.40 123.43 3hs0 s VAL 198 Ca 0.01 0.47 -0.30 0.00 0.00 0.00 0.00 61.98 62.16 3hs0 s VAL 198 Cb -0.13 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 3hs0 s VAL 198 CO 0.03 0.55 1.18 -0.76 0.00 0.00 0.00 175.10 176.11 3hs0 s LEU 199 N -0.66 4.28 1.04 3.92 1.43 -1.26 -5.00 118.68 122.43 3hs0 s LEU 199 Ca 0.17 1.80 -0.12 0.00 -1.03 0.00 0.00 54.13 54.96 3hs0 s LEU 199 Cb -0.14 -3.56 0.22 0.00 0.03 0.00 0.00 46.19 42.74 3hs0 s LEU 199 CO 0.06 -0.57 1.07 -2.84 0.23 0.00 0.00 176.35 174.31 3hs0 s PRO 200 N 2.13 0.04 0.00 1.29 0.02 -1.26 -4.95 135.00 132.27 3hs0 s PRO 200 Ca 0.55 0.98 0.25 0.00 0.02 0.00 0.00 61.00 62.81 3hs0 s PRO 200 Cb -0.24 -1.65 0.50 0.00 0.02 0.00 0.00 34.50 33.12 3hs0 s PRO 200 CO 0.22 -3.12 1.41 -1.13 -0.33 0.00 0.00 177.00 174.05 3hs0 n SER 201 N -4.51 1.41 -4.02 2.53 3.41 -1.26 -4.89 113.62 106.29 3hs0 n SER 201 Ca 0.06 -1.14 -0.08 0.00 -0.26 0.00 0.00 58.87 57.45 3hs0 n SER 201 Cb 0.54 0.25 -0.09 0.00 -0.26 0.00 0.00 64.21 64.64 3hs0 n SER 201 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3hs0 s PHE 202 N -2.47 0.40 0.07 7.33 -0.12 -1.26 -2.15 117.98 119.78 3hs0 s PHE 202 Ca 0.23 -0.89 0.02 0.00 -0.05 0.00 0.00 56.93 56.24 3hs0 s PHE 202 Cb 0.19 -0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 3hs0 s PHE 202 CO 0.53 -0.40 0.09 -2.00 -0.05 0.00 0.00 175.22 173.39 3hs0 s GLU 203 N -3.66 2.96 -0.19 1.99 2.12 0.66 -4.88 118.70 117.70 3hs0 s GLU 203 Ca 0.04 -0.64 -0.00 0.00 0.36 0.00 0.00 54.97 54.73 3hs0 s GLU 203 Cb 0.06 -2.77 0.05 0.00 0.26 0.00 0.00 34.13 31.72 3hs0 s GLU 203 CO -0.09 0.58 -0.06 0.08 -0.54 0.00 0.00 175.26 175.23 3hs0 s VAL 204 N -1.37 1.26 -0.15 3.70 1.01 -1.26 -2.26 120.40 121.32 3hs0 s VAL 204 Ca 0.29 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.38 3hs0 s VAL 204 Cb -0.12 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 3hs0 s VAL 204 CO 0.21 0.06 0.09 -0.13 0.00 0.00 0.00 175.10 175.34 3hs0 s ARG 205 N 1.55 3.66 0.03 2.72 0.52 -0.27 -4.97 118.95 122.20 3hs0 s ARG 205 Ca -0.01 -0.25 0.05 0.00 -0.52 0.00 0.00 55.73 54.99 3hs0 s ARG 205 Cb -0.16 -3.17 -0.03 0.00 0.52 0.00 0.00 34.95 32.10 3hs0 s ARG 205 CO -0.07 0.53 -0.10 -0.51 0.02 0.00 0.00 175.30 175.17 3hs0 s LEU 206 N -0.34 3.03 -0.30 2.53 1.43 -1.26 -1.49 118.68 122.28 3hs0 s LEU 206 Ca 0.10 -0.25 -0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3hs0 s LEU 206 Cb -0.12 -1.77 0.11 0.00 0.03 0.00 0.00 46.19 44.44 3hs0 s LEU 206 CO 0.01 0.26 0.16 -1.58 0.23 0.00 0.00 176.35 175.43 3hs0 s GLN 207 N -1.58 0.24 0.55 1.70 2.00 -0.56 -4.99 119.66 117.01 3hs0 s GLN 207 Ca 0.18 -0.57 -0.20 0.00 -2.00 0.00 0.00 55.36 52.76 3hs0 s GLN 207 Cb -0.11 -1.12 -0.05 0.00 0.80 0.00 0.00 33.01 32.53 3hs0 s GLN 207 CO 0.08 -1.04 1.18 -1.25 -0.50 0.00 0.00 175.29 173.76 3hs0 s PRO 208 N 2.02 3.26 0.51 1.67 0.04 -1.26 -1.80 135.00 139.44 3hs0 s PRO 208 Ca 0.10 1.77 0.27 0.00 0.04 0.00 0.00 61.00 63.17 3hs0 s PRO 208 Cb -0.16 -2.06 1.36 0.00 0.04 0.00 0.00 34.50 33.68 3hs0 s PRO 208 CO -0.32 -0.96 2.03 0.66 0.04 0.00 0.00 177.00 178.45 3hs0 h SER 209 N 1.24 0.00 -5.16 6.66 4.64 -1.33 -3.44 113.55 116.16 3hs0 h SER 209 Ca -0.50 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.76 3hs0 h SER 209 Cb 1.28 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.25 3hs0 h SER 209 CO 0.57 0.14 -0.13 -1.61 -0.87 0.00 0.00 176.83 174.93 3hs0 s GLU 210 N -4.11 1.27 0.00 4.77 0.41 -1.26 -5.01 118.70 114.77 3hs0 s GLU 210 Ca -0.02 -0.99 0.26 0.00 -0.41 0.00 0.00 54.97 53.80 3hs0 s GLU 210 Cb 0.13 0.46 1.01 0.00 -1.78 0.00 0.00 34.13 33.94 3hs0 s GLU 210 CO 0.59 -0.51 1.71 1.63 -0.49 0.00 0.00 175.26 178.20 3hs0 n LYS 211 N -0.28 1.64 -4.06 1.61 4.01 -1.26 -4.92 118.16 114.90 3hs0 n LYS 211 Ca -0.09 -0.94 -0.11 0.00 -0.51 0.00 0.00 58.31 56.66 3hs0 n LYS 211 Cb 0.63 -1.45 -0.06 0.00 -0.51 0.00 0.00 35.03 33.63 3hs0 n LYS 211 CO 0.00 0.00 0.00 -0.59 -1.11 0.00 0.00 177.40 175.70 3hs0 s PHE 212 N -1.94 0.68 -0.06 2.13 -0.12 -1.26 -3.92 117.98 113.50 3hs0 s PHE 212 Ca 0.37 -0.98 -0.02 0.00 -0.05 0.00 0.00 56.93 56.24 3hs0 s PHE 212 Cb 0.20 -0.04 0.03 0.00 -0.63 0.00 0.00 43.02 42.58 3hs0 s PHE 212 CO 0.31 -0.94 0.03 0.12 -0.05 0.00 0.00 175.22 174.70 3hs0 s PHE 213 N -3.87 0.36 0.09 3.49 5.36 0.29 -4.91 117.98 118.79 3hs0 s PHE 213 Ca 0.28 0.05 -0.31 0.00 -0.96 0.00 0.00 56.93 55.99 3hs0 s PHE 213 Cb 0.01 -0.64 -0.08 0.00 -0.34 0.00 0.00 43.02 41.97 3hs0 s PHE 213 CO 0.12 -0.26 1.57 0.71 -1.46 0.00 0.00 175.22 175.90 3hs0 s TYR 214 N 2.07 2.71 0.51 10.12 2.02 -1.26 -0.85 117.35 132.66 3hs0 s TYR 214 Ca 0.05 0.53 0.19 0.00 -0.37 0.00 0.00 57.07 57.46 3hs0 s TYR 214 Cb -0.12 -3.88 1.30 0.00 -0.40 0.00 0.00 41.96 38.86 3hs0 s TYR 214 CO -0.04 -3.40 2.12 0.97 -1.57 0.00 0.00 175.55 173.63 3hs0 h ILE 215 N 4.59 0.93 0.00 2.71 2.10 -1.34 -3.15 117.51 123.35 3hs0 h ILE 215 Ca -0.42 -0.19 0.00 0.00 1.08 0.00 0.00 64.86 65.33 3hs0 h ILE 215 Cb 1.20 1.11 0.00 0.00 -1.09 0.00 0.00 36.82 38.04 3hs0 h ILE 215 CO 0.92 0.05 0.00 -0.90 -1.08 0.00 0.00 178.15 177.14 3hs0 n ASP 216 N -4.32 0.78 -2.81 2.19 5.68 -1.26 -4.98 116.55 111.84 3hs0 n ASP 216 Ca -0.03 -1.24 -0.07 0.00 -0.50 0.00 0.00 54.79 52.95 3hs0 n ASP 216 Cb 0.14 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.18 3hs0 n ASP 216 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hs0 n GLY 217 N -0.12 -2.71 0.03 6.12 0.00 -1.19 -4.99 105.19 102.34 3hs0 n GLY 217 Ca 0.00 -1.43 0.02 0.00 0.00 0.00 0.00 46.02 44.62 3hs0 n GLY 217 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hs0 n ASN 218 N -3.50 0.41 -4.63 1.61 5.15 -1.26 -5.06 115.26 107.98 3hs0 n ASN 218 Ca 0.04 -0.71 -0.38 0.00 -0.60 0.00 0.00 54.58 52.93 3hs0 n ASN 218 Cb 0.15 0.85 0.05 0.00 -0.53 0.00 0.00 39.78 40.30 3hs0 n ASN 218 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 3hs0 n GLU 219 N -0.91 0.96 -2.60 1.20 2.13 -1.26 -4.78 120.64 115.38 3hs0 n GLU 219 Ca 0.01 0.37 -0.22 0.00 0.66 0.00 0.00 57.16 57.99 3hs0 n GLU 219 Cb 0.09 -2.23 0.05 0.00 0.27 0.00 0.00 31.44 29.62 3hs0 n GLU 219 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 3hs0 s ASN 220 N -1.25 5.11 -0.06 4.31 0.01 -1.26 -4.43 114.94 117.36 3hs0 s ASN 220 Ca 0.76 -0.03 0.06 0.00 -0.71 0.00 0.00 52.86 52.94 3hs0 s ASN 220 Cb -0.41 -0.77 -0.01 0.00 0.41 0.00 0.00 41.25 40.47 3hs0 s ASN 220 CO 0.46 -1.28 -0.24 0.12 -1.51 0.00 0.00 177.10 174.65 3hs0 s PHE 221 N -2.85 2.40 0.03 2.20 5.36 -0.93 -5.00 117.98 119.19 3hs0 s PHE 221 Ca 0.59 -0.77 0.09 0.00 -0.96 0.00 0.00 56.93 55.88 3hs0 s PHE 221 Cb -0.10 -1.58 -0.03 0.00 -0.34 0.00 0.00 43.02 40.98 3hs0 s PHE 221 CO 0.40 -0.25 -0.26 -1.01 -1.46 0.00 0.00 175.22 172.64 3hs0 s HIS 222 N -0.05 2.27 -0.23 10.12 3.76 -1.26 -0.78 115.29 129.12 3hs0 s HIS 222 Ca -0.07 -0.41 0.01 0.00 -0.15 0.00 0.00 55.06 54.44 3hs0 s HIS 222 Cb -0.14 -1.38 0.06 0.00 1.11 0.00 0.00 32.58 32.22 3hs0 s HIS 222 CO 0.05 0.09 -0.06 0.08 -0.85 0.00 0.00 174.74 174.05 3hs0 s VAL 223 N -0.76 1.50 0.13 -0.90 1.01 -0.26 -0.74 120.40 120.38 3hs0 s VAL 223 Ca 0.11 -1.16 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 3hs0 s VAL 223 Cb -0.10 -1.75 -0.06 0.00 0.00 0.00 0.00 36.38 34.47 3hs0 s VAL 223 CO 0.01 -0.07 0.93 -0.44 0.00 0.00 0.00 175.10 175.53 3hs0 s SER 224 N 1.42 7.49 -0.10 3.32 0.01 -0.74 -1.67 113.70 123.42 3hs0 s SER 224 Ca -0.05 1.78 0.02 0.00 1.31 0.00 0.00 55.95 59.01 3hs0 s SER 224 Cb -0.18 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.46 3hs0 s SER 224 CO -0.06 -0.01 -0.17 -0.63 0.41 0.00 0.00 173.24 172.78 3hs0 s ILE 225 N -0.24 2.74 -0.09 1.44 1.01 0.19 -1.50 121.20 124.75 3hs0 s ILE 225 Ca 0.45 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 60.32 3hs0 s ILE 225 Cb -0.23 -2.10 0.01 0.00 0.01 0.00 0.00 42.46 40.15 3hs0 s ILE 225 CO 0.29 0.55 -0.15 0.42 0.00 0.00 0.00 174.94 176.05 3hs0 s THR 226 N 0.06 1.42 -0.28 2.92 -4.23 -0.56 -0.09 115.64 114.87 3hs0 s THR 226 Ca -0.07 -0.62 0.03 0.00 -1.18 0.00 0.00 61.69 59.85 3hs0 s THR 226 Cb -0.15 -1.29 0.07 0.00 1.34 0.00 0.00 72.50 72.48 3hs0 s THR 226 CO 0.05 0.42 -0.05 0.00 -0.54 0.00 0.00 174.62 174.50 3hs0 s ALA 227 N 0.80 2.60 0.06 3.99 0.00 0.53 -1.11 121.76 128.63 3hs0 s ALA 227 Ca -0.11 -1.97 0.08 0.00 0.00 0.00 0.00 51.96 49.96 3hs0 s ALA 227 Cb -0.16 -1.70 -0.03 0.00 0.00 0.00 0.00 23.12 21.24 3hs0 s ALA 227 CO 0.02 -1.36 -0.20 1.03 0.00 0.00 0.00 175.76 175.25 3hs0 s ARG 228 N 1.08 1.94 0.80 0.00 0.52 -0.96 -0.92 118.95 121.40 3hs0 s ARG 228 Ca -0.02 -1.06 -0.10 0.00 -0.52 0.00 0.00 55.73 54.02 3hs0 s ARG 228 Cb -0.20 -2.13 0.07 0.00 0.52 0.00 0.00 34.95 33.22 3hs0 s ARG 228 CO -0.06 0.52 1.10 0.71 0.02 0.00 0.00 175.30 177.58 3hs0 s TYR 229 N -0.96 2.46 -0.44 -0.53 2.02 -0.02 -0.25 117.35 119.63 3hs0 s TYR 229 Ca 0.15 1.57 0.24 0.00 -0.37 0.00 0.00 57.07 58.65 3hs0 s TYR 229 Cb -0.10 -3.08 1.01 0.00 -0.40 0.00 0.00 41.96 39.38 3hs0 s TYR 229 CO 0.06 -1.94 1.72 1.28 -1.57 0.00 0.00 175.55 175.10 3hs0 n LEU 230 N -3.62 0.69 -0.59 -1.29 4.77 -0.91 -1.63 117.00 114.41 3hs0 n LEU 230 Ca 0.09 0.68 0.12 0.00 -0.03 0.00 0.00 56.01 56.87 3hs0 n LEU 230 Cb 0.53 -0.59 0.14 0.00 -2.33 0.00 0.00 43.42 41.17 3hs0 n LEU 230 CO 0.53 -0.60 0.51 0.00 -1.33 0.00 0.00 177.39 176.51 3hs0 n TYR 231 N -2.27 0.00 0.00 -1.77 0.18 -1.26 -4.95 117.16 107.08 3hs0 n TYR 231 Ca 0.02 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.80 3hs0 n TYR 231 Cb 0.22 -0.02 0.00 0.00 -0.38 0.00 0.00 39.34 39.16 3hs0 n TYR 231 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3hs0 n GLY 232 N 1.36 0.57 3.81 -7.48 0.00 -0.65 -5.11 105.19 97.69 3hs0 n GLY 232 Ca 0.12 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 3hs0 n GLY 232 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hs0 s GLU 233 N 0.00 2.85 0.43 1.61 0.41 -1.26 -4.65 118.70 118.10 3hs0 s GLU 233 Ca 0.00 1.05 -0.22 0.00 -0.41 0.00 0.00 54.97 55.38 3hs0 s GLU 233 Cb 0.00 -1.98 -0.09 0.00 -1.78 0.00 0.00 34.13 30.28 3hs0 s GLU 233 CO 0.00 -1.17 1.03 -1.21 -0.49 0.00 0.00 175.26 173.42 3hs0 s GLU 234 N -4.85 4.05 -0.13 1.61 0.41 -1.26 -0.84 118.70 117.69 3hs0 s GLU 234 Ca 0.60 1.41 -0.07 0.00 -0.41 0.00 0.00 54.97 56.49 3hs0 s GLU 234 Cb -0.15 -2.34 -0.04 0.00 -1.78 0.00 0.00 34.13 29.81 3hs0 s GLU 234 CO 0.52 -0.22 0.12 0.08 -0.49 0.00 0.00 175.26 175.27 3hs0 s VAL 235 N -1.83 5.37 -0.01 2.63 1.01 -0.09 -4.77 120.40 122.71 3hs0 s VAL 235 Ca 0.62 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.77 3hs0 s VAL 235 Cb -0.18 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 3hs0 s VAL 235 CO 0.23 0.59 -0.01 -0.70 0.00 0.00 0.00 175.10 175.21 3hs0 s GLU 236 N -0.76 2.77 0.00 2.72 2.12 -1.26 -1.82 118.70 122.46 3hs0 s GLU 236 Ca 0.13 -0.61 0.00 0.00 0.36 0.00 0.00 54.97 54.85 3hs0 s GLU 236 Cb -0.12 -2.65 0.00 0.00 0.26 0.00 0.00 34.13 31.62 3hs0 s GLU 236 CO 0.03 0.63 0.00 0.41 -0.54 0.00 0.00 175.26 175.78 3hs0 n GLY 237 N 1.47 -0.70 3.17 -1.50 0.00 0.17 -1.55 105.19 106.25 3hs0 n GLY 237 Ca -0.15 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 3hs0 n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hs0 s VAL 238 N -3.16 0.00 -0.02 1.61 1.01 -0.68 -1.50 120.40 117.67 3hs0 s VAL 238 Ca 0.00 -0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.01 3hs0 s VAL 238 Cb 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.95 3hs0 s VAL 238 CO 0.00 -0.02 -0.20 0.00 0.00 0.00 0.00 175.10 174.89 3hs0 s ALA 239 N 0.06 2.45 -0.23 5.51 0.00 0.17 -1.54 121.76 128.19 3hs0 s ALA 239 Ca -0.01 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 3hs0 s ALA 239 Cb -0.02 -0.75 0.01 0.00 0.00 0.00 0.00 23.12 22.36 3hs0 s ALA 239 CO 0.01 0.55 -0.07 -0.06 0.00 0.00 0.00 175.76 176.19 3hs0 s PHE 240 N -0.73 2.99 -0.04 0.00 0.08 0.12 -0.31 117.98 120.08 3hs0 s PHE 240 Ca 0.12 -1.32 0.06 0.00 0.12 0.00 0.00 56.93 55.91 3hs0 s PHE 240 Cb -0.10 -2.07 -0.02 0.00 -0.57 0.00 0.00 43.02 40.26 3hs0 s PHE 240 CO 0.01 -0.67 -0.22 0.08 -0.10 0.00 0.00 175.22 174.32 3hs0 s VAL 241 N 1.38 2.35 -0.05 -0.44 1.01 -0.60 -0.91 120.40 123.14 3hs0 s VAL 241 Ca 0.03 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.03 3hs0 s VAL 241 Cb -0.15 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.39 3hs0 s VAL 241 CO -0.05 0.58 -0.03 -0.22 0.00 0.00 0.00 175.10 175.38 3hs0 s LEU 242 N -0.49 1.14 0.22 3.92 2.96 -0.26 -1.24 118.68 124.93 3hs0 s LEU 242 Ca 0.06 -0.10 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 3hs0 s LEU 242 Cb -0.11 -0.41 -0.03 0.00 0.50 0.00 0.00 46.19 46.14 3hs0 s LEU 242 CO 0.01 -0.09 0.35 -0.36 -1.32 0.00 0.00 176.35 174.93 3hs0 s PHE 243 N 1.16 3.46 0.16 5.38 0.08 -1.26 0.00 117.98 126.97 3hs0 s PHE 243 Ca -0.07 0.02 -0.23 0.00 0.12 0.00 0.00 56.93 56.77 3hs0 s PHE 243 Cb -0.14 -1.60 0.08 0.00 -0.57 0.00 0.00 43.02 40.79 3hs0 s PHE 243 CO -0.01 0.45 1.05 0.20 -0.10 0.00 0.00 175.22 176.80 3hs0 s GLY 244 N -3.80 0.02 -0.08 4.36 0.00 -0.55 -0.93 107.32 106.33 3hs0 s GLY 244 Ca 0.34 -0.19 0.04 0.00 0.00 0.00 0.00 44.72 44.92 3hs0 s GLY 244 CO 0.29 2.05 -0.23 0.14 0.00 0.00 0.00 173.10 175.35 3hs0 s VAL 245 N -2.37 2.21 -0.65 1.40 1.01 0.01 -1.35 120.40 120.66 3hs0 s VAL 245 Ca 0.20 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.24 3hs0 s VAL 245 Cb -0.02 -1.83 0.19 0.00 0.00 0.00 0.00 36.38 34.71 3hs0 s VAL 245 CO 0.04 0.56 0.53 1.17 0.00 0.00 0.00 175.10 177.40 3hs0 n LYS 246 N 3.21 1.75 0.00 2.72 4.81 -0.45 -1.73 118.16 128.48 3hs0 n LYS 246 Ca -0.18 -4.35 0.00 0.00 -0.87 0.00 0.00 58.31 52.91 3hs0 n LYS 246 Cb 0.52 -2.18 0.00 0.00 0.02 0.00 0.00 35.03 33.39 3hs0 n LYS 246 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 3hs0 n ILE 247 N 1.83 0.00 -0.04 3.15 5.41 -1.23 -3.93 119.36 124.56 3hs0 n ILE 247 Ca 0.23 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.91 3hs0 n ILE 247 Cb 0.38 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.28 3hs0 n ILE 247 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 3hs0 n ASP 248 N 0.00 1.32 -2.62 4.38 -0.08 -1.26 -4.62 116.55 113.67 3hs0 n ASP 248 Ca 0.00 0.05 -0.05 0.00 -1.51 0.00 0.00 54.79 53.29 3hs0 n ASP 248 Cb 0.00 -0.18 0.05 0.00 2.34 0.00 0.00 41.12 43.33 3hs0 n ASP 248 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 3hs0 n ASP 249 N -3.15 -1.44 -4.05 1.67 4.64 -1.26 -5.11 116.55 107.85 3hs0 n ASP 249 Ca -0.14 -2.00 -0.25 0.00 -1.38 0.00 0.00 54.79 51.03 3hs0 n ASP 249 Cb 0.61 0.94 -0.16 0.00 -1.04 0.00 0.00 41.12 41.47 3hs0 n ASP 249 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3hs0 s ALA 250 N 0.11 1.30 -0.20 -1.67 0.00 -1.26 -5.14 121.76 114.89 3hs0 s ALA 250 Ca 0.12 -0.48 -0.08 0.00 0.00 0.00 0.00 51.96 51.52 3hs0 s ALA 250 Cb 0.23 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 3hs0 s ALA 250 CO -0.05 0.16 0.09 0.15 0.00 0.00 0.00 175.76 176.10 3hs0 s LYS 251 N 0.48 3.97 -0.27 0.00 1.02 -1.26 -3.53 119.74 120.15 3hs0 s LYS 251 Ca -0.12 -0.34 -0.05 0.00 0.02 0.00 0.00 55.97 55.49 3hs0 s LYS 251 Cb -0.14 -3.31 0.01 0.00 -0.52 0.00 0.00 37.83 33.86 3hs0 s LYS 251 CO 0.03 0.17 0.03 0.15 -0.92 0.00 0.00 175.35 174.81 3hs0 s LYS 252 N 0.68 3.13 0.36 1.68 1.02 -0.70 -5.01 119.74 120.90 3hs0 s LYS 252 Ca 0.05 -0.81 -0.12 0.00 0.02 0.00 0.00 55.97 55.11 3hs0 s LYS 252 Cb -0.13 -3.22 -0.07 0.00 -0.52 0.00 0.00 37.83 33.89 3hs0 s LYS 252 CO 0.02 -0.37 0.73 -1.54 -0.92 0.00 0.00 175.35 173.27 3hs0 s SER 253 N 1.47 6.61 -1.05 2.83 1.04 -1.26 -0.81 113.70 122.52 3hs0 s SER 253 Ca 0.03 1.15 -0.08 0.00 0.48 0.00 0.00 55.95 57.53 3hs0 s SER 253 Cb -0.16 -2.32 0.26 0.00 0.10 0.00 0.00 66.02 63.90 3hs0 s SER 253 CO 0.00 -0.30 1.03 -0.63 0.98 0.00 0.00 173.24 174.32 3hs0 s ILE 254 N -2.18 5.66 0.42 -1.02 1.01 -0.11 -4.92 121.20 120.05 3hs0 s ILE 254 Ca 0.52 -3.47 0.16 0.00 0.00 0.00 0.00 60.65 57.86 3hs0 s ILE 254 Cb -0.10 -4.42 0.36 0.00 0.01 0.00 0.00 42.46 38.31 3hs0 s ILE 254 CO 0.26 -1.16 1.89 -0.65 0.00 0.00 0.00 174.94 175.28 3hs0 h PRO 255 N 6.59 0.43 -0.08 2.79 0.11 -1.96 0.97 132.00 140.86 3hs0 h PRO 255 Ca 0.17 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3hs0 h PRO 255 Cb 0.87 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.88 3hs0 h PRO 255 CO 0.97 0.29 0.00 -0.25 -0.21 0.00 0.00 178.00 178.79 3hs0 n ASP 256 N -4.50 0.08 -0.28 -2.05 8.00 -1.26 -2.95 116.55 113.59 3hs0 n ASP 256 Ca 0.16 -1.96 0.06 0.00 0.71 0.00 0.00 54.79 53.76 3hs0 n ASP 256 Cb 0.58 -0.04 -0.00 0.00 -0.02 0.00 0.00 41.12 41.64 3hs0 n ASP 256 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3hs0 n SER 257 N -0.46 1.36 -4.67 -2.24 3.41 0.34 -4.96 113.62 106.41 3hs0 n SER 257 Ca 0.00 -1.18 -0.43 0.00 -0.26 0.00 0.00 58.87 57.00 3hs0 n SER 257 Cb 0.02 0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 64.41 3hs0 n SER 257 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3hs0 n LEU 258 N -0.21 4.10 -3.86 1.04 7.94 -1.15 -4.57 117.00 120.29 3hs0 n LEU 258 Ca 0.05 0.92 -0.17 0.00 -1.11 0.00 0.00 56.01 55.70 3hs0 n LEU 258 Cb 0.26 -1.52 -0.16 0.00 0.53 0.00 0.00 43.42 42.53 3hs0 n LEU 258 CO 0.15 0.18 -0.39 0.28 -1.11 0.00 0.00 177.39 176.51 3hs0 s THR 259 N 4.10 0.29 -0.24 1.96 -1.32 -0.38 -4.98 115.64 115.07 3hs0 s THR 259 Ca 0.88 -0.01 -0.18 0.00 -1.21 0.00 0.00 61.69 61.17 3hs0 s THR 259 Cb -0.46 -0.34 -0.03 0.00 -1.51 0.00 0.00 72.50 70.16 3hs0 s THR 259 CO 0.42 0.15 0.51 -0.60 -2.21 0.00 0.00 174.62 172.89 3hs0 s ARG 260 N 0.77 4.10 0.11 7.08 3.52 -1.26 -1.56 118.95 131.72 3hs0 s ARG 260 Ca -0.08 0.34 0.09 0.00 -0.13 0.00 0.00 55.73 55.94 3hs0 s ARG 260 Cb -0.12 -3.62 -0.04 0.00 -1.56 0.00 0.00 34.95 29.61 3hs0 s ARG 260 CO -0.01 -0.29 -0.22 0.96 -0.81 0.00 0.00 175.30 174.93 3hs0 s ILE 261 N 2.09 1.82 0.14 4.11 -4.36 0.57 -4.97 121.20 120.60 3hs0 s ILE 261 Ca 0.22 -1.58 -0.30 0.00 -0.26 0.00 0.00 60.65 58.73 3hs0 s ILE 261 Cb -0.16 -1.64 -0.07 0.00 1.25 0.00 0.00 42.46 41.85 3hs0 s ILE 261 CO 0.09 -0.03 1.03 -2.84 0.24 0.00 0.00 174.94 173.44 3hs0 s PRO 262 N -1.92 4.64 -0.44 0.37 0.02 -1.26 0.43 135.00 136.85 3hs0 s PRO 262 Ca 0.08 1.58 -0.17 0.00 0.02 0.00 0.00 61.00 62.51 3hs0 s PRO 262 Cb -0.10 -3.33 0.03 0.00 0.02 0.00 0.00 34.50 31.12 3hs0 s PRO 262 CO 0.05 0.14 0.46 0.42 -0.33 0.00 0.00 177.00 177.73 3hs0 s ILE 263 N -0.08 5.07 -0.08 2.83 -1.09 -0.56 -4.67 121.20 122.62 3hs0 s ILE 263 Ca 0.48 -0.43 0.04 0.00 -2.23 0.00 0.00 60.65 58.52 3hs0 s ILE 263 Cb -0.26 -4.08 -0.01 0.00 -1.58 0.00 0.00 42.46 36.53 3hs0 s ILE 263 CO 0.32 -0.48 -0.20 -0.63 -1.23 0.00 0.00 174.94 172.72 3hs0 s ILE 264 N 2.15 2.49 -0.65 2.92 -1.09 -0.87 -0.65 121.20 125.50 3hs0 s ILE 264 Ca 0.12 -0.90 -0.08 0.00 -2.23 0.00 0.00 60.65 57.56 3hs0 s ILE 264 Cb -0.18 -1.96 0.08 0.00 -1.58 0.00 0.00 42.46 38.82 3hs0 s ILE 264 CO 0.13 0.56 0.21 0.47 -1.23 0.00 0.00 174.94 175.08 3hs0 n ASP 265 N 3.00 -1.31 0.00 3.58 9.92 -1.26 -1.11 116.55 129.36 3hs0 n ASP 265 Ca -0.18 -0.10 0.00 0.00 -0.53 0.00 0.00 54.79 53.99 3hs0 n ASP 265 Cb 0.52 -1.22 0.00 0.00 -0.64 0.00 0.00 41.12 39.78 3hs0 n ASP 265 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hs0 n GLY 266 N -0.69 2.88 3.92 0.44 0.00 -0.75 -4.78 105.19 106.20 3hs0 n GLY 266 Ca 0.04 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.38 3hs0 n GLY 266 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hs0 s ASP 267 N 0.42 6.40 0.10 1.61 1.01 -0.27 -0.34 116.67 125.59 3hs0 s ASP 267 Ca 0.00 0.61 -0.24 0.00 0.71 0.00 0.00 52.55 53.63 3hs0 s ASP 267 Cb 0.00 -2.10 0.06 0.00 1.01 0.00 0.00 42.92 41.90 3hs0 s ASP 267 CO 0.00 -0.20 0.59 -0.83 0.21 0.00 0.00 175.17 174.94 3hs0 s GLY 268 N -3.38 -0.56 -0.09 0.21 0.00 0.87 -2.04 107.32 102.32 3hs0 s GLY 268 Ca 0.42 0.64 -0.03 0.00 0.00 0.00 0.00 44.72 45.75 3hs0 s GLY 268 CO 0.32 0.32 0.16 1.25 0.00 0.00 0.00 173.10 175.14 3hs0 s LYS 269 N -3.02 0.04 -0.11 2.90 2.20 -1.26 0.55 119.74 121.04 3hs0 s LYS 269 Ca -0.02 0.52 -0.03 0.00 -0.36 0.00 0.00 55.97 56.08 3hs0 s LYS 269 Cb -0.01 -0.38 -0.03 0.00 -1.51 0.00 0.00 37.83 35.91 3hs0 s LYS 269 CO -0.06 -0.34 -0.00 0.00 -0.36 0.00 0.00 175.35 174.58 3hs0 s ALA 270 N 2.29 3.23 -0.05 3.13 0.00 -0.67 -4.97 121.76 124.71 3hs0 s ALA 270 Ca 0.03 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.25 3hs0 s ALA 270 Cb -0.12 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.47 3hs0 s ALA 270 CO -0.06 0.48 -0.25 0.99 0.00 0.00 0.00 175.76 176.92 3hs0 s THR 271 N -0.53 2.03 -0.33 0.00 2.01 -1.26 -1.11 115.64 116.46 3hs0 s THR 271 Ca 0.09 -1.06 -0.12 0.00 0.31 0.00 0.00 61.69 60.91 3hs0 s THR 271 Cb -0.12 -1.72 -0.02 0.00 0.01 0.00 0.00 72.50 70.66 3hs0 s THR 271 CO 0.02 0.57 0.22 -0.22 -0.69 0.00 0.00 174.62 174.51 3hs0 s LEU 272 N -0.18 4.40 0.13 4.42 2.96 0.04 -5.01 118.68 125.44 3hs0 s LEU 272 Ca -0.03 -0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 53.14 3hs0 s LEU 272 Cb -0.13 -2.10 -0.07 0.00 0.50 0.00 0.00 46.19 44.39 3hs0 s LEU 272 CO 0.03 -0.22 1.12 -0.54 -1.32 0.00 0.00 176.35 175.42 3hs0 s LYS 273 N 1.70 4.54 0.49 1.98 -0.14 -1.26 -2.18 119.74 124.87 3hs0 s LYS 273 Ca 0.06 1.71 0.17 0.00 -1.36 0.00 0.00 55.97 56.55 3hs0 s LYS 273 Cb -0.17 -3.31 1.20 0.00 -1.68 0.00 0.00 37.83 33.87 3hs0 s LYS 273 CO 0.09 -0.03 2.04 -0.09 -0.76 0.00 0.00 175.35 176.60 3hs0 h ARG 274 N 5.72 0.17 0.30 1.68 9.65 -1.87 -1.78 114.38 128.25 3hs0 h ARG 274 Ca -0.43 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.42 3hs0 h ARG 274 Cb 1.21 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.76 3hs0 h ARG 274 CO 0.75 0.11 -0.14 -0.44 2.80 0.00 0.00 179.97 183.05 3hs0 h ASP 275 N 0.18 -0.34 -0.28 -3.80 3.32 -1.93 -1.07 116.42 112.51 3hs0 h ASP 275 Ca 0.18 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3hs0 h ASP 275 Cb 0.49 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 3hs0 h ASP 275 CO -0.03 -0.18 0.18 0.74 -1.72 0.00 0.00 179.24 178.23 3hs0 h THR 276 N -0.47 1.07 0.29 0.35 2.02 -1.75 -1.69 112.91 112.73 3hs0 h THR 276 Ca -0.04 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 3hs0 h THR 276 Cb 0.36 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 3hs0 h THR 276 CO 0.07 0.07 -0.14 0.15 0.37 0.00 0.00 175.52 176.04 3hs0 h PHE 277 N 0.38 -0.36 -0.77 3.16 3.57 -1.04 -2.83 116.94 119.04 3hs0 h PHE 277 Ca 0.10 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.69 3hs0 h PHE 277 Cb -0.04 0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.76 3hs0 h PHE 277 CO 0.00 -0.04 0.51 0.00 -2.23 0.00 0.00 178.31 176.55 3hs0 h ARG 278 N -0.70 0.65 -0.76 1.11 3.08 -0.87 0.88 114.38 117.76 3hs0 h ARG 278 Ca -0.04 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3hs0 h ARG 278 Cb 0.48 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.35 3hs0 h ARG 278 CO 0.07 0.43 0.48 0.77 -1.07 0.00 0.00 179.97 180.65 3hs0 h SER 279 N 0.67 0.90 0.57 7.04 0.02 -1.25 -3.11 113.55 118.38 3hs0 h SER 279 Ca 0.36 -0.05 -0.29 0.00 -0.84 0.00 0.00 61.79 60.98 3hs0 h SER 279 Cb 0.49 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 3hs0 h SER 279 CO -0.13 0.68 -1.38 -0.09 -1.14 0.00 0.00 176.83 174.77 3hs0 h ARG 280 N 1.04 0.24 -3.08 3.45 9.65 -1.05 -3.42 114.38 121.21 3hs0 h ARG 280 Ca 0.28 -0.40 -0.62 0.00 -1.10 0.00 0.00 59.98 58.14 3hs0 h ARG 280 Cb -0.07 0.15 -0.40 0.00 -1.39 0.00 0.00 29.97 28.26 3hs0 h ARG 280 CO -0.06 1.13 -0.71 -0.06 2.80 0.00 0.00 179.97 183.07 3hs0 s PHE 281 N -2.64 2.24 -0.04 2.20 0.08 0.21 -4.96 117.98 115.07 3hs0 s PHE 281 Ca -0.06 -2.58 0.00 0.00 0.12 0.00 0.00 56.93 54.41 3hs0 s PHE 281 Cb 0.07 -2.09 -0.26 0.00 -0.57 0.00 0.00 43.02 40.17 3hs0 s PHE 281 CO 0.86 -0.77 0.68 -1.35 -0.10 0.00 0.00 175.22 174.54 3hs0 h PRO 282 N 6.69 0.18 -5.96 0.24 0.11 -1.80 -3.41 132.00 128.06 3hs0 h PRO 282 Ca -0.03 -0.31 -0.60 0.00 0.11 0.00 0.00 66.00 65.17 3hs0 h PRO 282 Cb 0.92 0.12 -0.11 0.00 0.11 0.00 0.00 31.00 32.04 3hs0 h PRO 282 CO 0.53 0.97 1.19 1.21 -0.21 0.00 0.00 178.00 181.68 3hs0 s ASN 283 N -6.75 6.39 0.57 -2.05 3.84 -1.26 -4.86 114.94 110.81 3hs0 s ASN 283 Ca -0.11 -1.21 0.31 0.00 0.21 0.00 0.00 52.86 52.05 3hs0 s ASN 283 Cb 0.07 -2.53 1.45 0.00 -0.55 0.00 0.00 41.25 39.69 3hs0 s ASN 283 CO 0.82 -1.53 1.84 -0.07 -2.79 0.00 0.00 177.10 175.37 3hs0 h LEU 284 N 12.37 0.00 -0.80 3.21 3.38 -1.94 -0.04 115.31 131.49 3hs0 h LEU 284 Ca 0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 3hs0 h LEU 284 Cb 1.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 3hs0 h LEU 284 CO 1.32 0.00 -0.21 0.78 0.09 0.00 0.00 178.44 180.42 3hs0 h ASN 285 N 0.00 0.67 -0.32 -0.43 2.35 -1.99 -2.56 115.58 113.30 3hs0 h ASN 285 Ca 0.36 -0.23 0.09 0.00 -0.55 0.00 0.00 56.30 55.97 3hs0 h ASN 285 Cb 1.65 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.82 3hs0 h ASN 285 CO -0.00 0.88 0.25 -0.08 -1.65 0.00 0.00 177.43 176.83 3hs0 h GLU 286 N 0.59 0.00 0.00 0.81 4.81 -1.41 -2.65 114.58 116.73 3hs0 h GLU 286 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3hs0 h GLU 286 Cb 0.68 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.06 3hs0 h GLU 286 CO 0.05 0.00 -0.46 -0.07 -0.73 0.00 0.00 179.01 177.80 3hs0 h LEU 287 N 0.00 0.00 -9.33 1.64 3.38 -1.57 -3.47 115.31 105.96 3hs0 h LEU 287 Ca 0.15 -0.10 -0.54 0.00 0.09 0.00 0.00 57.88 57.48 3hs0 h LEU 287 Cb 0.66 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.43 3hs0 h LEU 287 CO -0.00 0.05 1.24 0.52 0.09 0.00 0.00 178.44 180.34 3hs0 n VAL 288 N -2.38 0.74 -0.33 1.22 0.31 -1.00 -1.73 118.33 115.15 3hs0 n VAL 288 Ca 0.03 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3hs0 n VAL 288 Cb 0.47 -2.30 0.00 0.00 -0.91 0.00 0.00 33.84 31.10 3hs0 n VAL 288 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hs0 n GLY 289 N 4.61 0.77 3.95 2.92 0.00 -1.26 -5.07 105.19 111.12 3hs0 n GLY 289 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 3hs0 n GLY 289 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hs0 s HIS 290 N -2.25 1.44 0.27 1.61 4.02 -0.70 -4.99 115.29 114.69 3hs0 s HIS 290 Ca 0.00 -0.84 0.05 0.00 1.02 0.00 0.00 55.06 55.29 3hs0 s HIS 290 Cb 0.00 -1.98 -0.06 0.00 -1.02 0.00 0.00 32.58 29.52 3hs0 s HIS 290 CO 0.00 -0.73 -0.01 0.95 1.02 0.00 0.00 174.74 175.97 3hs0 s THR 291 N -2.77 1.28 -0.16 1.30 -4.23 -1.25 -1.80 115.64 108.01 3hs0 s THR 291 Ca 0.41 -2.06 -0.01 0.00 -1.18 0.00 0.00 61.69 58.85 3hs0 s THR 291 Cb -0.03 -2.48 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 3hs0 s THR 291 CO 0.26 -0.24 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.78 3hs0 s LEU 292 N -3.39 2.80 0.22 4.79 2.96 0.36 -1.34 118.68 125.07 3hs0 s LEU 292 Ca 0.31 -0.33 0.10 0.00 -0.22 0.00 0.00 54.13 53.99 3hs0 s LEU 292 Cb 0.06 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 3hs0 s LEU 292 CO 0.11 0.11 -0.15 -0.72 -1.32 0.00 0.00 176.35 174.39 3hs0 s TYR 293 N 0.67 2.47 -0.05 5.38 -0.85 -0.45 -2.69 117.35 121.83 3hs0 s TYR 293 Ca -0.05 -0.29 0.02 0.00 -0.52 0.00 0.00 57.07 56.24 3hs0 s TYR 293 Cb -0.15 -1.17 0.01 0.00 0.38 0.00 0.00 41.96 41.03 3hs0 s TYR 293 CO 0.02 0.57 -0.11 0.00 -1.52 0.00 0.00 175.55 174.51 3hs0 s ALA 294 N -1.95 1.15 -0.25 9.51 0.00 0.21 -1.48 121.76 128.94 3hs0 s ALA 294 Ca 0.26 -0.39 -0.10 0.00 0.00 0.00 0.00 51.96 51.73 3hs0 s ALA 294 Cb -0.07 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 3hs0 s ALA 294 CO 0.14 0.13 0.14 0.45 0.00 0.00 0.00 175.76 176.61 3hs0 s SER 295 N 0.52 5.79 -0.15 0.00 0.15 0.10 -0.53 113.70 119.59 3hs0 s SER 295 Ca -0.11 -0.01 -0.00 0.00 0.70 0.00 0.00 55.95 56.54 3hs0 s SER 295 Cb -0.14 -2.05 -0.01 0.00 -1.71 0.00 0.00 66.02 62.11 3hs0 s SER 295 CO 0.03 0.02 -0.14 -0.69 1.20 0.00 0.00 173.24 173.66 3hs0 s VAL 296 N 1.32 2.87 -0.17 4.45 1.01 -0.75 -1.10 120.40 128.03 3hs0 s VAL 296 Ca 0.06 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.35 3hs0 s VAL 296 Cb -0.15 -2.21 0.02 0.00 0.00 0.00 0.00 36.38 34.04 3hs0 s VAL 296 CO 0.06 0.51 -0.19 -0.89 0.00 0.00 0.00 175.10 174.59 3hs0 s THR 297 N 0.62 1.96 -0.11 3.92 2.01 -0.08 -0.97 115.64 122.99 3hs0 s THR 297 Ca -0.08 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.07 3hs0 s THR 297 Cb -0.16 -1.78 0.01 0.00 0.01 0.00 0.00 72.50 70.58 3hs0 s THR 297 CO 0.03 0.52 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.58 3hs0 s VAL 298 N 1.27 1.91 0.01 3.82 1.01 -0.57 0.12 120.40 127.96 3hs0 s VAL 298 Ca 0.04 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 61.17 3hs0 s VAL 298 Cb -0.13 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 3hs0 s VAL 298 CO -0.11 0.52 -0.21 -0.04 0.00 0.00 0.00 175.10 175.26 3hs0 s MET 299 N 0.57 2.11 0.68 2.72 -1.94 -0.59 -1.23 119.30 121.63 3hs0 s MET 299 Ca -0.14 -0.94 -0.14 0.00 -1.71 0.00 0.00 55.69 52.76 3hs0 s MET 299 Cb -0.17 -2.14 0.01 0.00 2.01 0.00 0.00 34.83 34.55 3hs0 s MET 299 CO 0.04 0.56 1.11 0.95 -0.01 0.00 0.00 175.02 177.67 3hs0 s THR 300 N -0.77 3.18 0.57 2.05 -4.23 -0.90 -1.69 115.64 113.85 3hs0 s THR 300 Ca 0.12 0.52 0.28 0.00 -1.18 0.00 0.00 61.69 61.43 3hs0 s THR 300 Cb -0.10 -3.03 0.39 0.00 1.34 0.00 0.00 72.50 71.09 3hs0 s THR 300 CO 0.02 -0.36 1.97 1.05 -0.54 0.00 0.00 174.62 176.75 3hs0 h GLU 301 N -0.18 0.00 -0.02 3.99 -0.00 -1.60 -0.75 114.58 116.02 3hs0 h GLU 301 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.90 3hs0 h GLU 301 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.00 3hs0 h GLU 301 CO 0.53 0.00 -0.03 -1.13 -0.00 0.00 0.00 179.01 178.38 3hs0 n SER 302 N -3.99 1.86 -0.24 3.06 3.41 -1.26 -4.93 113.62 111.53 3hs0 n SER 302 Ca 0.08 -1.58 -0.03 0.00 -0.26 0.00 0.00 58.87 57.08 3hs0 n SER 302 Cb 0.60 0.02 -0.01 0.00 -0.26 0.00 0.00 64.21 64.57 3hs0 n SER 302 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hs0 n GLY 303 N 1.24 0.58 0.06 5.00 0.00 -0.29 -4.89 105.19 106.89 3hs0 n GLY 303 Ca 0.17 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 46.03 3hs0 n GLY 303 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hs0 h SER 304 N 0.00 0.00 -4.99 1.61 4.64 -1.92 -3.48 113.55 109.41 3hs0 h SER 304 Ca -0.06 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.02 3hs0 h SER 304 Cb 0.42 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.40 3hs0 h SER 304 CO 0.09 0.11 0.22 -0.62 -0.87 0.00 0.00 176.83 175.77 3hs0 s ASP 305 N -4.23 -0.55 -0.26 4.97 2.15 -1.26 -5.04 116.67 112.45 3hs0 s ASP 305 Ca 0.06 -0.02 -0.06 0.00 0.43 0.00 0.00 52.55 52.95 3hs0 s ASP 305 Cb 0.13 0.60 0.13 0.00 -0.30 0.00 0.00 42.92 43.48 3hs0 s ASP 305 CO 0.73 -0.97 0.53 -0.32 -0.17 0.00 0.00 175.17 174.97 3hs0 s MET 306 N -3.73 0.46 0.05 4.34 -2.45 -1.26 -2.11 119.30 114.59 3hs0 s MET 306 Ca 0.01 1.12 -0.04 0.00 -1.25 0.00 0.00 55.69 55.53 3hs0 s MET 306 Cb -0.01 0.46 -0.05 0.00 1.25 0.00 0.00 34.83 36.48 3hs0 s MET 306 CO -0.12 -0.35 0.27 0.08 1.05 0.00 0.00 175.02 175.95 3hs0 s VAL 307 N 2.75 5.30 -0.27 10.11 1.01 -0.36 -4.95 120.40 133.99 3hs0 s VAL 307 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.00 3hs0 s VAL 307 Cb -0.13 -3.59 0.08 0.00 0.00 0.00 0.00 36.38 32.73 3hs0 s VAL 307 CO -0.17 0.24 -0.00 -0.69 0.00 0.00 0.00 175.10 174.48 3hs0 s VAL 308 N -1.43 1.51 0.56 2.92 1.01 -1.26 -1.52 120.40 122.19 3hs0 s VAL 308 Ca 0.32 -1.44 0.06 0.00 0.00 0.00 0.00 61.98 60.92 3hs0 s VAL 308 Cb -0.13 -1.91 0.05 0.00 0.00 0.00 0.00 36.38 34.39 3hs0 s VAL 308 CO 0.21 -0.31 0.50 -0.89 0.00 0.00 0.00 175.10 174.62 3hs0 s THR 309 N 1.36 1.75 -0.25 3.92 2.01 -0.15 -5.00 115.64 119.28 3hs0 s THR 309 Ca 0.00 -1.37 -0.14 0.00 0.31 0.00 0.00 61.69 60.49 3hs0 s THR 309 Cb -0.19 -2.12 0.07 0.00 0.01 0.00 0.00 72.50 70.28 3hs0 s THR 309 CO -0.10 0.00 0.61 -0.70 -0.69 0.00 0.00 174.62 173.74 3hs0 s GLU 310 N -4.38 0.62 -0.45 4.92 2.12 -1.26 -1.82 118.70 118.45 3hs0 s GLU 310 Ca 0.41 1.11 -0.19 0.00 0.36 0.00 0.00 54.97 56.65 3hs0 s GLU 310 Cb -0.03 0.10 0.03 0.00 0.26 0.00 0.00 34.13 34.49 3hs0 s GLU 310 CO 0.25 -0.15 0.57 -1.14 -0.54 0.00 0.00 175.26 174.25 3hs0 s GLN 311 N 1.58 3.17 0.43 4.30 2.00 0.31 -4.96 119.66 126.49 3hs0 s GLN 311 Ca -0.10 -0.65 0.02 0.00 -2.00 0.00 0.00 55.36 52.64 3hs0 s GLN 311 Cb -0.06 -4.00 0.02 0.00 0.80 0.00 0.00 33.01 29.77 3hs0 s GLN 311 CO -0.18 -1.02 0.19 -1.13 -0.50 0.00 0.00 175.29 172.65 3hs0 n SER 312 N 6.02 2.71 -3.52 6.67 3.41 -1.26 -0.62 113.62 127.03 3hs0 n SER 312 Ca -0.05 -2.63 -0.20 0.00 -0.26 0.00 0.00 58.87 55.73 3hs0 n SER 312 Cb 0.47 0.10 0.08 0.00 -0.26 0.00 0.00 64.21 64.60 3hs0 n SER 312 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hs0 n GLY 313 N -0.13 -0.43 3.27 5.00 0.00 -1.26 -4.96 105.19 106.69 3hs0 n GLY 313 Ca -0.08 0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 3hs0 n GLY 313 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hs0 s ILE 314 N -3.36 4.86 0.30 -0.61 -1.09 -1.09 -4.93 121.20 115.27 3hs0 s ILE 314 Ca 0.23 -1.69 -0.29 0.00 -2.23 0.00 0.00 60.65 56.67 3hs0 s ILE 314 Cb -0.10 -4.13 -0.10 0.00 -1.58 0.00 0.00 42.46 36.54 3hs0 s ILE 314 CO 0.74 -0.85 1.35 -1.00 -1.23 0.00 0.00 174.94 173.95 3hs0 s HIS 315 N 1.40 3.04 -0.45 3.97 3.76 -1.25 0.14 115.29 125.89 3hs0 s HIS 315 Ca 0.05 1.28 -0.17 0.00 -0.15 0.00 0.00 55.06 56.08 3hs0 s HIS 315 Cb -0.27 -3.72 0.04 0.00 1.11 0.00 0.00 32.58 29.74 3hs0 s HIS 315 CO 0.01 -2.12 0.45 0.42 -0.85 0.00 0.00 174.74 172.65 3hs0 s ILE 316 N -0.72 5.10 0.23 0.60 1.01 -0.75 -0.54 121.20 126.13 3hs0 s ILE 316 Ca 0.53 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.58 3hs0 s ILE 316 Cb -0.40 -4.11 -0.05 0.00 0.01 0.00 0.00 42.46 37.91 3hs0 s ILE 316 CO 0.49 -0.54 0.04 0.68 0.00 0.00 0.00 174.94 175.61 3hs0 s VAL 317 N 2.06 0.77 -0.39 2.92 -7.23 -0.03 -4.40 120.40 114.10 3hs0 s VAL 317 Ca 0.10 -2.00 0.23 0.00 -1.81 0.00 0.00 61.98 58.49 3hs0 s VAL 317 Cb -0.20 -2.40 0.04 0.00 0.56 0.00 0.00 36.38 34.39 3hs0 s VAL 317 CO 0.11 -0.24 1.18 0.00 -0.31 0.00 0.00 175.10 175.84 3hs0 h ALA 318 N 2.49 0.57 -2.27 1.32 0.00 -1.96 -0.34 119.26 119.07 3hs0 h ALA 318 Ca -0.38 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 3hs0 h ALA 318 Cb 1.23 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 18.82 3hs0 h ALA 318 CO 0.63 0.00 -0.04 0.45 0.00 0.00 0.00 179.25 180.29 3hs0 s SER 319 N -5.04 -0.42 0.00 0.00 0.15 -1.26 -4.60 113.70 102.52 3hs0 s SER 319 Ca 0.02 0.39 0.25 0.00 0.70 0.00 0.00 55.95 57.31 3hs0 s SER 319 Cb 0.10 0.43 1.33 0.00 -1.71 0.00 0.00 66.02 66.17 3hs0 s SER 319 CO 0.76 -0.54 1.85 -2.65 1.20 0.00 0.00 173.24 173.86 3hs0 n PRO 320 N 1.06 0.48 -4.34 5.44 -0.02 -1.26 -4.85 135.00 131.51 3hs0 n PRO 320 Ca -0.20 0.04 -0.18 0.00 -2.02 0.00 0.00 63.50 61.14 3hs0 n PRO 320 Cb 0.57 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 32.44 3hs0 n PRO 320 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 3hs0 s TYR 321 N -2.41 1.61 -0.02 6.00 2.02 -1.26 -3.93 117.35 119.36 3hs0 s TYR 321 Ca 0.28 -0.80 0.01 0.00 -0.37 0.00 0.00 57.07 56.19 3hs0 s TYR 321 Cb 0.17 -0.89 0.01 0.00 -0.40 0.00 0.00 41.96 40.85 3hs0 s TYR 321 CO 0.35 0.11 -0.05 -0.65 -1.57 0.00 0.00 175.55 173.74 3hs0 s GLN 322 N -3.78 0.56 -0.12 -0.62 -0.21 -0.39 -4.74 119.66 110.35 3hs0 s GLN 322 Ca 0.26 -0.15 -0.05 0.00 0.02 0.00 0.00 55.36 55.44 3hs0 s GLN 322 Cb 0.04 -0.57 -0.04 0.00 1.00 0.00 0.00 33.01 33.44 3hs0 s GLN 322 CO 0.08 0.04 0.06 0.42 -2.12 0.00 0.00 175.29 173.76 3hs0 s ILE 323 N 0.31 4.84 0.05 1.08 1.01 -1.26 -1.25 121.20 125.98 3hs0 s ILE 323 Ca -0.03 -0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.64 3hs0 s ILE 323 Cb -0.07 -3.10 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 3hs0 s ILE 323 CO -0.00 0.57 -0.16 -1.00 0.00 0.00 0.00 174.94 174.35 3hs0 s HIS 324 N -0.61 1.38 -0.22 3.97 3.76 0.89 -4.85 115.29 119.61 3hs0 s HIS 324 Ca 0.11 -0.39 0.14 0.00 -0.15 0.00 0.00 55.06 54.77 3hs0 s HIS 324 Cb -0.12 -0.80 0.49 0.00 1.11 0.00 0.00 32.58 33.27 3hs0 s HIS 324 CO 0.02 0.07 1.41 1.19 -0.85 0.00 0.00 174.74 176.58 3hs0 n PHE 325 N 1.66 0.90 0.37 1.40 3.72 -1.26 -2.36 117.46 121.88 3hs0 n PHE 325 Ca -0.19 -1.18 0.13 0.00 -0.05 0.00 0.00 57.45 56.16 3hs0 n PHE 325 Cb 0.54 -0.37 0.54 0.00 -0.94 0.00 0.00 39.48 39.25 3hs0 n PHE 325 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 3hs0 h THR 326 N 1.28 0.00 -0.17 4.37 1.35 -1.94 -3.09 112.91 114.71 3hs0 h THR 326 Ca 0.09 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 3hs0 h THR 326 Cb 1.48 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 3hs0 h THR 326 CO 0.27 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.83 3hs0 n LYS 327 N -2.47 1.74 -4.31 4.72 5.02 -1.26 -4.63 118.16 116.96 3hs0 n LYS 327 Ca 0.02 -1.73 -0.28 0.00 -2.02 0.00 0.00 58.31 54.30 3hs0 n LYS 327 Cb 0.26 -1.34 -0.11 0.00 -0.02 0.00 0.00 35.03 33.82 3hs0 n LYS 327 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3hs0 s THR 328 N -1.26 2.89 0.35 -0.18 -1.32 -1.17 -4.78 115.64 110.18 3hs0 s THR 328 Ca 0.24 -1.60 -0.28 0.00 -1.21 0.00 0.00 61.69 58.83 3hs0 s THR 328 Cb 0.15 -2.36 -0.10 0.00 -1.51 0.00 0.00 72.50 68.68 3hs0 s THR 328 CO 0.21 0.02 1.28 -2.84 -2.21 0.00 0.00 174.62 171.08 3hs0 s PRO 329 N -2.39 4.28 -0.02 7.08 0.02 -1.26 -4.53 135.00 138.18 3hs0 s PRO 329 Ca 0.20 2.15 0.10 0.00 0.02 0.00 0.00 61.00 63.47 3hs0 s PRO 329 Cb -0.10 -2.99 0.31 0.00 0.02 0.00 0.00 34.50 31.74 3hs0 s PRO 329 CO 0.11 -0.23 1.22 1.63 -0.33 0.00 0.00 177.00 179.40 3hs0 n LYS 330 N 0.65 1.93 -4.10 5.54 4.76 -1.26 -4.88 118.16 120.80 3hs0 n LYS 330 Ca 0.01 -1.24 -0.14 0.00 -2.87 0.00 0.00 58.31 54.07 3hs0 n LYS 330 Cb 0.43 -1.35 -0.12 0.00 -1.84 0.00 0.00 35.03 32.14 3hs0 n LYS 330 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3hs0 s TYR 331 N -1.59 0.63 0.26 2.13 2.02 -1.26 -2.06 117.35 117.47 3hs0 s TYR 331 Ca 0.23 -0.36 0.04 0.00 -0.37 0.00 0.00 57.07 56.61 3hs0 s TYR 331 Cb 0.13 -0.38 -0.05 0.00 -0.40 0.00 0.00 41.96 41.25 3hs0 s TYR 331 CO 0.14 -0.05 0.00 -0.59 -1.57 0.00 0.00 175.55 173.48 3hs0 s PHE 332 N -0.95 1.70 -0.31 2.71 -0.12 -0.94 -4.88 117.98 115.19 3hs0 s PHE 332 Ca -0.06 -0.90 0.03 0.00 -0.05 0.00 0.00 56.93 55.94 3hs0 s PHE 332 Cb -0.07 -1.01 0.08 0.00 -0.63 0.00 0.00 43.02 41.39 3hs0 s PHE 332 CO 0.00 0.01 -0.01 0.15 -0.05 0.00 0.00 175.22 175.31 3hs0 s LYS 333 N -3.85 1.94 0.13 1.99 3.01 -1.26 -2.26 119.74 119.43 3hs0 s LYS 333 Ca 0.31 -1.59 -0.34 0.00 -1.01 0.00 0.00 55.97 53.34 3hs0 s LYS 333 Cb 0.06 -3.09 -0.17 0.00 -1.01 0.00 0.00 37.83 33.62 3hs0 s LYS 333 CO 0.11 -0.76 1.07 -2.30 0.51 0.00 0.00 175.35 173.98 3hs0 n PRO 334 N 4.39 0.73 -0.97 -1.68 -0.02 -1.26 -1.10 135.00 135.09 3hs0 n PRO 334 Ca -0.06 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3hs0 n PRO 334 Cb 0.42 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 3hs0 n PRO 334 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hs0 n GLY 335 N 1.95 0.90 3.26 -1.23 0.00 -1.26 -5.01 105.19 103.80 3hs0 n GLY 335 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 3hs0 n GLY 335 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hs0 s MET 336 N -0.03 1.34 0.19 1.61 -1.94 -0.26 -4.99 119.30 115.21 3hs0 s MET 336 Ca 0.00 -0.99 -0.33 0.00 -1.71 0.00 0.00 55.69 52.66 3hs0 s MET 336 Cb 0.00 -1.49 -0.15 0.00 2.01 0.00 0.00 34.83 35.20 3hs0 s MET 336 CO 0.00 0.37 1.35 -2.30 -0.01 0.00 0.00 175.02 174.43 3hs0 n PRO 337 N 1.70 1.67 -3.69 2.03 -0.02 -1.26 -4.51 135.00 130.91 3hs0 n PRO 337 Ca -0.18 0.60 -0.36 0.00 -2.02 0.00 0.00 63.50 61.54 3hs0 n PRO 337 Cb 0.53 -2.22 -0.07 0.00 -0.02 0.00 0.00 33.50 31.72 3hs0 n PRO 337 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3hs0 s TYR 338 N 0.12 3.46 -0.65 6.00 5.04 -1.11 -4.88 117.35 125.32 3hs0 s TYR 338 Ca 0.73 0.44 -0.18 0.00 -2.44 0.00 0.00 57.07 55.63 3hs0 s TYR 338 Cb -0.76 -2.18 0.13 0.00 0.35 0.00 0.00 41.96 39.50 3hs0 s TYR 338 CO 0.48 0.34 0.73 -1.21 -1.34 0.00 0.00 175.55 174.55 3hs0 s GLU 339 N 0.18 3.17 -0.19 4.97 2.02 -1.26 -1.06 118.70 126.54 3hs0 s GLU 339 Ca 0.12 -1.58 -0.28 0.00 0.02 0.00 0.00 54.97 53.24 3hs0 s GLU 339 Cb -0.12 -4.36 -0.00 0.00 0.10 0.00 0.00 34.13 29.75 3hs0 s GLU 339 CO 0.01 -1.50 0.98 -1.17 0.02 0.00 0.00 175.26 173.59 3hs0 s LEU 340 N 2.18 4.15 -0.44 1.80 2.96 -0.47 -4.71 118.68 124.15 3hs0 s LEU 340 Ca 0.13 1.36 -0.05 0.00 -0.22 0.00 0.00 54.13 55.35 3hs0 s LEU 340 Cb -0.21 -3.47 0.12 0.00 0.50 0.00 0.00 46.19 43.13 3hs0 s LEU 340 CO 0.02 -0.55 0.26 -0.89 -1.32 0.00 0.00 176.35 173.87 3hs0 s THR 341 N 2.67 3.62 -0.11 3.68 2.01 -1.26 -0.23 115.64 126.02 3hs0 s THR 341 Ca 0.44 -2.00 -0.26 0.00 0.31 0.00 0.00 61.69 60.17 3hs0 s THR 341 Cb -0.16 -3.44 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 3hs0 s THR 341 CO 0.11 -0.73 0.85 -0.69 -0.69 0.00 0.00 174.62 173.46 3hs0 s VAL 342 N 1.17 4.91 -0.22 3.82 1.01 -0.22 -4.09 120.40 126.77 3hs0 s VAL 342 Ca 0.08 1.71 -0.05 0.00 0.00 0.00 0.00 61.98 63.72 3hs0 s VAL 342 Cb -0.24 -4.17 -0.02 0.00 0.00 0.00 0.00 36.38 31.96 3hs0 s VAL 342 CO -0.03 0.10 -0.01 -0.47 0.00 0.00 0.00 175.10 174.68 3hs0 s TYR 343 N 1.62 2.99 -0.16 5.22 5.04 -0.99 -1.24 117.35 129.83 3hs0 s TYR 343 Ca 0.42 -0.73 0.01 0.00 -2.44 0.00 0.00 57.07 54.33 3hs0 s TYR 343 Cb -0.18 -2.12 0.00 0.00 0.35 0.00 0.00 41.96 40.01 3hs0 s TYR 343 CO 0.17 -0.44 -0.17 0.08 -1.34 0.00 0.00 175.55 173.85 3hs0 s VAL 344 N 1.38 2.48 0.27 3.14 1.01 -0.14 -0.08 120.40 128.47 3hs0 s VAL 344 Ca 0.05 -0.83 0.11 0.00 0.00 0.00 0.00 61.98 61.30 3hs0 s VAL 344 Cb -0.14 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 3hs0 s VAL 344 CO -0.01 0.52 -0.17 0.42 0.00 0.00 0.00 175.10 175.86 3hs0 s THR 345 N 0.88 2.29 0.86 3.92 -4.23 -0.38 -2.43 115.64 116.54 3hs0 s THR 345 Ca -0.05 -2.34 -0.12 0.00 -1.18 0.00 0.00 61.69 58.01 3hs0 s THR 345 Cb -0.15 -2.30 0.11 0.00 1.34 0.00 0.00 72.50 71.50 3hs0 s THR 345 CO -0.02 -0.41 1.12 0.20 -0.54 0.00 0.00 174.62 174.98 3hs0 s ASN 346 N -3.48 3.95 0.51 3.99 0.01 0.32 -1.26 114.94 118.99 3hs0 s ASN 346 Ca 0.29 1.09 0.20 0.00 -0.71 0.00 0.00 52.86 53.73 3hs0 s ASN 346 Cb -0.03 -1.73 1.30 0.00 0.41 0.00 0.00 41.25 41.19 3hs0 s ASN 346 CO 0.14 -2.28 2.06 -0.65 -1.51 0.00 0.00 177.10 174.86 3hs0 h PRO 347 N -1.31 0.05 -0.00 -0.60 0.11 -1.90 -1.25 132.00 127.10 3hs0 h PRO 347 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hs0 h PRO 347 Cb 1.31 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3hs0 h PRO 347 CO 0.61 0.03 -0.09 -0.40 -0.21 0.00 0.00 178.00 177.95 3hs0 n ASP 348 N -4.46 0.54 0.00 -2.05 5.68 -1.26 -4.91 116.55 110.09 3hs0 n ASP 348 Ca 0.04 -0.74 0.00 0.00 -0.50 0.00 0.00 54.79 53.59 3hs0 n ASP 348 Cb 0.34 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.27 3hs0 n ASP 348 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hs0 n GLY 349 N 1.23 2.20 3.73 6.12 0.00 -0.47 -5.09 105.19 112.92 3hs0 n GLY 349 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3hs0 n GLY 349 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hs0 s SER 350 N -1.64 4.23 0.75 1.61 1.04 -1.26 -4.66 113.70 113.77 3hs0 s SER 350 Ca 0.00 2.17 -0.13 0.00 0.48 0.00 0.00 55.95 58.46 3hs0 s SER 350 Cb 0.00 -2.57 0.05 0.00 0.10 0.00 0.00 66.02 63.60 3hs0 s SER 350 CO 0.00 -2.23 1.15 -2.84 0.98 0.00 0.00 173.24 170.30 3hs0 s PRO 351 N -4.22 2.15 -0.23 4.02 0.02 -1.26 -0.52 135.00 134.95 3hs0 s PRO 351 Ca 0.69 1.53 -0.02 0.00 0.02 0.00 0.00 61.00 63.22 3hs0 s PRO 351 Cb -0.24 -1.86 0.07 0.00 0.02 0.00 0.00 34.50 32.49 3hs0 s PRO 351 CO 0.48 -1.78 0.04 0.00 -0.33 0.00 0.00 177.00 175.41 3hs0 s ALA 352 N -2.35 1.27 0.59 -1.55 0.00 -1.02 -4.53 121.76 114.17 3hs0 s ALA 352 Ca 0.69 -1.03 -0.06 0.00 0.00 0.00 0.00 51.96 51.56 3hs0 s ALA 352 Cb -0.24 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.56 3hs0 s ALA 352 CO 0.48 -1.30 0.90 0.00 0.00 0.00 0.00 175.76 175.85 3hs0 s ALA 353 N 1.73 3.28 -1.19 0.00 0.00 -1.26 -4.28 121.76 120.05 3hs0 s ALA 353 Ca 0.01 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.33 3hs0 s ALA 353 Cb -0.17 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.31 3hs0 s ALA 353 CO -0.12 -0.77 0.00 0.72 0.00 0.00 0.00 175.76 175.58 3hs0 n HIS 354 N -2.58 -1.26 -3.47 0.00 8.25 -0.99 -4.93 115.22 110.24 3hs0 n HIS 354 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.09 3hs0 n HIS 354 Cb 0.57 -2.91 -0.10 0.00 1.12 0.00 0.00 29.99 28.67 3hs0 n HIS 354 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3hs0 s VAL 355 N -2.63 5.24 0.28 1.59 1.01 -1.26 -4.87 120.40 119.77 3hs0 s VAL 355 Ca 0.00 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 3hs0 s VAL 355 Cb 0.00 -3.83 -0.10 0.00 0.00 0.00 0.00 36.38 32.45 3hs0 s VAL 355 CO 0.00 -0.16 1.29 -2.84 0.00 0.00 0.00 175.10 173.39 3hs0 s PRO 356 N 1.78 4.39 0.18 2.72 0.02 -1.26 -1.84 135.00 140.99 3hs0 s PRO 356 Ca 0.07 2.13 0.08 0.00 0.02 0.00 0.00 61.00 63.30 3hs0 s PRO 356 Cb -0.18 -3.12 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 3hs0 s PRO 356 CO 0.11 -0.17 -0.16 0.14 -0.33 0.00 0.00 177.00 176.59 3hs0 s VAL 357 N -0.72 1.71 -0.03 3.83 -7.23 0.18 -0.73 120.40 117.41 3hs0 s VAL 357 Ca 0.51 -2.04 -0.11 0.00 -1.81 0.00 0.00 61.98 58.54 3hs0 s VAL 357 Cb -0.38 -1.90 0.02 0.00 0.56 0.00 0.00 36.38 34.68 3hs0 s VAL 357 CO 0.47 -0.47 0.24 0.68 -0.31 0.00 0.00 175.10 175.71 3hs0 s VAL 358 N -2.52 0.05 -0.44 1.32 -7.23 -0.65 -1.70 120.40 109.23 3hs0 s VAL 358 Ca 0.18 -0.40 0.01 0.00 -1.81 0.00 0.00 61.98 59.97 3hs0 s VAL 358 Cb -0.03 -0.48 0.12 0.00 0.56 0.00 0.00 36.38 36.55 3hs0 s VAL 358 CO 0.06 -0.22 0.19 -0.55 -0.31 0.00 0.00 175.10 174.27 3hs0 s SER 359 N -0.89 4.85 0.34 4.85 0.15 -0.04 -2.27 113.70 120.68 3hs0 s SER 359 Ca -0.10 -2.43 0.06 0.00 0.70 0.00 0.00 55.95 54.18 3hs0 s SER 359 Cb -0.05 -1.71 0.72 0.00 -1.71 0.00 0.00 66.02 63.27 3hs0 s SER 359 CO 0.02 -0.38 1.89 -0.33 1.20 0.00 0.00 173.24 175.64 3hs0 h GLU 360 N 7.37 0.78 0.00 5.44 5.08 -1.85 -0.26 114.58 131.13 3hs0 h GLU 360 Ca -0.07 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3hs0 h GLU 360 Cb 0.99 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.06 3hs0 h GLU 360 CO 0.63 0.52 0.00 0.00 -1.00 0.00 0.00 179.01 179.15 3hs0 n ALA 361 N -2.42 1.86 -0.21 3.43 0.00 -1.26 -3.10 120.51 118.80 3hs0 n ALA 361 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3hs0 n ALA 361 Cb 0.36 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.48 3hs0 n ALA 361 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3hs0 n PHE 362 N -1.64 0.00 -2.83 0.00 3.72 -0.21 -5.00 117.46 111.50 3hs0 n PHE 362 Ca 0.04 -0.18 -0.17 0.00 -0.05 0.00 0.00 57.45 57.09 3hs0 n PHE 362 Cb 0.23 -0.02 -0.00 0.00 -0.94 0.00 0.00 39.48 38.75 3hs0 n PHE 362 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3hs0 n HIS 363 N -0.18 -1.61 -3.42 1.38 8.25 -0.62 -4.93 115.22 114.09 3hs0 n HIS 363 Ca 0.00 0.22 -0.38 0.00 -0.26 0.00 0.00 57.72 57.30 3hs0 n HIS 363 Cb 0.17 -2.97 -0.08 0.00 1.12 0.00 0.00 29.99 28.23 3hs0 n HIS 363 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3hs0 s SER 364 N -2.34 6.41 0.08 0.41 0.01 -1.16 -4.97 113.70 112.14 3hs0 s SER 364 Ca 0.17 0.48 0.09 0.00 1.31 0.00 0.00 55.95 58.00 3hs0 s SER 364 Cb -0.09 -2.22 -0.03 0.00 0.21 0.00 0.00 66.02 63.89 3hs0 s SER 364 CO 0.21 -0.05 -0.23 -0.04 0.41 0.00 0.00 173.24 173.55 3hs0 s MET 365 N 1.21 1.37 0.10 12.44 -1.94 -1.26 -0.86 119.30 130.34 3hs0 s MET 365 Ca 0.18 -1.11 -0.25 0.00 -1.71 0.00 0.00 55.69 52.80 3hs0 s MET 365 Cb -0.14 -1.61 0.08 0.00 2.01 0.00 0.00 34.83 35.17 3hs0 s MET 365 CO 0.07 0.39 0.68 0.20 -0.01 0.00 0.00 175.02 176.36 3hs0 s GLY 366 N -1.57 -0.57 -0.12 -0.03 0.00 -0.69 -4.95 107.32 99.39 3hs0 s GLY 366 Ca 0.09 0.72 0.03 0.00 0.00 0.00 0.00 44.72 45.55 3hs0 s GLY 366 CO 0.03 0.29 -0.20 -1.59 0.00 0.00 0.00 173.10 171.63 3hs0 s THR 367 N -3.33 1.86 0.74 0.90 2.01 -1.26 0.51 115.64 117.08 3hs0 s THR 367 Ca 0.01 -0.87 -0.15 0.00 0.31 0.00 0.00 61.69 60.98 3hs0 s THR 367 Cb -0.01 -1.65 0.01 0.00 0.01 0.00 0.00 72.50 70.86 3hs0 s THR 367 CO -0.10 0.51 0.89 0.35 -0.69 0.00 0.00 174.62 175.58 3hs0 n THR 368 N 4.00 2.37 -3.01 -0.82 -2.24 -0.77 -4.72 114.28 109.09 3hs0 n THR 368 Ca -0.20 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 3hs0 n THR 368 Cb 0.52 -1.02 0.00 0.00 -2.10 0.00 0.00 70.33 67.73 3hs0 n THR 368 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3hs0 n LEU 369 N -1.60 0.00 0.11 3.22 4.77 -0.58 -2.34 117.00 120.58 3hs0 n LEU 369 Ca 0.12 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.29 3hs0 n LEU 369 Cb 0.50 0.00 0.76 0.00 -2.33 0.00 0.00 43.42 42.34 3hs0 n LEU 369 CO 0.49 -0.23 1.17 0.77 -1.33 0.00 0.00 177.39 178.26 3hs0 h SER 370 N 0.00 0.00 -0.53 -1.43 4.64 -1.93 0.14 113.55 114.44 3hs0 h SER 370 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hs0 h SER 370 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3hs0 h SER 370 CO 0.00 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.06 3hs0 n ASP 371 N -3.94 4.90 -0.07 4.97 5.75 -1.26 -4.72 116.55 122.18 3hs0 n ASP 371 Ca 0.06 -2.72 -0.01 0.00 -0.01 0.00 0.00 54.79 52.11 3hs0 n ASP 371 Cb 0.51 -0.60 -0.00 0.00 -1.03 0.00 0.00 41.12 40.00 3hs0 n ASP 371 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hs0 n GLY 372 N 0.59 0.46 3.68 6.12 0.00 0.50 -4.79 105.19 111.76 3hs0 n GLY 372 Ca 0.25 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3hs0 n GLY 372 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hs0 s THR 373 N -1.86 4.18 -0.05 2.61 -4.23 -1.26 -0.96 115.64 114.07 3hs0 s THR 373 Ca 0.00 -0.53 0.02 0.00 -1.18 0.00 0.00 61.69 59.99 3hs0 s THR 373 Cb 0.00 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 71.02 3hs0 s THR 373 CO 0.00 0.42 -0.08 0.00 -0.54 0.00 0.00 174.62 174.43 3hs0 s ALA 374 N -1.05 0.90 -0.26 3.99 0.00 -0.38 -1.53 121.76 123.44 3hs0 s ALA 374 Ca 0.18 -0.20 -0.10 0.00 0.00 0.00 0.00 51.96 51.84 3hs0 s ALA 374 Cb -0.11 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 3hs0 s ALA 374 CO 0.09 0.04 0.17 0.21 0.00 0.00 0.00 175.76 176.26 3hs0 s LYS 375 N 0.81 3.98 -0.16 0.00 2.20 -1.26 -1.05 119.74 124.25 3hs0 s LYS 375 Ca -0.13 -0.31 0.00 0.00 -0.36 0.00 0.00 55.97 55.17 3hs0 s LYS 375 Cb -0.15 -3.58 0.00 0.00 -1.51 0.00 0.00 37.83 32.59 3hs0 s LYS 375 CO 0.02 -0.08 -0.16 -0.51 -0.36 0.00 0.00 175.35 174.26 3hs0 s LEU 376 N 1.44 2.42 -0.04 5.43 1.43 0.68 -4.94 118.68 125.10 3hs0 s LEU 376 Ca 0.07 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.37 3hs0 s LEU 376 Cb -0.15 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 3hs0 s LEU 376 CO 0.08 0.07 1.08 -0.63 0.23 0.00 0.00 176.35 177.17 3hs0 s ILE 377 N 0.93 4.56 0.32 -0.59 -1.09 -1.26 -1.37 121.20 122.70 3hs0 s ILE 377 Ca -0.03 1.85 0.08 0.00 -2.23 0.00 0.00 60.65 60.32 3hs0 s ILE 377 Cb -0.15 -4.18 -0.04 0.00 -1.58 0.00 0.00 42.46 36.51 3hs0 s ILE 377 CO -0.02 0.06 0.14 -0.76 -1.23 0.00 0.00 174.94 173.13 3hs0 s LEU 378 N 1.64 3.33 -0.10 2.97 1.02 -0.22 -4.92 118.68 122.39 3hs0 s LEU 378 Ca 0.53 -0.69 0.01 0.00 0.02 0.00 0.00 54.13 54.00 3hs0 s LEU 378 Cb -0.22 -1.83 0.02 0.00 0.02 0.00 0.00 46.19 44.18 3hs0 s LEU 378 CO 0.23 -0.24 -0.10 0.20 0.02 0.00 0.00 176.35 176.46 3hs0 s ASN 379 N -3.83 2.10 -0.14 2.29 0.02 -1.26 -2.77 114.94 111.35 3hs0 s ASN 379 Ca 0.37 -0.33 -0.03 0.00 -1.02 0.00 0.00 52.86 51.85 3hs0 s ASN 379 Cb -0.04 -0.89 -0.03 0.00 0.02 0.00 0.00 41.25 40.32 3hs0 s ASN 379 CO 0.23 -0.05 -0.03 -0.63 0.02 0.00 0.00 177.10 176.64 3hs0 s ILE 380 N 1.28 3.98 0.21 0.60 -1.09 -1.26 -5.03 121.20 119.88 3hs0 s ILE 380 Ca -0.03 -0.33 -0.31 0.00 -2.23 0.00 0.00 60.65 57.75 3hs0 s ILE 380 Cb -0.14 -2.73 -0.15 0.00 -1.58 0.00 0.00 42.46 37.86 3hs0 s ILE 380 CO -0.04 0.51 1.15 -2.65 -1.23 0.00 0.00 174.94 172.68 3hs0 n PRO 381 N 3.26 1.30 0.30 2.79 -0.02 -1.26 -4.01 135.00 137.36 3hs0 n PRO 381 Ca -0.17 0.46 0.17 0.00 -2.02 0.00 0.00 63.50 61.94 3hs0 n PRO 381 Cb 0.53 -1.94 0.93 0.00 -0.02 0.00 0.00 33.50 33.00 3hs0 n PRO 381 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3hs0 h LEU 382 N 3.13 0.00 -3.64 2.45 5.85 -1.97 -2.89 115.31 118.23 3hs0 h LEU 382 Ca -0.42 0.00 -0.46 0.00 0.84 0.00 0.00 57.88 57.84 3hs0 h LEU 382 Cb 1.34 0.00 -0.36 0.00 0.37 0.00 0.00 40.66 42.01 3hs0 h LEU 382 CO 0.68 0.04 -0.77 -0.46 -0.34 0.00 0.00 178.44 177.59 3hs0 n ASN 383 N -3.46 4.37 -4.44 1.25 0.23 -1.26 -4.64 115.26 107.31 3hs0 n ASN 383 Ca -0.02 -3.76 -0.40 0.00 -0.53 0.00 0.00 54.58 49.87 3hs0 n ASN 383 Cb 0.15 -0.37 -0.11 0.00 -2.08 0.00 0.00 39.78 37.37 3hs0 n ASN 383 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hs0 s ALA 384 N -3.54 3.33 -0.67 -2.53 0.00 -1.09 -4.93 121.76 112.33 3hs0 s ALA 384 Ca 0.49 -1.50 0.22 0.00 0.00 0.00 0.00 51.96 51.16 3hs0 s ALA 384 Cb 0.40 -2.53 -0.19 0.00 0.00 0.00 0.00 23.12 20.80 3hs0 s ALA 384 CO 0.02 -1.09 0.82 1.04 0.00 0.00 0.00 175.76 176.56 3hs0 n GLN 385 N 5.02 0.23 -3.70 0.00 1.13 -1.26 -4.82 117.38 113.99 3hs0 n GLN 385 Ca -0.13 -0.05 -0.15 0.00 -1.94 0.00 0.00 57.00 54.73 3hs0 n GLN 385 Cb 0.48 -1.52 -0.14 0.00 0.11 0.00 0.00 30.24 29.17 3hs0 n GLN 385 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3hs0 s SER 386 N -3.56 0.29 -0.15 1.08 0.15 -1.26 -3.06 113.70 107.18 3hs0 s SER 386 Ca 0.03 0.42 0.01 0.00 0.70 0.00 0.00 55.95 57.11 3hs0 s SER 386 Cb 0.15 0.37 0.02 0.00 -1.71 0.00 0.00 66.02 64.85 3hs0 s SER 386 CO 0.86 -0.21 -0.18 -0.22 1.20 0.00 0.00 173.24 174.70 3hs0 s LEU 387 N 1.89 1.92 -0.05 3.45 2.96 -0.42 -4.99 118.68 123.44 3hs0 s LEU 387 Ca -0.02 -0.56 -0.11 0.00 -0.22 0.00 0.00 54.13 53.22 3hs0 s LEU 387 Cb -0.12 -1.32 -0.05 0.00 0.50 0.00 0.00 46.19 45.20 3hs0 s LEU 387 CO -0.07 -0.00 0.29 -2.84 -1.32 0.00 0.00 176.35 172.41 3hs0 s PRO 388 N 1.23 3.71 -0.03 0.98 0.02 -1.26 0.14 135.00 139.78 3hs0 s PRO 388 Ca 0.01 0.17 0.01 0.00 0.02 0.00 0.00 61.00 61.21 3hs0 s PRO 388 Cb -0.14 -3.20 0.01 0.00 0.02 0.00 0.00 34.50 31.20 3hs0 s PRO 388 CO -0.09 0.72 -0.05 0.42 -0.33 0.00 0.00 177.00 177.68 3hs0 s ILE 389 N -1.08 0.48 -0.11 2.83 1.01 -0.21 -4.99 121.20 119.14 3hs0 s ILE 389 Ca 0.21 -0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.73 3hs0 s ILE 389 Cb -0.15 -0.48 0.01 0.00 0.01 0.00 0.00 42.46 41.85 3hs0 s ILE 389 CO 0.10 0.19 -0.16 -0.89 0.00 0.00 0.00 174.94 174.18 3hs0 s THR 390 N 0.59 1.54 -0.03 2.92 2.01 -1.26 -1.66 115.64 119.74 3hs0 s THR 390 Ca -0.07 -0.67 0.06 0.00 0.31 0.00 0.00 61.69 61.31 3hs0 s THR 390 Cb -0.11 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 70.99 3hs0 s THR 390 CO -0.00 0.45 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.47 3hs0 s VAL 391 N 0.93 1.72 0.22 3.82 1.01 -0.97 -4.27 120.40 122.88 3hs0 s VAL 391 Ca -0.07 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.03 3hs0 s VAL 391 Cb -0.15 -1.45 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 3hs0 s VAL 391 CO -0.01 0.49 0.01 0.00 0.00 0.00 0.00 175.10 175.58 3hs0 s ARG 392 N -0.28 1.30 0.61 2.72 1.70 -0.96 -2.19 118.95 121.85 3hs0 s ARG 392 Ca 0.02 -1.66 -0.06 0.00 -0.47 0.00 0.00 55.73 53.56 3hs0 s ARG 392 Cb -0.11 -0.52 0.02 0.00 -0.57 0.00 0.00 34.95 33.77 3hs0 s ARG 392 CO 0.01 -0.12 0.92 0.95 -1.08 0.00 0.00 175.30 175.98 3hs0 s THR 393 N -3.49 3.44 -0.39 4.99 -4.23 -0.62 -1.63 115.64 113.71 3hs0 s THR 393 Ca 0.28 -0.03 0.11 0.00 -1.18 0.00 0.00 61.69 60.88 3hs0 s THR 393 Cb 0.06 -3.38 0.37 0.00 1.34 0.00 0.00 72.50 70.89 3hs0 s THR 393 CO 0.08 -0.40 1.01 -3.20 -0.54 0.00 0.00 174.62 171.57 3hs0 n ASN 394 N -2.64 -0.46 -4.79 3.99 5.15 0.09 -4.72 115.26 111.88 3hs0 n ASN 394 Ca 0.05 -3.03 -0.35 0.00 -0.60 0.00 0.00 54.58 50.65 3hs0 n ASN 394 Cb 0.58 0.43 -0.02 0.00 -0.53 0.00 0.00 39.78 40.24 3hs0 n ASN 394 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 3hs0 s HIS 395 N -1.32 2.90 0.05 1.20 2.46 -1.26 -4.57 115.29 114.75 3hs0 s HIS 395 Ca 0.29 1.57 -0.16 0.00 0.47 0.00 0.00 55.06 57.22 3hs0 s HIS 395 Cb 0.37 -3.16 -0.24 0.00 -0.13 0.00 0.00 32.58 29.42 3hs0 s HIS 395 CO -0.05 -1.10 1.15 0.78 -2.47 0.00 0.00 174.74 173.06 3hs0 h GLY 396 N 1.53 0.67 1.35 1.59 0.00 -1.97 -3.14 103.07 103.09 3hs0 h GLY 396 Ca -0.50 -1.18 0.00 0.00 0.00 0.00 0.00 47.33 45.65 3hs0 h GLY 396 CO 0.59 1.04 0.00 1.22 0.00 0.00 0.00 176.54 179.39 3hs0 n ASP 397 N -3.98 0.00 -4.48 0.19 8.00 -1.26 -4.78 116.55 110.23 3hs0 n ASP 397 Ca -0.11 -0.16 -0.34 0.00 0.71 0.00 0.00 54.79 54.90 3hs0 n ASP 397 Cb 0.81 -0.18 -0.12 0.00 -0.02 0.00 0.00 41.12 41.61 3hs0 n ASP 397 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hs0 s LEU 398 N -2.35 3.11 0.77 0.64 1.43 -1.19 -5.10 118.68 115.98 3hs0 s LEU 398 Ca 0.19 -0.15 -0.14 0.00 -1.03 0.00 0.00 54.13 52.99 3hs0 s LEU 398 Cb 0.11 -1.73 0.06 0.00 0.03 0.00 0.00 46.19 44.66 3hs0 s LEU 398 CO 0.22 0.20 1.20 -2.84 0.23 0.00 0.00 176.35 175.36 3hs0 s PRO 399 N 0.15 1.92 0.20 1.29 0.02 -1.26 -4.80 135.00 132.52 3hs0 s PRO 399 Ca -0.03 1.73 -0.11 0.00 0.02 0.00 0.00 61.00 62.62 3hs0 s PRO 399 Cb -0.14 -1.81 0.18 0.00 0.02 0.00 0.00 34.50 32.75 3hs0 s PRO 399 CO 0.03 -1.99 1.83 0.00 -0.33 0.00 0.00 177.00 176.54 3hs0 h ARG 400 N -0.60 0.76 -0.98 5.54 2.47 -1.98 -2.12 114.38 117.47 3hs0 h ARG 400 Ca -0.47 -0.05 0.33 0.00 -1.26 0.00 0.00 59.98 58.53 3hs0 h ARG 400 Cb 1.29 -0.17 -0.16 0.00 -1.65 0.00 0.00 29.97 29.29 3hs0 h ARG 400 CO 0.48 0.50 0.48 0.93 0.56 0.00 0.00 179.97 182.93 3hs0 h GLU 401 N 0.78 0.22 -0.13 0.04 5.08 -1.98 -1.67 114.58 116.93 3hs0 h GLU 401 Ca 0.27 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3hs0 h GLU 401 Cb 0.05 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hs0 h GLU 401 CO -0.12 0.15 0.00 0.54 -1.00 0.00 0.00 179.01 178.58 3hs0 n ARG 402 N -5.14 1.89 -2.74 2.33 5.12 -0.80 -4.89 116.66 112.42 3hs0 n ARG 402 Ca 0.31 -1.32 -0.36 0.00 -1.93 0.00 0.00 57.85 54.55 3hs0 n ARG 402 Cb 0.99 -1.45 -0.06 0.00 -1.16 0.00 0.00 32.46 30.78 3hs0 n ARG 402 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3hs0 s GLN 403 N -1.85 4.41 0.33 5.56 -1.52 -0.63 -4.20 119.66 121.76 3hs0 s GLN 403 Ca 0.34 1.31 -0.06 0.00 -1.95 0.00 0.00 55.36 55.01 3hs0 s GLN 403 Cb 0.20 -2.58 -0.05 0.00 -0.22 0.00 0.00 33.01 30.35 3hs0 s GLN 403 CO 0.30 0.11 0.61 0.00 -0.25 0.00 0.00 175.29 176.06 3hs0 s ALA 404 N -1.77 3.56 -0.00 6.09 0.00 -1.26 -4.87 121.76 123.50 3hs0 s ALA 404 Ca 0.55 -0.51 -0.12 0.00 0.00 0.00 0.00 51.96 51.88 3hs0 s ALA 404 Cb -0.17 -2.38 0.01 0.00 0.00 0.00 0.00 23.12 20.58 3hs0 s ALA 404 CO 0.22 0.13 0.24 -0.08 0.00 0.00 0.00 175.76 176.27 3hs0 s THR 405 N -2.20 0.07 0.03 0.00 -1.32 -1.26 -1.59 115.64 109.37 3hs0 s THR 405 Ca 0.45 -0.59 -0.28 0.00 -1.21 0.00 0.00 61.69 60.07 3hs0 s THR 405 Cb -0.10 -0.58 0.07 0.00 -1.51 0.00 0.00 72.50 70.38 3hs0 s THR 405 CO 0.32 -0.32 0.65 -0.75 -2.21 0.00 0.00 174.62 172.30 3hs0 s LYS 406 N -1.48 1.15 0.10 7.08 2.47 -0.93 -4.77 119.74 123.36 3hs0 s LYS 406 Ca -0.13 -0.03 0.03 0.00 -1.56 0.00 0.00 55.97 54.27 3hs0 s LYS 406 Cb -0.06 0.54 -0.04 0.00 -1.46 0.00 0.00 37.83 36.81 3hs0 s LYS 406 CO 0.03 -0.42 -0.08 -1.12 0.16 0.00 0.00 175.35 173.91 3hs0 s SER 407 N -1.82 1.28 0.25 1.43 0.01 -1.26 -2.28 113.70 111.31 3hs0 s SER 407 Ca -0.06 -0.92 -0.15 0.00 1.31 0.00 0.00 55.95 56.13 3hs0 s SER 407 Cb -0.00 0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.28 3hs0 s SER 407 CO 0.01 -0.38 0.53 0.00 0.41 0.00 0.00 173.24 173.82 3hs0 s MET 408 N -3.37 1.60 -0.02 12.44 0.23 -0.67 -5.02 119.30 124.49 3hs0 s MET 408 Ca 0.09 -1.19 0.02 0.00 -1.03 0.00 0.00 55.69 53.58 3hs0 s MET 408 Cb 0.02 0.50 0.01 0.00 -1.53 0.00 0.00 34.83 33.82 3hs0 s MET 408 CO -0.02 -0.68 -0.05 0.95 -2.03 0.00 0.00 175.02 173.18 3hs0 s THR 409 N -3.99 0.49 -0.16 3.16 -4.23 -1.26 -1.04 115.64 108.60 3hs0 s THR 409 Ca 0.20 -0.20 -0.03 0.00 -1.18 0.00 0.00 61.69 60.48 3hs0 s THR 409 Cb -0.02 -0.45 -0.02 0.00 1.34 0.00 0.00 72.50 73.35 3hs0 s THR 409 CO 0.08 0.17 -0.06 0.00 -0.54 0.00 0.00 174.62 174.27 3hs0 s ALA 410 N 0.27 2.85 0.51 3.99 0.00 0.12 -4.92 121.76 124.57 3hs0 s ALA 410 Ca -0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 51.96 50.96 3hs0 s ALA 410 Cb -0.07 -1.49 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 3hs0 s ALA 410 CO -0.00 0.07 0.80 0.42 0.00 0.00 0.00 175.76 177.05 3hs0 s ILE 411 N 0.62 4.33 0.28 0.00 -1.09 -0.87 -1.31 121.20 123.16 3hs0 s ILE 411 Ca -0.04 -0.01 -0.19 0.00 -2.23 0.00 0.00 60.65 58.18 3hs0 s ILE 411 Cb -0.15 -3.66 -0.09 0.00 -1.58 0.00 0.00 42.46 36.99 3hs0 s ILE 411 CO 0.03 -0.62 0.77 0.00 -1.23 0.00 0.00 174.94 173.88 3hs0 s ALA 412 N -2.78 3.33 -0.01 9.38 0.00 -1.17 -2.21 121.76 128.30 3hs0 s ALA 412 Ca 0.49 0.18 -0.30 0.00 0.00 0.00 0.00 51.96 52.33 3hs0 s ALA 412 Cb -0.10 -2.86 -0.07 0.00 0.00 0.00 0.00 23.12 20.08 3hs0 s ALA 412 CO 0.43 0.30 1.76 -0.47 0.00 0.00 0.00 175.76 177.78 3hs0 s TYR 413 N -1.73 1.82 -0.53 0.00 5.04 -0.96 -4.85 117.35 116.13 3hs0 s TYR 413 Ca 0.49 -0.01 -0.28 0.00 -2.44 0.00 0.00 57.07 54.83 3hs0 s TYR 413 Cb -0.14 -4.03 0.03 0.00 0.35 0.00 0.00 41.96 38.17 3hs0 s TYR 413 CO 0.19 -4.43 1.12 -0.65 -1.34 0.00 0.00 175.55 170.45 3hs0 s GLN 414 N 3.96 3.57 0.58 4.97 -1.52 -0.80 -4.99 119.66 125.44 3hs0 s GLN 414 Ca 0.78 0.30 -0.20 0.00 -1.95 0.00 0.00 55.36 54.30 3hs0 s GLN 414 Cb -0.37 -3.97 -0.03 0.00 -0.22 0.00 0.00 33.01 28.41 3hs0 s GLN 414 CO 0.34 -1.51 1.30 0.95 -0.25 0.00 0.00 175.29 176.12 3hs0 s THR 415 N 4.56 2.20 -0.28 -0.19 -4.23 -1.26 -4.35 115.64 112.09 3hs0 s THR 415 Ca 0.43 0.14 -0.29 0.00 -1.18 0.00 0.00 61.69 60.79 3hs0 s THR 415 Cb -0.08 -3.06 -0.02 0.00 1.34 0.00 0.00 72.50 70.68 3hs0 s THR 415 CO 0.27 -0.01 1.71 -1.58 -0.54 0.00 0.00 174.62 174.47 3hs0 s GLN 416 N -3.12 3.55 0.00 3.99 0.74 -1.26 -2.09 119.66 121.47 3hs0 s GLN 416 Ca 0.76 1.53 0.00 0.00 0.05 0.00 0.00 55.36 57.70 3hs0 s GLN 416 Cb -0.37 -4.12 0.00 0.00 1.10 0.00 0.00 33.01 29.61 3hs0 s GLN 416 CO 0.42 -1.59 0.00 0.41 -0.55 0.00 0.00 175.29 173.98 3hs0 n GLY 417 N 5.08 2.91 0.00 2.59 0.00 -1.26 -2.85 105.19 111.66 3hs0 n GLY 417 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3hs0 n GLY 417 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hs0 n GLY 418 N -1.53 1.77 0.30 -0.02 0.00 -0.89 -5.00 105.19 99.83 3hs0 n GLY 418 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.22 3hs0 n GLY 418 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hs0 h SER 419 N 0.00 0.00 -0.13 1.61 4.64 -1.74 -3.46 113.55 114.47 3hs0 h SER 419 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 3hs0 h SER 419 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 3hs0 h SER 419 CO 0.00 0.00 -0.05 0.61 -0.87 0.00 0.00 176.83 176.52 3hs0 n GLY 420 N -0.53 0.60 3.58 -0.77 0.00 -1.26 -4.63 105.19 102.18 3hs0 n GLY 420 Ca -0.01 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 3hs0 n GLY 420 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hs0 s ASN 421 N -2.72 6.25 0.29 1.61 0.01 -1.26 -4.29 114.94 114.82 3hs0 s ASN 421 Ca 0.00 0.12 0.11 0.00 -0.71 0.00 0.00 52.86 52.38 3hs0 s ASN 421 Cb 0.00 -2.22 -0.05 0.00 0.41 0.00 0.00 41.25 39.39 3hs0 s ASN 421 CO 0.00 -0.27 -0.16 -0.31 -1.51 0.00 0.00 177.10 174.85 3hs0 s TYR 422 N 2.11 2.35 0.00 2.20 2.02 -0.72 -4.80 117.35 120.51 3hs0 s TYR 422 Ca 0.15 -0.34 0.01 0.00 -0.37 0.00 0.00 57.07 56.52 3hs0 s TYR 422 Cb -0.16 -1.07 -0.00 0.00 -0.40 0.00 0.00 41.96 40.33 3hs0 s TYR 422 CO 0.11 0.69 -0.03 -1.17 -1.57 0.00 0.00 175.55 173.58 3hs0 s LEU 423 N -3.54 2.02 -0.11 -1.29 2.96 -1.26 -3.56 118.68 113.91 3hs0 s LEU 423 Ca 0.31 -0.09 -0.04 0.00 -0.22 0.00 0.00 54.13 54.09 3hs0 s LEU 423 Cb -0.04 -0.15 0.05 0.00 0.50 0.00 0.00 46.19 46.55 3hs0 s LEU 423 CO 0.16 0.02 0.17 -2.28 -1.32 0.00 0.00 176.35 173.09 3hs0 s HIS 424 N -0.17 -0.17 0.09 5.38 5.65 -0.64 -4.68 115.29 120.75 3hs0 s HIS 424 Ca 0.00 0.51 -0.14 0.00 0.25 0.00 0.00 55.06 55.68 3hs0 s HIS 424 Cb -0.02 -0.30 -0.06 0.00 -1.18 0.00 0.00 32.58 31.02 3hs0 s HIS 424 CO -0.00 -0.33 0.50 0.08 -0.65 0.00 0.00 174.74 174.33 3hs0 s VAL 425 N 2.29 4.91 -0.00 0.89 1.01 -1.26 -1.29 120.40 126.95 3hs0 s VAL 425 Ca 0.04 0.83 0.01 0.00 0.00 0.00 0.00 61.98 62.85 3hs0 s VAL 425 Cb -0.13 -3.74 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 3hs0 s VAL 425 CO -0.07 0.37 -0.03 0.00 0.00 0.00 0.00 175.10 175.38 3hs0 s ALA 426 N -1.31 0.27 -0.25 5.51 0.00 -1.01 -4.97 121.76 120.00 3hs0 s ALA 426 Ca 0.32 -0.12 -0.03 0.00 0.00 0.00 0.00 51.96 52.13 3hs0 s ALA 426 Cb -0.16 -0.08 0.08 0.00 0.00 0.00 0.00 23.12 22.96 3hs0 s ALA 426 CO 0.18 0.06 0.10 0.42 0.00 0.00 0.00 175.76 176.51 3hs0 s ILE 427 N -0.02 0.22 0.22 0.00 1.01 -1.26 -2.51 121.20 118.85 3hs0 s ILE 427 Ca 0.01 -0.69 0.09 0.00 0.00 0.00 0.00 60.65 60.05 3hs0 s ILE 427 Cb -0.02 -1.02 -0.09 0.00 0.01 0.00 0.00 42.46 41.34 3hs0 s ILE 427 CO -0.00 -0.51 1.49 0.71 0.00 0.00 0.00 174.94 176.63 3hs0 h THR 428 N 6.45 1.53 -4.03 2.92 1.35 -2.01 -3.46 112.91 115.66 3hs0 h THR 428 Ca -0.17 -2.55 -0.55 0.00 -0.55 0.00 0.00 66.41 62.59 3hs0 h THR 428 Cb 1.07 2.38 0.17 0.00 -1.73 0.00 0.00 68.15 70.03 3hs0 h THR 428 CO 0.39 0.73 0.37 -1.20 -0.25 0.00 0.00 175.52 175.56 3hs0 n SER 429 N -3.66 1.46 -4.14 5.36 7.64 -1.26 -5.03 113.62 114.00 3hs0 n SER 429 Ca -0.01 0.74 -0.10 0.00 1.01 0.00 0.00 58.87 60.51 3hs0 n SER 429 Cb 0.73 -1.51 -0.10 0.00 -1.01 0.00 0.00 64.21 62.32 3hs0 n SER 429 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3hs0 s THR 430 N -1.64 0.09 -1.07 0.44 -4.23 -1.26 -4.91 115.64 103.06 3hs0 s THR 430 Ca 0.79 -1.87 -0.21 0.00 -1.18 0.00 0.00 61.69 59.22 3hs0 s THR 430 Cb -0.36 -2.07 0.02 0.00 1.34 0.00 0.00 72.50 71.44 3hs0 s THR 430 CO 0.45 -0.41 0.68 -0.62 -0.54 0.00 0.00 174.62 174.18 3hs0 n GLU 431 N -0.12 -0.83 -2.72 3.99 1.02 -1.26 -4.83 120.64 115.89 3hs0 n GLU 431 Ca -0.05 0.40 -0.43 0.00 -0.02 0.00 0.00 57.16 57.06 3hs0 n GLU 431 Cb 0.64 -2.87 -0.03 0.00 -0.02 0.00 0.00 31.44 29.17 3hs0 n GLU 431 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3hs0 s ILE 432 N -3.34 4.75 0.09 -3.67 1.01 -1.26 -4.93 121.20 113.85 3hs0 s ILE 432 Ca 0.33 1.94 0.06 0.00 0.00 0.00 0.00 60.65 62.97 3hs0 s ILE 432 Cb -0.17 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 37.99 3hs0 s ILE 432 CO 0.92 -0.09 -0.05 -0.54 0.00 0.00 0.00 174.94 175.18 3hs0 s LYS 433 N 2.71 2.38 -0.16 2.79 1.02 -1.26 -0.68 119.74 126.53 3hs0 s LYS 433 Ca 0.44 -0.90 -0.32 0.00 0.02 0.00 0.00 55.97 55.20 3hs0 s LYS 433 Cb -0.16 -2.44 -0.09 0.00 -0.52 0.00 0.00 37.83 34.61 3hs0 s LYS 433 CO 0.10 0.53 2.05 -2.30 -0.92 0.00 0.00 175.35 174.82 3hs0 n PRO 434 N 0.74 1.98 0.00 -1.68 -0.02 -1.26 -1.92 135.00 132.84 3hs0 n PRO 434 Ca -0.12 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 3hs0 n PRO 434 Cb 0.52 -2.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.18 3hs0 n PRO 434 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hs0 n GLY 435 N 5.24 1.27 3.83 -1.23 0.00 -0.81 -4.93 105.19 108.56 3hs0 n GLY 435 Ca 0.28 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 3hs0 n GLY 435 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hs0 s ASP 436 N -0.97 5.09 -0.18 1.61 1.11 -0.81 -4.85 116.67 117.67 3hs0 s ASP 436 Ca 0.00 1.38 0.01 0.00 0.18 0.00 0.00 52.55 54.11 3hs0 s ASP 436 Cb 0.00 -2.20 0.02 0.00 1.07 0.00 0.00 42.92 41.81 3hs0 s ASP 436 CO 0.00 -1.59 -0.19 0.20 1.18 0.00 0.00 175.17 174.77 3hs0 s ASN 437 N -3.98 3.26 -0.37 0.27 0.01 -1.26 -2.05 114.94 110.81 3hs0 s ASN 437 Ca 0.59 -0.62 -0.11 0.00 -0.71 0.00 0.00 52.86 52.01 3hs0 s ASN 437 Cb -0.13 -1.50 0.02 0.00 0.41 0.00 0.00 41.25 40.05 3hs0 s ASN 437 CO 0.54 0.01 0.20 -0.22 -1.51 0.00 0.00 177.10 176.12 3hs0 s LEU 438 N 1.26 4.68 -0.30 0.60 2.96 0.38 -4.87 118.68 123.38 3hs0 s LEU 438 Ca 0.04 -0.96 -0.28 0.00 -0.22 0.00 0.00 54.13 52.71 3hs0 s LEU 438 Cb -0.13 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 3hs0 s LEU 438 CO -0.11 -0.37 1.91 -2.84 -1.32 0.00 0.00 176.35 173.62 3hs0 s PRO 439 N 1.56 3.27 -0.06 0.98 0.02 -1.26 -1.61 135.00 137.90 3hs0 s PRO 439 Ca 0.02 1.58 -0.01 0.00 0.02 0.00 0.00 61.00 62.61 3hs0 s PRO 439 Cb -0.19 -4.25 -0.03 0.00 0.02 0.00 0.00 34.50 30.05 3hs0 s PRO 439 CO 0.07 -1.94 0.01 0.08 -0.33 0.00 0.00 177.00 174.89 3hs0 s VAL 440 N 7.32 4.31 -0.06 3.83 1.01 0.18 -4.47 120.40 132.52 3hs0 s VAL 440 Ca 0.85 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 62.53 3hs0 s VAL 440 Cb -0.25 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 3hs0 s VAL 440 CO 0.34 0.52 -0.22 0.20 0.00 0.00 0.00 175.10 175.94 3hs0 s ASN 441 N -1.14 2.77 -0.46 3.32 0.01 -1.04 -0.70 114.94 117.70 3hs0 s ASN 441 Ca 0.16 -0.47 -0.09 0.00 -0.71 0.00 0.00 52.86 51.75 3hs0 s ASN 441 Cb -0.11 -0.85 0.11 0.00 0.41 0.00 0.00 41.25 40.81 3hs0 s ASN 441 CO 0.05 0.20 0.32 -0.36 -1.51 0.00 0.00 177.10 175.81 3hs0 s PHE 442 N -0.01 3.43 -0.13 2.20 0.08 0.34 -2.41 117.98 121.48 3hs0 s PHE 442 Ca -0.06 -1.89 -0.14 0.00 0.12 0.00 0.00 56.93 54.96 3hs0 s PHE 442 Cb -0.14 -3.41 -0.05 0.00 -0.57 0.00 0.00 43.02 38.85 3hs0 s PHE 442 CO 0.04 -0.98 0.31 -0.80 -0.10 0.00 0.00 175.22 173.69 3hs0 s ASN 443 N 2.53 6.50 0.17 1.36 0.01 -0.41 -2.37 114.94 122.73 3hs0 s ASN 443 Ca 0.06 0.59 0.11 0.00 -0.71 0.00 0.00 52.86 52.90 3hs0 s ASN 443 Cb -0.26 -2.19 -0.04 0.00 0.41 0.00 0.00 41.25 39.17 3hs0 s ASN 443 CO -0.01 0.15 -0.24 0.68 -1.51 0.00 0.00 177.10 176.17 3hs0 s VAL 444 N 0.13 2.27 -0.29 1.60 -7.23 -0.73 -1.62 120.40 114.53 3hs0 s VAL 444 Ca 0.18 -1.93 -0.14 0.00 -1.81 0.00 0.00 61.98 58.28 3hs0 s VAL 444 Cb -0.14 -2.05 0.10 0.00 0.56 0.00 0.00 36.38 34.86 3hs0 s VAL 444 CO 0.06 -0.07 0.69 -0.75 -0.31 0.00 0.00 175.10 174.72 3hs0 s LYS 445 N -2.47 0.65 0.00 4.82 2.20 -1.23 -4.91 119.74 118.79 3hs0 s LYS 445 Ca 0.18 1.28 0.00 0.00 -0.36 0.00 0.00 55.97 57.07 3hs0 s LYS 445 Cb -0.08 0.38 0.00 0.00 -1.51 0.00 0.00 37.83 36.61 3hs0 s LYS 445 CO 0.08 -0.16 0.00 0.41 -0.36 0.00 0.00 175.35 175.32 3hs0 n GLY 446 N 4.67 -0.53 3.47 5.54 0.00 -1.26 -1.75 105.19 115.32 3hs0 n GLY 446 Ca -0.17 -0.72 -0.49 0.00 0.00 0.00 0.00 46.02 44.64 3hs0 n GLY 446 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hs0 n ASN 447 N 0.00 2.23 -0.22 1.61 2.85 -1.26 -4.79 115.26 115.67 3hs0 n ASN 447 Ca 0.00 0.34 0.30 0.00 -0.11 0.00 0.00 54.58 55.11 3hs0 n ASN 447 Cb 0.00 -1.30 0.72 0.00 1.24 0.00 0.00 39.78 40.43 3hs0 n ASN 447 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3hs0 h ALA 448 N 12.99 2.88 -0.03 5.20 0.00 -1.99 0.61 119.26 138.93 3hs0 h ALA 448 Ca -0.28 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3hs0 h ALA 448 Cb 1.31 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 3hs0 h ALA 448 CO 1.03 -1.16 -0.04 -0.97 0.00 0.00 0.00 179.25 178.10 3hs0 h ASN 449 N 0.03 0.09 -0.37 0.00 -0.73 -2.02 -3.25 115.58 109.33 3hs0 h ASN 449 Ca 0.47 -0.52 -0.11 0.00 1.87 0.00 0.00 56.30 58.02 3hs0 h ASN 449 Cb 1.83 -0.02 -0.02 0.00 0.27 0.00 0.00 38.32 40.38 3hs0 h ASN 449 CO -0.02 0.59 -0.15 0.28 -0.37 0.00 0.00 177.43 177.76 3hs0 h SER 450 N -0.41 0.83 0.05 1.15 0.02 -0.82 -3.15 113.55 111.22 3hs0 h SER 450 Ca 0.00 -0.27 -0.01 0.00 -0.84 0.00 0.00 61.79 60.68 3hs0 h SER 450 Cb 0.57 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.88 3hs0 h SER 450 CO 0.01 0.98 -0.03 -0.07 -1.14 0.00 0.00 176.83 176.58 3hs0 h LEU 451 N 0.74 0.00 -0.03 5.07 3.38 -0.04 -1.66 115.31 122.77 3hs0 h LEU 451 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3hs0 h LEU 451 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3hs0 h LEU 451 CO 0.05 0.03 -0.24 2.29 0.09 0.00 0.00 178.44 180.65 3hs0 n LYS 452 N -4.06 0.09 -2.24 1.13 2.85 -1.19 -3.63 118.16 111.11 3hs0 n LYS 452 Ca -0.03 -0.03 -0.38 0.00 -1.05 0.00 0.00 58.31 56.82 3hs0 n LYS 452 Cb 0.11 -1.50 0.03 0.00 -0.65 0.00 0.00 35.03 33.02 3hs0 n LYS 452 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3hs0 n GLN 453 N -1.43 3.58 -3.78 -1.58 10.64 -0.62 -4.88 117.38 119.31 3hs0 n GLN 453 Ca 0.07 -4.02 -0.29 0.00 -1.83 0.00 0.00 57.00 50.92 3hs0 n GLN 453 Cb 0.33 -2.32 -0.16 0.00 -0.86 0.00 0.00 30.24 27.24 3hs0 n GLN 453 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 3hs0 s ILE 454 N -4.91 0.94 -1.43 -0.39 1.01 -1.24 -4.77 121.20 110.41 3hs0 s ILE 454 Ca 0.48 -1.15 0.12 0.00 0.00 0.00 0.00 60.65 60.10 3hs0 s ILE 454 Cb 0.36 -1.54 0.16 0.00 0.01 0.00 0.00 42.46 41.45 3hs0 s ILE 454 CO -0.30 -0.44 1.00 0.29 0.00 0.00 0.00 174.94 175.49 3hs0 n LYS 455 N 4.86 1.28 -3.60 2.79 5.02 -1.26 -4.60 118.16 122.64 3hs0 n LYS 455 Ca -0.06 -1.47 -0.07 0.00 -2.02 0.00 0.00 58.31 54.70 3hs0 n LYS 455 Cb 0.44 -1.26 -0.04 0.00 -0.02 0.00 0.00 35.03 34.15 3hs0 n LYS 455 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 3hs0 s TYR 456 N -1.03 -0.22 -0.12 2.13 -0.85 -1.26 -3.29 117.35 112.71 3hs0 s TYR 456 Ca 0.18 0.35 -0.04 0.00 -0.52 0.00 0.00 57.07 57.04 3hs0 s TYR 456 Cb 0.11 0.48 -0.03 0.00 0.38 0.00 0.00 41.96 42.89 3hs0 s TYR 456 CO 0.16 -0.23 0.03 -0.06 -1.52 0.00 0.00 175.55 173.93 3hs0 s PHE 457 N -1.30 3.22 -0.11 -3.49 0.08 0.62 -4.65 117.98 112.36 3hs0 s PHE 457 Ca 0.04 0.16 -0.15 0.00 0.12 0.00 0.00 56.93 57.10 3hs0 s PHE 457 Cb -0.01 -1.89 -0.05 0.00 -0.57 0.00 0.00 43.02 40.51 3hs0 s PHE 457 CO -0.03 0.39 0.35 0.99 -0.10 0.00 0.00 175.22 176.82 3hs0 s THR 458 N -0.51 5.22 0.08 0.64 2.01 0.06 -1.08 115.64 122.06 3hs0 s THR 458 Ca 0.09 0.69 0.05 0.00 0.31 0.00 0.00 61.69 62.84 3hs0 s THR 458 Cb -0.12 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 3hs0 s THR 458 CO 0.02 0.44 -0.13 -0.72 -0.69 0.00 0.00 174.62 173.54 3hs0 s TYR 459 N -0.01 1.22 -0.07 4.92 -0.85 -0.07 -0.54 117.35 121.96 3hs0 s TYR 459 Ca 0.20 -0.51 0.02 0.00 -0.52 0.00 0.00 57.07 56.27 3hs0 s TYR 459 Cb -0.14 -0.67 0.02 0.00 0.38 0.00 0.00 41.96 41.54 3hs0 s TYR 459 CO 0.08 0.06 -0.11 -0.51 -1.52 0.00 0.00 175.55 173.56 3hs0 s LEU 460 N -1.97 1.56 -0.31 -3.49 1.02 0.22 -1.03 118.68 114.68 3hs0 s LEU 460 Ca 0.01 -0.27 -0.17 0.00 0.02 0.00 0.00 54.13 53.71 3hs0 s LEU 460 Cb -0.08 -0.77 -0.02 0.00 0.02 0.00 0.00 46.19 45.34 3hs0 s LEU 460 CO 0.02 0.01 0.47 -0.63 0.02 0.00 0.00 176.35 176.24 3hs0 s ILE 461 N 0.79 5.08 -0.13 -0.59 -1.09 0.18 -1.15 121.20 124.28 3hs0 s ILE 461 Ca -0.12 0.53 -0.07 0.00 -2.23 0.00 0.00 60.65 58.75 3hs0 s ILE 461 Cb -0.15 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.83 3hs0 s ILE 461 CO 0.02 -0.04 0.11 -0.76 -1.23 0.00 0.00 174.94 173.05 3hs0 s LEU 462 N 2.27 4.21 -0.19 2.97 1.43 0.52 -0.52 118.68 129.38 3hs0 s LEU 462 Ca 0.18 0.36 -0.10 0.00 -1.03 0.00 0.00 54.13 53.54 3hs0 s LEU 462 Cb -0.16 -2.03 0.06 0.00 0.03 0.00 0.00 46.19 44.09 3hs0 s LEU 462 CO 0.11 0.35 0.45 0.21 0.23 0.00 0.00 176.35 177.71 3hs0 s ASN 463 N -0.69 -0.59 -1.50 2.29 3.04 -0.15 -0.82 114.94 116.51 3hs0 s ASN 463 Ca 0.13 0.99 -0.00 0.00 0.04 0.00 0.00 52.86 54.02 3hs0 s ASN 463 Cb -0.12 0.87 0.00 0.00 -1.54 0.00 0.00 41.25 40.46 3hs0 s ASN 463 CO 0.03 -0.20 0.02 0.29 -3.04 0.00 0.00 177.10 174.20 3hs0 n LYS 464 N 4.28 -2.00 -0.61 0.43 5.02 -1.26 -1.67 118.16 122.34 3hs0 n LYS 464 Ca -0.23 0.85 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 3hs0 n LYS 464 Cb 0.56 -5.50 0.00 0.00 -0.02 0.00 0.00 35.03 30.07 3hs0 n LYS 464 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hs0 n GLY 465 N -0.95 0.79 3.59 0.72 0.00 -1.26 -4.97 105.19 103.10 3hs0 n GLY 465 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 3hs0 n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hs0 s LYS 466 N -0.39 2.17 -0.73 1.61 1.02 -0.67 -4.87 119.74 117.88 3hs0 s LYS 466 Ca 0.00 -1.02 -0.26 0.00 0.02 0.00 0.00 55.97 54.71 3hs0 s LYS 466 Cb 0.00 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.99 3hs0 s LYS 466 CO 0.00 0.51 1.59 0.42 -0.92 0.00 0.00 175.35 176.95 3hs0 s ILE 467 N -1.25 3.56 -0.05 2.17 1.01 -1.26 -0.98 121.20 124.41 3hs0 s ILE 467 Ca 0.22 0.15 -0.23 0.00 0.00 0.00 0.00 60.65 60.78 3hs0 s ILE 467 Cb -0.11 -4.45 -0.18 0.00 0.01 0.00 0.00 42.46 37.73 3hs0 s ILE 467 CO 0.14 -1.40 0.99 0.15 0.00 0.00 0.00 174.94 174.83 3hs0 h PHE 468 N 12.13 -0.14 -3.51 3.97 3.57 -1.10 -3.41 116.94 128.46 3hs0 h PHE 468 Ca -0.19 -0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.09 3hs0 h PHE 468 Cb 1.09 0.05 -0.28 0.00 2.79 0.00 0.00 35.95 39.60 3hs0 h PHE 468 CO 1.12 0.36 -0.62 0.21 -2.23 0.00 0.00 178.31 177.14 3hs0 s LYS 469 N -3.61 0.09 0.21 1.11 2.20 -1.06 -4.99 119.74 113.69 3hs0 s LYS 469 Ca -0.14 0.14 0.09 0.00 -0.36 0.00 0.00 55.97 55.69 3hs0 s LYS 469 Cb 0.01 0.02 -0.04 0.00 -1.51 0.00 0.00 37.83 36.31 3hs0 s LYS 469 CO 0.55 -0.03 -0.03 0.08 -0.36 0.00 0.00 175.35 175.56 3hs0 s VAL 470 N 0.16 3.44 0.09 4.02 1.01 -1.26 0.48 120.40 128.33 3hs0 s VAL 470 Ca -0.01 -1.69 -0.26 0.00 0.00 0.00 0.00 61.98 60.02 3hs0 s VAL 470 Cb -0.02 -2.76 0.08 0.00 0.00 0.00 0.00 36.38 33.68 3hs0 s VAL 470 CO -0.00 -0.21 0.77 -0.83 0.00 0.00 0.00 175.10 174.83 3hs0 s GLY 471 N -3.19 -0.48 -0.01 4.51 0.00 -0.20 -4.98 107.32 102.97 3hs0 s GLY 471 Ca 0.28 0.65 0.08 0.00 0.00 0.00 0.00 44.72 45.73 3hs0 s GLY 471 CO 0.18 0.21 -0.26 0.50 0.00 0.00 0.00 173.10 173.73 3hs0 s ARG 472 N -3.42 2.07 -0.14 2.90 1.81 -1.26 -0.89 118.95 120.02 3hs0 s ARG 472 Ca 0.05 -0.95 -0.00 0.00 -1.72 0.00 0.00 55.73 53.10 3hs0 s ARG 472 Cb -0.01 -2.04 0.03 0.00 -0.45 0.00 0.00 34.95 32.48 3hs0 s ARG 472 CO -0.09 0.55 -0.07 -1.14 -0.68 0.00 0.00 175.30 173.88 3hs0 s GLN 473 N -0.71 1.55 0.20 3.54 2.00 -0.24 -4.97 119.66 121.02 3hs0 s GLN 473 Ca 0.10 -0.39 -0.29 0.00 -2.00 0.00 0.00 55.36 52.78 3hs0 s GLN 473 Cb -0.10 -1.80 -0.08 0.00 0.80 0.00 0.00 33.01 31.83 3hs0 s GLN 473 CO -0.00 -0.33 0.92 -2.14 -0.50 0.00 0.00 175.29 173.24 3hs0 s PRO 474 N 1.66 4.79 -0.11 1.67 0.02 -1.26 -0.27 135.00 141.50 3hs0 s PRO 474 Ca 0.03 1.44 0.04 0.00 0.02 0.00 0.00 61.00 62.53 3hs0 s PRO 474 Cb -0.14 -3.30 0.00 0.00 0.02 0.00 0.00 34.50 31.08 3hs0 s PRO 474 CO -0.08 0.45 -0.24 0.50 -0.33 0.00 0.00 177.00 177.30 3hs0 s ARG 475 N -0.89 3.04 0.22 5.54 6.06 -1.21 -4.94 118.95 126.78 3hs0 s ARG 475 Ca 0.42 -0.87 0.02 0.00 -2.50 0.00 0.00 55.73 52.79 3hs0 s ARG 475 Cb -0.25 -2.31 -0.04 0.00 0.06 0.00 0.00 34.95 32.41 3hs0 s ARG 475 CO 0.31 0.15 0.38 -0.98 -2.50 0.00 0.00 175.30 172.66 3hs0 s ARG 476 N 0.41 3.47 0.09 5.12 1.70 -1.26 -4.44 118.95 124.03 3hs0 s ARG 476 Ca -0.17 -0.53 -0.32 0.00 -0.47 0.00 0.00 55.73 54.23 3hs0 s ARG 476 Cb -0.18 -2.86 -0.11 0.00 -0.57 0.00 0.00 34.95 31.23 3hs0 s ARG 476 CO 0.07 0.40 1.81 -3.47 -1.08 0.00 0.00 175.30 173.04 3hs0 n ASP 477 N -1.05 3.82 0.00 -2.89 2.03 -1.26 -2.15 116.55 115.05 3hs0 n ASP 477 Ca -0.07 1.00 0.00 0.00 0.52 0.00 0.00 54.79 56.24 3hs0 n ASP 477 Cb 0.55 -1.50 0.00 0.00 -0.72 0.00 0.00 41.12 39.45 3hs0 n ASP 477 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hs0 n GLY 478 N 4.15 2.40 3.41 0.27 0.00 -1.26 -5.03 105.19 109.13 3hs0 n GLY 478 Ca 0.19 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.76 3hs0 n GLY 478 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hs0 s GLN 479 N -0.58 3.83 0.00 1.61 -0.21 -0.91 -4.83 119.66 118.56 3hs0 s GLN 479 Ca 0.00 -2.34 0.14 0.00 0.02 0.00 0.00 55.36 53.18 3hs0 s GLN 479 Cb 0.00 -4.81 0.72 0.00 1.00 0.00 0.00 33.01 29.92 3hs0 s GLN 479 CO 0.00 -1.60 1.37 0.09 -2.12 0.00 0.00 175.29 173.03 3hs0 n ASN 480 N 5.22 0.00 -3.67 5.90 4.13 -1.26 -4.48 115.26 121.09 3hs0 n ASN 480 Ca 0.25 0.06 -0.20 0.00 1.68 0.00 0.00 54.58 56.37 3hs0 n ASN 480 Cb 0.45 -0.27 -0.18 0.00 -1.54 0.00 0.00 39.78 38.25 3hs0 n ASN 480 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3hs0 s LEU 481 N -2.54 0.15 -0.08 3.41 0.20 -1.26 -1.77 118.68 116.79 3hs0 s LEU 481 Ca 0.14 0.06 0.03 0.00 0.69 0.00 0.00 54.13 55.04 3hs0 s LEU 481 Cb 0.09 -0.15 0.01 0.00 -0.43 0.00 0.00 46.19 45.71 3hs0 s LEU 481 CO 0.21 -0.25 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.16 3hs0 s VAL 482 N 2.17 1.53 -0.01 1.68 1.01 -1.00 -4.94 120.40 120.83 3hs0 s VAL 482 Ca 0.05 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 3hs0 s VAL 482 Cb -0.12 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 3hs0 s VAL 482 CO -0.03 0.44 0.10 -0.89 0.00 0.00 0.00 175.10 174.72 3hs0 s THR 483 N 0.55 4.89 0.05 3.92 2.01 -1.26 -0.51 115.64 125.29 3hs0 s THR 483 Ca -0.16 -0.34 0.02 0.00 0.31 0.00 0.00 61.69 61.53 3hs0 s THR 483 Cb -0.17 -3.24 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 3hs0 s THR 483 CO 0.06 0.36 -0.08 -0.32 -0.69 0.00 0.00 174.62 173.94 3hs0 s MET 484 N -1.75 0.55 -0.17 4.92 -2.45 0.12 -4.97 119.30 115.55 3hs0 s MET 484 Ca 0.23 -0.79 -0.10 0.00 -1.25 0.00 0.00 55.69 53.78 3hs0 s MET 484 Cb -0.12 -0.31 -0.05 0.00 1.25 0.00 0.00 34.83 35.60 3hs0 s MET 484 CO 0.14 0.05 0.16 1.21 1.05 0.00 0.00 175.02 177.64 3hs0 s ASN 485 N -1.65 6.31 -0.21 1.11 2.47 -1.26 -0.65 114.94 121.06 3hs0 s ASN 485 Ca -0.09 0.35 0.00 0.00 0.42 0.00 0.00 52.86 53.55 3hs0 s ASN 485 Cb -0.09 -2.10 0.02 0.00 -1.45 0.00 0.00 41.25 37.63 3hs0 s ASN 485 CO 0.00 0.23 -0.15 -0.22 -3.72 0.00 0.00 177.10 173.25 3hs0 s LEU 486 N -0.03 2.55 -0.21 3.21 2.96 -0.63 -4.90 118.68 121.63 3hs0 s LEU 486 Ca 0.11 -0.74 -0.25 0.00 -0.22 0.00 0.00 54.13 53.04 3hs0 s LEU 486 Cb -0.12 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 45.01 3hs0 s LEU 486 CO 0.01 -0.04 0.83 -2.28 -1.32 0.00 0.00 176.35 173.54 3hs0 s HIS 487 N 1.30 3.36 0.01 5.38 5.65 -1.26 -0.47 115.29 129.27 3hs0 s HIS 487 Ca 0.03 1.19 -0.20 0.00 0.25 0.00 0.00 55.06 56.33 3hs0 s HIS 487 Cb -0.15 -3.03 -0.06 0.00 -1.18 0.00 0.00 32.58 28.17 3hs0 s HIS 487 CO -0.09 -0.32 0.57 0.42 -0.65 0.00 0.00 174.74 174.67 3hs0 s ILE 488 N 2.49 4.88 0.15 0.89 -1.09 -0.87 -5.02 121.20 122.63 3hs0 s ILE 488 Ca 0.36 1.20 0.04 0.00 -2.23 0.00 0.00 60.65 60.02 3hs0 s ILE 488 Cb -0.16 -3.90 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 3hs0 s ILE 488 CO 0.10 0.46 -0.09 0.42 -1.23 0.00 0.00 174.94 174.59 3hs0 s THR 489 N -0.45 1.12 0.22 2.92 -4.23 -1.26 -1.93 115.64 112.03 3hs0 s THR 489 Ca 0.30 -2.05 0.20 0.00 -1.18 0.00 0.00 61.69 58.95 3hs0 s THR 489 Cb -0.18 -1.85 0.20 0.00 1.34 0.00 0.00 72.50 72.00 3hs0 s THR 489 CO 0.17 -0.74 1.54 -0.65 -0.54 0.00 0.00 174.62 174.40 3hs0 h PRO 490 N 2.79 0.00 0.00 3.99 0.11 -1.91 0.13 132.00 137.10 3hs0 h PRO 490 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 3hs0 h PRO 490 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3hs0 h PRO 490 CO 0.64 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.18 3hs0 n ASP 491 N -2.36 0.00 -0.00 -2.05 10.43 -1.26 -2.59 116.55 118.73 3hs0 n ASP 491 Ca -0.01 0.29 0.09 0.00 2.57 0.00 0.00 54.79 57.73 3hs0 n ASP 491 Cb 0.32 -0.40 -0.12 0.00 1.84 0.00 0.00 41.12 42.76 3hs0 n ASP 491 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3hs0 n LEU 492 N -1.40 0.89 -4.77 0.64 4.77 0.46 -4.92 117.00 112.66 3hs0 n LEU 492 Ca 0.06 -0.47 -0.40 0.00 -0.03 0.00 0.00 56.01 55.17 3hs0 n LEU 492 Cb 0.18 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.28 3hs0 n LEU 492 CO 0.15 0.22 1.10 -0.63 -1.33 0.00 0.00 177.39 176.91 3hs0 s ILE 493 N -2.92 2.03 -0.84 -0.08 1.01 -1.07 -1.66 121.20 117.68 3hs0 s ILE 493 Ca 0.07 0.03 0.25 0.00 0.00 0.00 0.00 60.65 60.99 3hs0 s ILE 493 Cb 0.15 -3.02 0.03 0.00 0.01 0.00 0.00 42.46 39.63 3hs0 s ILE 493 CO 0.82 0.01 1.38 -0.81 0.00 0.00 0.00 174.94 176.34 3hs0 n PRO 494 N 0.05 0.13 -3.58 2.79 -0.05 -1.26 -4.94 135.00 128.14 3hs0 n PRO 494 Ca 0.03 0.03 -0.05 0.00 -0.05 0.00 0.00 63.50 63.46 3hs0 n PRO 494 Cb 0.41 -1.58 -0.02 0.00 -0.05 0.00 0.00 33.50 32.26 3hs0 n PRO 494 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 175.50 173.91 3hs0 s SER 495 N -3.53 -0.19 0.15 3.54 1.04 -0.66 -1.67 113.70 112.37 3hs0 s SER 495 Ca 0.09 0.02 -0.04 0.00 0.48 0.00 0.00 55.95 56.50 3hs0 s SER 495 Cb 0.16 0.20 -0.03 0.00 0.10 0.00 0.00 66.02 66.45 3hs0 s SER 495 CO 0.71 -0.31 0.15 0.72 0.98 0.00 0.00 173.24 175.48 3hs0 s PHE 496 N -2.46 0.69 -0.07 5.02 -0.12 0.08 -4.58 117.98 116.53 3hs0 s PHE 496 Ca 0.08 -1.05 0.04 0.00 -0.05 0.00 0.00 56.93 55.94 3hs0 s PHE 496 Cb -0.01 -0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.05 3hs0 s PHE 496 CO -0.05 -0.60 -0.18 1.03 -0.05 0.00 0.00 175.22 175.36 3hs0 s ARG 497 N -4.02 2.75 -0.33 1.99 0.52 -0.00 -0.40 118.95 119.46 3hs0 s ARG 497 Ca 0.22 -0.77 -0.09 0.00 -0.52 0.00 0.00 55.73 54.57 3hs0 s ARG 497 Cb 0.06 -2.36 0.01 0.00 0.52 0.00 0.00 34.95 33.18 3hs0 s ARG 497 CO 0.01 0.43 0.14 0.12 0.02 0.00 0.00 175.30 176.02 3hs0 s PHE 498 N -0.24 3.20 -0.14 -0.53 5.36 -0.38 -0.35 117.98 124.90 3hs0 s PHE 498 Ca 0.00 -0.93 -0.01 0.00 -0.96 0.00 0.00 56.93 55.03 3hs0 s PHE 498 Cb -0.13 -2.34 -0.02 0.00 -0.34 0.00 0.00 43.02 40.20 3hs0 s PHE 498 CO 0.03 -0.59 -0.12 0.08 -1.46 0.00 0.00 175.22 173.16 3hs0 s VAL 499 N 1.53 3.12 0.03 3.12 1.01 -0.30 -1.09 120.40 127.83 3hs0 s VAL 499 Ca 0.02 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.38 3hs0 s VAL 499 Cb -0.18 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 3hs0 s VAL 499 CO 0.05 0.52 -0.05 0.00 0.00 0.00 0.00 175.10 175.61 3hs0 s ALA 500 N 0.40 0.34 0.12 5.51 0.00 -0.23 0.70 121.76 128.59 3hs0 s ALA 500 Ca -0.10 -0.68 -0.16 0.00 0.00 0.00 0.00 51.96 51.02 3hs0 s ALA 500 Cb -0.16 0.10 0.03 0.00 0.00 0.00 0.00 23.12 23.10 3hs0 s ALA 500 CO 0.05 -0.10 0.40 1.52 0.00 0.00 0.00 175.76 177.63 3hs0 s TYR 501 N -1.46 -0.20 0.21 0.00 -0.85 0.29 -1.22 117.35 114.12 3hs0 s TYR 501 Ca -0.13 -0.10 0.02 0.00 -0.52 0.00 0.00 57.07 56.35 3hs0 s TYR 501 Cb -0.10 0.25 -0.05 0.00 0.38 0.00 0.00 41.96 42.44 3hs0 s TYR 501 CO -0.00 -0.69 0.02 1.52 -1.52 0.00 0.00 175.55 174.87 3hs0 s TYR 502 N -3.70 1.39 0.14 -3.49 -0.85 -0.76 -0.76 117.35 109.31 3hs0 s TYR 502 Ca 0.02 -1.01 0.07 0.00 -0.52 0.00 0.00 57.07 55.63 3hs0 s TYR 502 Cb 0.02 -0.80 -0.04 0.00 0.38 0.00 0.00 41.96 41.52 3hs0 s TYR 502 CO -0.11 -0.17 -0.16 1.14 -1.52 0.00 0.00 175.55 174.73 3hs0 s GLN 503 N -3.92 1.13 -0.06 -3.49 1.03 -1.26 -1.53 119.66 111.56 3hs0 s GLN 503 Ca 0.28 -1.32 -0.01 0.00 0.04 0.00 0.00 55.36 54.36 3hs0 s GLN 503 Cb 0.06 -1.07 0.03 0.00 0.03 0.00 0.00 33.01 32.06 3hs0 s GLN 503 CO 0.07 0.21 -0.01 0.08 -2.54 0.00 0.00 175.29 173.10 3hs0 s VAL 504 N -2.15 0.39 -1.52 3.63 1.01 -0.32 -4.79 120.40 116.66 3hs0 s VAL 504 Ca 0.12 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.16 3hs0 s VAL 504 Cb -0.05 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.82 3hs0 s VAL 504 CO 0.04 0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3hs0 n GLY 505 N 4.78 -0.25 2.23 4.51 0.00 -1.26 -1.84 105.19 113.36 3hs0 n GLY 505 Ca -0.13 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 3hs0 n GLY 505 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hs0 n ASN 506 N -1.32 -2.88 0.00 1.61 3.02 -1.26 -4.62 115.26 109.80 3hs0 n ASN 506 Ca -0.21 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 3hs0 n ASN 506 Cb 0.65 -2.59 0.00 0.00 -0.61 0.00 0.00 39.78 37.24 3hs0 n ASN 506 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3hs0 n ASN 507 N -1.22 1.14 -4.48 6.41 5.15 -1.04 -4.53 115.26 116.69 3hs0 n ASN 507 Ca -0.10 0.00 -0.34 0.00 -0.60 0.00 0.00 54.58 53.54 3hs0 n ASN 507 Cb 0.50 0.00 -0.12 0.00 -0.53 0.00 0.00 39.78 39.62 3hs0 n ASN 507 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 3hs0 s GLU 508 N -1.29 3.63 -0.14 1.20 2.12 -0.76 -4.99 118.70 118.46 3hs0 s GLU 508 Ca 0.00 -0.55 -0.02 0.00 0.36 0.00 0.00 54.97 54.77 3hs0 s GLU 508 Cb 0.00 -2.87 -0.02 0.00 0.26 0.00 0.00 34.13 31.50 3hs0 s GLU 508 CO 0.00 0.23 -0.09 0.42 -0.54 0.00 0.00 175.26 175.29 3hs0 s ILE 509 N 0.37 3.41 -0.18 -3.70 1.01 -1.26 -1.17 121.20 119.68 3hs0 s ILE 509 Ca -0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.06 3hs0 s ILE 509 Cb -0.14 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.86 3hs0 s ILE 509 CO 0.03 0.51 -0.14 -0.69 0.00 0.00 0.00 174.94 174.65 3hs0 s VAL 510 N 0.40 2.66 0.26 2.92 1.01 -0.58 -4.82 120.40 122.24 3hs0 s VAL 510 Ca -0.08 -0.75 0.11 0.00 0.00 0.00 0.00 61.98 61.26 3hs0 s VAL 510 Cb -0.15 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 3hs0 s VAL 510 CO 0.04 0.50 -0.19 0.00 0.00 0.00 0.00 175.10 175.46 3hs0 s ALA 511 N 1.14 2.54 -0.04 5.51 0.00 -1.26 -1.84 121.76 127.82 3hs0 s ALA 511 Ca 0.01 -1.82 -0.27 0.00 0.00 0.00 0.00 51.96 49.89 3hs0 s ALA 511 Cb -0.14 -0.21 0.06 0.00 0.00 0.00 0.00 23.12 22.82 3hs0 s ALA 511 CO -0.05 0.22 0.58 0.34 0.00 0.00 0.00 175.76 176.86 3hs0 s ASP 512 N -3.44 -0.54 0.25 0.00 2.15 -0.36 -4.63 116.67 110.11 3hs0 s ASP 512 Ca 0.28 0.55 0.04 0.00 0.43 0.00 0.00 52.55 53.85 3hs0 s ASP 512 Cb -0.04 0.48 -0.05 0.00 -0.30 0.00 0.00 42.92 43.01 3hs0 s ASP 512 CO 0.13 -0.57 -0.01 -0.94 -0.17 0.00 0.00 175.17 173.61 3hs0 s SER 513 N -1.22 2.12 -0.22 -0.34 1.04 -1.26 -1.07 113.70 112.75 3hs0 s SER 513 Ca -0.12 -1.22 -0.12 0.00 0.48 0.00 0.00 55.95 54.97 3hs0 s SER 513 Cb -0.01 -0.05 0.07 0.00 0.10 0.00 0.00 66.02 66.13 3hs0 s SER 513 CO 0.08 -0.47 0.53 -0.69 0.98 0.00 0.00 173.24 173.67 3hs0 s VAL 514 N -3.30 -0.01 -0.07 5.02 1.01 -0.25 -2.50 120.40 120.30 3hs0 s VAL 514 Ca 0.29 0.05 -0.18 0.00 0.00 0.00 0.00 61.98 62.15 3hs0 s VAL 514 Cb 0.05 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.61 3hs0 s VAL 514 CO 0.10 0.02 0.48 0.86 0.00 0.00 0.00 175.10 176.56 3hs0 s TRP 515 N 1.49 3.60 -0.14 5.22 -0.00 -1.16 -1.25 118.94 126.69 3hs0 s TRP 515 Ca -0.10 0.97 0.01 0.00 -0.00 0.00 0.00 56.10 56.98 3hs0 s TRP 515 Cb -0.07 -2.50 0.02 0.00 -0.00 0.00 0.00 33.47 30.92 3hs0 s TRP 515 CO -0.16 0.32 -0.14 0.08 -0.00 0.00 0.00 176.95 177.05 3hs0 s VAL 516 N 0.05 1.51 0.08 5.86 1.01 0.46 -5.00 120.40 124.37 3hs0 s VAL 516 Ca 0.26 -0.60 -0.21 0.00 0.00 0.00 0.00 61.98 61.43 3hs0 s VAL 516 Cb -0.16 -1.42 -0.07 0.00 0.00 0.00 0.00 36.38 34.74 3hs0 s VAL 516 CO 0.12 0.45 0.62 -0.62 0.00 0.00 0.00 175.10 175.67 3hs0 s ASP 517 N 1.41 7.12 0.11 3.32 2.15 -1.26 -0.74 116.67 128.78 3hs0 s ASP 517 Ca 0.03 1.33 0.09 0.00 0.43 0.00 0.00 52.55 54.42 3hs0 s ASP 517 Cb -0.13 -2.39 -0.04 0.00 -0.30 0.00 0.00 42.92 40.06 3hs0 s ASP 517 CO -0.09 0.23 -0.18 -0.69 -0.17 0.00 0.00 175.17 174.27 3hs0 s VAL 518 N -0.93 2.86 -0.10 1.11 1.01 -0.67 -4.34 120.40 119.34 3hs0 s VAL 518 Ca 0.31 -1.48 -0.29 0.00 0.00 0.00 0.00 61.98 60.51 3hs0 s VAL 518 Cb -0.20 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 3hs0 s VAL 518 CO 0.20 0.11 1.74 -0.75 0.00 0.00 0.00 175.10 176.41 3hs0 s LYS 519 N -2.12 3.98 -0.17 2.72 2.20 0.14 -4.63 119.74 121.88 3hs0 s LYS 519 Ca 0.18 2.11 -0.29 0.00 -0.36 0.00 0.00 55.97 57.60 3hs0 s LYS 519 Cb -0.11 -4.06 -0.02 0.00 -1.51 0.00 0.00 37.83 32.13 3hs0 s LYS 519 CO 0.10 -1.09 1.40 -0.51 -0.36 0.00 0.00 175.35 174.90 3hs0 s ASP 520 N 4.17 6.77 0.00 1.43 1.11 -1.26 -4.80 116.67 124.09 3hs0 s ASP 520 Ca 0.78 1.74 0.00 0.00 0.18 0.00 0.00 52.55 55.24 3hs0 s ASP 520 Cb -0.33 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.13 3hs0 s ASP 520 CO 0.32 -0.91 0.00 0.35 1.18 0.00 0.00 175.17 176.11 3hs0 n THR 521 N 5.65 0.00 -2.68 -1.27 -2.24 -1.26 -5.06 114.28 107.43 3hs0 n THR 521 Ca 0.15 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.56 3hs0 n THR 521 Cb 0.45 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.62 3hs0 n THR 521 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hs0 h MET 523 N 3.16 0.00 0.00 0.00 2.86 -2.00 -3.44 114.93 115.50 3hs0 h MET 523 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 3hs0 h MET 523 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 3hs0 h MET 523 CO 0.65 0.13 0.00 0.41 1.06 0.00 0.00 176.91 179.16 3hs0 n GLY 524 N -0.92 5.08 3.23 8.32 0.00 -1.26 -4.86 105.19 114.77 3hs0 n GLY 524 Ca -0.02 -1.72 -0.16 0.00 0.00 0.00 0.00 46.02 44.12 3hs0 n GLY 524 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hs0 s THR 525 N 2.92 1.22 -0.30 2.61 2.01 -1.26 -5.04 115.64 117.80 3hs0 s THR 525 Ca 0.00 -1.82 -0.12 0.00 0.31 0.00 0.00 61.69 60.06 3hs0 s THR 525 Cb 0.00 -1.60 0.14 0.00 0.01 0.00 0.00 72.50 71.05 3hs0 s THR 525 CO 0.00 -0.55 0.78 -0.22 -0.69 0.00 0.00 174.62 173.94 3hs0 s LEU 526 N -2.69 -0.93 -0.01 4.42 2.96 -1.25 -3.62 118.68 117.56 3hs0 s LEU 526 Ca 0.11 1.29 -0.00 0.00 -0.22 0.00 0.00 54.13 55.30 3hs0 s LEU 526 Cb -0.02 2.08 0.01 0.00 0.50 0.00 0.00 46.19 48.76 3hs0 s LEU 526 CO 0.02 -0.18 0.02 -0.69 -1.32 0.00 0.00 176.35 174.20 3hs0 s VAL 527 N 2.61 -0.01 -0.29 1.68 1.01 -0.18 -5.00 120.40 120.22 3hs0 s VAL 527 Ca -0.05 0.04 -0.06 0.00 0.00 0.00 0.00 61.98 61.91 3hs0 s VAL 527 Cb -0.09 -0.04 0.02 0.00 0.00 0.00 0.00 36.38 36.26 3hs0 s VAL 527 CO -0.18 0.02 0.07 -0.69 0.00 0.00 0.00 175.10 174.31 3hs0 s VAL 528 N 0.22 3.80 -0.10 2.92 1.01 -1.26 -1.57 120.40 125.43 3hs0 s VAL 528 Ca -0.02 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 3hs0 s VAL 528 Cb -0.03 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 3hs0 s VAL 528 CO -0.01 0.06 0.01 -0.54 0.00 0.00 0.00 175.10 174.62 3hs0 s LYS 529 N 1.46 3.11 0.00 2.72 1.02 -0.69 -4.96 119.74 122.41 3hs0 s LYS 529 Ca 0.02 -0.39 0.00 0.00 0.02 0.00 0.00 55.97 55.61 3hs0 s LYS 529 Cb -0.17 -2.85 0.00 0.00 -0.52 0.00 0.00 37.83 34.29 3hs0 s LYS 529 CO 0.02 0.65 0.00 0.41 -0.92 0.00 0.00 175.35 175.51 3hs0 n GLY 530 N 2.30 5.54 0.00 -3.33 0.00 -1.26 -1.13 105.19 107.31 3hs0 n GLY 530 Ca -0.19 -1.42 0.05 0.00 0.00 0.00 0.00 46.02 44.46 3hs0 n GLY 530 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hs0 n ASP 531 N 0.00 0.53 -1.40 1.61 5.75 -1.26 -5.00 116.55 116.79 3hs0 n ASP 531 Ca 0.00 -0.73 -0.18 0.00 -0.01 0.00 0.00 54.79 53.86 3hs0 n ASP 531 Cb 0.00 1.01 -0.08 0.00 -1.03 0.00 0.00 41.12 41.02 3hs0 n ASP 531 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3hs0 n ASN 532 N -1.26 -5.27 -4.87 -1.12 3.02 -1.26 -4.97 115.26 99.52 3hs0 n ASN 532 Ca 0.02 0.45 -0.32 0.00 -0.03 0.00 0.00 54.58 54.70 3hs0 n ASN 532 Cb 0.17 -4.38 -0.05 0.00 -0.61 0.00 0.00 39.78 34.90 3hs0 n ASN 532 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3hs0 s LEU 533 N -4.14 4.20 0.30 3.41 1.43 -1.26 -5.06 118.68 117.56 3hs0 s LEU 533 Ca 0.00 0.91 -0.29 0.00 -1.03 0.00 0.00 54.13 53.72 3hs0 s LEU 533 Cb 0.00 -3.60 -0.10 0.00 0.03 0.00 0.00 46.19 42.52 3hs0 s LEU 533 CO 0.00 -0.04 1.21 -0.63 0.23 0.00 0.00 176.35 177.12 3hs0 s ILE 534 N -1.76 3.08 0.12 -0.59 1.01 -1.26 -5.02 121.20 116.78 3hs0 s ILE 534 Ca 0.46 1.09 0.09 0.00 0.00 0.00 0.00 60.65 62.28 3hs0 s ILE 534 Cb -0.12 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 3hs0 s ILE 534 CO 0.21 0.26 -0.21 -1.10 0.00 0.00 0.00 174.94 174.10 3hs0 s GLN 535 N -1.58 1.19 0.46 2.79 -1.52 -1.26 -5.14 119.66 114.60 3hs0 s GLN 535 Ca 0.47 -1.25 -0.14 0.00 -1.95 0.00 0.00 55.36 52.49 3hs0 s GLN 535 Cb -0.36 -1.42 -0.07 0.00 -0.22 0.00 0.00 33.01 30.94 3hs0 s GLN 535 CO 0.47 0.32 0.89 -1.64 -0.25 0.00 0.00 175.29 175.08 3hs0 s MET 536 N -2.17 3.89 0.55 2.91 -1.94 -1.26 -5.04 119.30 116.23 3hs0 s MET 536 Ca 0.10 0.76 -0.21 0.00 -1.71 0.00 0.00 55.69 54.62 3hs0 s MET 536 Cb -0.09 -2.25 -0.05 0.00 2.01 0.00 0.00 34.83 34.46 3hs0 s MET 536 CO 0.05 -0.16 1.31 -2.14 -0.01 0.00 0.00 175.02 174.07 3hs0 s PRO 537 N -3.91 3.17 -1.64 2.03 0.02 -1.26 -2.84 135.00 130.56 3hs0 s PRO 537 Ca 0.56 2.10 0.00 0.00 0.02 0.00 0.00 61.00 63.68 3hs0 s PRO 537 Cb -0.10 -2.21 0.00 0.00 0.02 0.00 0.00 34.50 32.21 3hs0 s PRO 537 CO 0.30 -1.13 0.00 0.41 -0.33 0.00 0.00 177.00 176.26 3hs0 n GLY 538 N 0.68 1.25 3.89 0.52 0.00 -1.26 -4.99 105.19 105.28 3hs0 n GLY 538 Ca 0.11 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 3hs0 n GLY 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hs0 s ALA 539 N -2.64 3.31 -0.04 4.61 0.00 -1.13 -5.04 121.76 120.83 3hs0 s ALA 539 Ca 0.00 -0.36 -0.30 0.00 0.00 0.00 0.00 51.96 51.30 3hs0 s ALA 539 Cb 0.00 -2.74 -0.02 0.00 0.00 0.00 0.00 23.12 20.36 3hs0 s ALA 539 CO 0.00 -0.42 1.00 0.00 0.00 0.00 0.00 175.76 176.34 3hs0 s ALA 540 N -2.83 3.27 0.13 0.00 0.00 -1.26 -5.05 121.76 116.02 3hs0 s ALA 540 Ca 0.50 0.48 0.08 0.00 0.00 0.00 0.00 51.96 53.03 3hs0 s ALA 540 Cb -0.10 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 3hs0 s ALA 540 CO 0.46 -0.39 -0.13 -1.64 0.00 0.00 0.00 175.76 174.05 3hs0 s MET 541 N 1.43 1.95 0.01 0.00 -1.94 -1.26 -5.13 119.30 114.36 3hs0 s MET 541 Ca 0.51 -1.16 0.05 0.00 -1.71 0.00 0.00 55.69 53.37 3hs0 s MET 541 Cb -0.20 -2.18 -0.02 0.00 2.01 0.00 0.00 34.83 34.45 3hs0 s MET 541 CO 0.24 0.47 -0.14 0.15 -0.01 0.00 0.00 175.02 175.73 3hs0 s LYS 542 N -2.36 1.04 0.02 2.03 1.02 -1.26 -5.16 119.74 115.07 3hs0 s LYS 542 Ca 0.21 -0.63 -0.03 0.00 0.02 0.00 0.00 55.97 55.55 3hs0 s LYS 542 Cb -0.10 -1.03 -0.01 0.00 -0.52 0.00 0.00 37.83 36.16 3hs0 s LYS 542 CO 0.13 0.27 0.03 0.96 -0.92 0.00 0.00 175.35 175.81 3hs0 s ILE 543 N -0.58 0.11 -0.16 2.17 -4.36 -1.26 -4.70 121.20 112.42 3hs0 s ILE 543 Ca 0.04 -0.89 -0.06 0.00 -0.26 0.00 0.00 60.65 59.48 3hs0 s ILE 543 Cb -0.07 -0.40 -0.04 0.00 1.25 0.00 0.00 42.46 43.21 3hs0 s ILE 543 CO 0.00 -0.49 0.02 -0.54 0.24 0.00 0.00 174.94 174.18 3hs0 s LYS 544 N -1.60 3.78 -0.35 0.37 1.02 -0.28 -4.96 119.74 117.71 3hs0 s LYS 544 Ca -0.14 -0.41 -0.13 0.00 0.02 0.00 0.00 55.97 55.31 3hs0 s LYS 544 Cb -0.08 -3.07 -0.01 0.00 -0.52 0.00 0.00 37.83 34.15 3hs0 s LYS 544 CO -0.01 0.31 0.24 -0.51 -0.92 0.00 0.00 175.35 174.46 3hs0 s LEU 545 N 0.23 4.56 -0.23 3.17 1.43 -1.26 -1.70 118.68 124.87 3hs0 s LEU 545 Ca 0.02 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.60 3hs0 s LEU 545 Cb -0.13 -2.13 0.02 0.00 0.03 0.00 0.00 46.19 43.98 3hs0 s LEU 545 CO 0.01 -0.26 -0.09 -1.61 0.23 0.00 0.00 176.35 174.64 3hs0 s GLU 546 N 1.70 2.96 0.00 1.70 2.02 -0.61 -4.99 118.70 121.49 3hs0 s GLU 546 Ca 0.06 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.16 3hs0 s GLU 546 Cb -0.18 -2.91 0.00 0.00 0.10 0.00 0.00 34.13 31.15 3hs0 s GLU 546 CO 0.10 -0.33 0.00 0.41 0.02 0.00 0.00 175.26 175.46 3hs0 n GLY 547 N 4.68 2.16 3.77 -1.39 0.00 -1.26 -1.01 105.19 112.14 3hs0 n GLY 547 Ca -0.18 -0.93 -0.40 0.00 0.00 0.00 0.00 46.02 44.52 3hs0 n GLY 547 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hs0 s ASP 548 N -0.18 6.47 0.08 1.61 1.01 -1.24 -4.92 116.67 119.50 3hs0 s ASP 548 Ca 0.00 2.60 -0.31 0.00 0.71 0.00 0.00 52.55 55.56 3hs0 s ASP 548 Cb 0.00 -2.64 -0.09 0.00 1.01 0.00 0.00 42.92 41.20 3hs0 s ASP 548 CO 0.00 -0.74 1.74 -2.84 0.21 0.00 0.00 175.17 173.55 3hs0 s PRO 549 N -2.13 4.17 0.00 8.23 0.02 -1.26 -1.73 135.00 142.30 3hs0 s PRO 549 Ca 0.55 2.44 0.00 0.00 0.02 0.00 0.00 61.00 64.01 3hs0 s PRO 549 Cb -0.37 -3.66 0.00 0.00 0.02 0.00 0.00 34.50 30.49 3hs0 s PRO 549 CO 0.48 -0.80 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 3hs0 n GLY 550 N 4.13 0.44 3.50 0.52 0.00 -1.26 -5.05 105.19 107.47 3hs0 n GLY 550 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3hs0 n GLY 550 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hs0 n ALA 551 N -1.98 -0.93 -3.71 4.61 0.00 -0.71 -4.98 120.51 112.81 3hs0 n ALA 551 Ca 0.00 0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.18 3hs0 n ALA 551 Cb 0.00 -1.87 -0.14 0.00 0.00 0.00 0.00 19.45 17.44 3hs0 n ALA 551 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3hs0 s ARG 552 N -1.95 2.50 -0.21 0.00 3.52 -1.26 -5.06 118.95 116.49 3hs0 s ARG 552 Ca 0.66 -1.21 -0.06 0.00 -0.13 0.00 0.00 55.73 55.00 3hs0 s ARG 552 Cb -0.52 -3.10 -0.03 0.00 -1.56 0.00 0.00 34.95 29.74 3hs0 s ARG 552 CO 0.55 -0.56 0.03 0.08 -0.81 0.00 0.00 175.30 174.59 3hs0 s VAL 553 N 1.25 4.16 -0.23 7.11 1.01 -1.26 -5.08 120.40 127.36 3hs0 s VAL 553 Ca -0.04 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.55 3hs0 s VAL 553 Cb -0.19 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 3hs0 s VAL 553 CO -0.02 0.41 0.36 -0.83 0.00 0.00 0.00 175.10 175.02 3hs0 s GLY 554 N 1.08 2.01 0.20 4.51 0.00 -1.26 -5.09 107.32 108.77 3hs0 s GLY 554 Ca 0.03 -0.66 0.06 0.00 0.00 0.00 0.00 44.72 44.15 3hs0 s GLY 554 CO 0.02 0.82 0.15 1.08 0.00 0.00 0.00 173.10 175.17 3hs0 s LEU 555 N 1.52 3.78 -0.08 0.66 1.43 -1.26 -5.13 118.68 119.59 3hs0 s LEU 555 Ca 0.16 -0.19 -0.24 0.00 -1.03 0.00 0.00 54.13 52.84 3hs0 s LEU 555 Cb -0.15 -2.36 0.05 0.00 0.03 0.00 0.00 46.19 43.76 3hs0 s LEU 555 CO 0.08 0.03 0.55 0.54 0.23 0.00 0.00 176.35 177.78 3hs0 s VAL 556 N -1.89 0.02 -0.14 -1.59 0.11 -1.26 -5.15 120.40 110.49 3hs0 s VAL 556 Ca 0.31 -0.13 0.00 0.00 -2.93 0.00 0.00 61.98 59.23 3hs0 s VAL 556 Cb -0.09 -0.84 -0.01 0.00 -1.53 0.00 0.00 36.38 33.91 3hs0 s VAL 556 CO 0.24 -0.07 -0.14 0.00 -3.33 0.00 0.00 175.10 171.79 3hs0 s ALA 557 N -0.84 2.55 -0.07 1.54 0.00 -1.26 -5.12 121.76 118.57 3hs0 s ALA 557 Ca -0.09 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 50.93 3hs0 s ALA 557 Cb -0.03 -1.22 0.01 0.00 0.00 0.00 0.00 23.12 21.88 3hs0 s ALA 557 CO 0.06 0.11 -0.15 0.08 0.00 0.00 0.00 175.76 175.85 3hs0 s VAL 558 N 0.59 1.37 0.24 0.00 1.01 -1.26 -5.10 120.40 117.24 3hs0 s VAL 558 Ca -0.08 -0.63 -0.31 0.00 0.00 0.00 0.00 61.98 60.95 3hs0 s VAL 558 Cb -0.16 -1.22 -0.13 0.00 0.00 0.00 0.00 36.38 34.88 3hs0 s VAL 558 CO 0.03 0.40 1.58 -0.67 0.00 0.00 0.00 175.10 176.45 3hs0 n ASP 559 N 3.63 3.50 0.16 3.32 -0.08 -1.26 -4.81 116.55 121.01 3hs0 n ASP 559 Ca -0.21 1.11 0.10 0.00 -1.51 0.00 0.00 54.79 54.29 3hs0 n ASP 559 Cb 0.52 -1.52 0.56 0.00 2.34 0.00 0.00 41.12 43.02 3hs0 n ASP 559 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 3hs0 n LYS 560 N 2.79 0.13 0.23 -0.67 4.81 -1.26 -0.63 118.16 123.55 3hs0 n LYS 560 Ca 0.13 0.63 0.09 0.00 -0.87 0.00 0.00 58.31 58.28 3hs0 n LYS 560 Cb 0.34 -1.98 0.55 0.00 0.02 0.00 0.00 35.03 33.96 3hs0 n LYS 560 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hs0 h ALA 561 N 1.89 1.27 0.01 3.14 0.00 -1.90 -2.93 119.26 120.74 3hs0 h ALA 561 Ca 0.00 -0.20 -0.33 0.00 0.00 0.00 0.00 54.91 54.38 3hs0 h ALA 561 Cb 0.08 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3hs0 h ALA 561 CO 0.00 0.28 -1.81 0.28 0.00 0.00 0.00 179.25 178.00 3hs0 n VAL 562 N -3.75 1.54 -0.05 0.00 0.31 0.20 -4.30 118.33 112.28 3hs0 n VAL 562 Ca -0.01 -0.20 0.25 0.00 -0.01 0.00 0.00 64.34 64.36 3hs0 n VAL 562 Cb 0.33 -1.95 0.71 0.00 -0.91 0.00 0.00 33.84 32.02 3hs0 n VAL 562 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 3hs0 h TYR 563 N -0.92 0.00 0.00 3.52 3.20 -1.53 0.29 116.97 121.52 3hs0 h TYR 563 Ca -0.49 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.38 3hs0 h TYR 563 Cb 1.47 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.74 3hs0 h TYR 563 CO 0.02 0.00 -0.30 -0.39 -1.64 0.00 0.00 178.16 175.86 3hs0 h VAL 564 N 0.00 0.00 -3.48 1.81 -1.51 -1.72 -3.44 116.25 107.91 3hs0 h VAL 564 Ca 0.32 -0.82 -0.53 0.00 -1.23 0.00 0.00 66.70 64.44 3hs0 h VAL 564 Cb 1.50 1.65 -0.03 0.00 -2.13 0.00 0.00 31.29 32.28 3hs0 h VAL 564 CO -0.00 0.00 -0.02 -0.76 -1.23 0.00 0.00 177.57 175.56 3hs0 s LEU 565 N -5.40 4.24 -1.30 4.19 1.02 0.10 -4.45 118.68 117.09 3hs0 s LEU 565 Ca 0.06 1.15 -0.07 0.00 0.02 0.00 0.00 54.13 55.29 3hs0 s LEU 565 Cb 0.09 -3.60 -0.00 0.00 0.02 0.00 0.00 46.19 42.70 3hs0 s LEU 565 CO 0.69 -0.02 0.60 0.59 0.02 0.00 0.00 176.35 178.23 3hs0 n ASN 566 N 0.32 -2.10 -0.34 2.29 3.02 -1.26 -4.82 115.26 112.37 3hs0 n ASN 566 Ca -0.01 -0.96 0.22 0.00 -0.03 0.00 0.00 54.58 53.80 3hs0 n ASN 566 Cb 0.52 -3.41 0.48 0.00 -0.61 0.00 0.00 39.78 36.76 3hs0 n ASN 566 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 3hs0 h ASP 567 N -1.85 0.50 -1.01 6.41 3.45 -1.85 -2.37 116.42 119.71 3hs0 h ASP 567 Ca -0.64 0.11 0.13 0.00 0.43 0.00 0.00 57.03 57.07 3hs0 h ASP 567 Cb 1.37 0.04 -0.09 0.00 -0.56 0.00 0.00 39.33 40.08 3hs0 h ASP 567 CO 0.56 0.05 0.63 0.11 -1.57 0.00 0.00 179.24 179.03 3hs0 h LYS 568 N 0.42 0.93 0.00 3.56 1.57 -1.97 -2.24 116.57 118.83 3hs0 h LYS 568 Ca 0.64 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 3hs0 h LYS 568 Cb 1.53 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.63 3hs0 h LYS 568 CO -0.38 0.61 -0.12 1.88 -0.57 0.00 0.00 179.45 180.87 3hs0 h TYR 569 N 0.96 0.00 -4.17 -1.35 0.05 -1.76 -3.47 116.97 107.22 3hs0 h TYR 569 Ca 0.51 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.78 3hs0 h TYR 569 Cb 0.56 0.00 0.12 0.00 1.01 0.00 0.00 36.73 38.42 3hs0 h TYR 569 CO -0.00 0.00 0.40 0.21 -1.05 0.00 0.00 178.16 177.71 3hs0 s LYS 570 N -3.14 2.66 0.01 4.88 2.20 -0.85 -4.68 119.74 120.83 3hs0 s LYS 570 Ca 0.09 1.57 -0.17 0.00 -0.36 0.00 0.00 55.97 57.10 3hs0 s LYS 570 Cb 0.11 -1.92 -0.06 0.00 -1.51 0.00 0.00 37.83 34.46 3hs0 s LYS 570 CO 0.63 -1.39 0.48 -1.50 -0.36 0.00 0.00 175.35 173.21 3hs0 s ILE 571 N -2.09 4.95 0.11 5.43 2.07 -1.26 -5.03 121.20 125.38 3hs0 s ILE 571 Ca 0.71 1.00 -0.04 0.00 -1.41 0.00 0.00 60.65 60.91 3hs0 s ILE 571 Cb -0.25 -3.80 -0.03 0.00 0.13 0.00 0.00 42.46 38.52 3hs0 s ILE 571 CO 0.40 0.53 0.10 -0.94 -1.91 0.00 0.00 174.94 173.12 3hs0 s SER 572 N -0.81 0.27 0.20 4.50 1.04 -1.26 -5.04 113.70 112.60 3hs0 s SER 572 Ca 0.26 -1.02 -0.12 0.00 0.48 0.00 0.00 55.95 55.56 3hs0 s SER 572 Cb -0.17 0.31 0.12 0.00 0.10 0.00 0.00 66.02 66.38 3hs0 s SER 572 CO 0.15 -0.73 1.86 -0.61 0.98 0.00 0.00 173.24 174.89 3hs0 h GLN 573 N 2.85 0.89 -0.51 4.02 5.75 -2.00 -2.57 115.11 123.53 3hs0 h GLN 573 Ca -0.34 -0.05 0.10 0.00 -0.15 0.00 0.00 58.65 58.20 3hs0 h GLN 573 Cb 1.19 -0.20 -0.08 0.00 1.07 0.00 0.00 27.48 29.46 3hs0 h GLN 573 CO 0.58 0.59 0.03 0.00 -2.65 0.00 0.00 178.83 177.38 3hs0 h ALA 574 N 1.24 0.52 -0.05 3.38 0.00 -1.97 -0.98 119.26 121.41 3hs0 h ALA 574 Ca 0.25 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.24 3hs0 h ALA 574 Cb -0.10 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3hs0 h ALA 574 CO -0.05 -0.37 -0.26 0.87 0.00 0.00 0.00 179.25 179.44 3hs0 h LYS 575 N 0.15 0.08 0.33 0.00 1.57 -1.88 -1.01 116.57 115.80 3hs0 h LYS 575 Ca 0.26 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 3hs0 h LYS 575 Cb 0.39 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.69 3hs0 h LYS 575 CO -0.41 0.34 -0.16 0.82 -0.57 0.00 0.00 179.45 179.47 3hs0 h ILE 576 N 0.07 0.68 -0.72 1.86 2.04 -0.83 -1.51 117.51 119.11 3hs0 h ILE 576 Ca 0.01 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 3hs0 h ILE 576 Cb 0.50 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 3hs0 h ILE 576 CO 0.04 0.10 0.33 -0.50 0.00 0.00 0.00 178.15 178.11 3hs0 h TRP 577 N -0.72 1.05 -0.36 1.37 -0.00 -1.20 -1.65 115.95 114.43 3hs0 h TRP 577 Ca -0.04 -0.06 -0.03 0.00 -0.00 0.00 0.00 58.89 58.76 3hs0 h TRP 577 Cb 0.49 -0.32 -0.02 0.00 -0.00 0.00 0.00 29.16 29.31 3hs0 h TRP 577 CO 0.01 0.79 0.11 0.22 -0.00 0.00 0.00 178.44 179.57 3hs0 h ASP 578 N 1.01 0.46 -0.13 -3.49 3.58 -1.22 0.09 116.42 116.73 3hs0 h ASP 578 Ca 0.25 -0.05 -0.11 0.00 0.42 0.00 0.00 57.03 57.53 3hs0 h ASP 578 Cb 0.14 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 3hs0 h ASP 578 CO -0.03 0.46 -0.28 0.74 -2.88 0.00 0.00 179.24 177.24 3hs0 h THR 579 N 0.51 1.28 -0.20 2.25 2.02 -0.66 -2.77 112.91 115.34 3hs0 h THR 579 Ca 0.12 -1.38 -0.04 0.00 0.77 0.00 0.00 66.41 65.89 3hs0 h THR 579 Cb 0.16 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 3hs0 h THR 579 CO -0.01 0.44 -0.03 0.40 0.37 0.00 0.00 175.52 176.69 3hs0 h ILE 580 N 0.52 1.28 0.00 3.11 1.08 -0.32 -3.13 117.51 120.05 3hs0 h ILE 580 Ca 0.07 -0.98 -0.04 0.00 -0.39 0.00 0.00 64.86 63.52 3hs0 h ILE 580 Cb 0.76 1.52 -0.01 0.00 -3.07 0.00 0.00 36.82 36.02 3hs0 h ILE 580 CO 0.06 0.30 -0.19 -0.33 -0.69 0.00 0.00 178.15 177.29 3hs0 h GLU 581 N 0.10 0.00 0.00 2.37 4.39 -0.98 -1.84 114.58 118.63 3hs0 h GLU 581 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 3hs0 h GLU 581 Cb 0.46 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 3hs0 h GLU 581 CO 0.02 0.19 -0.25 1.63 -1.16 0.00 0.00 179.01 179.44 3hs0 n LYS 582 N -3.72 0.02 -0.80 2.33 4.76 -1.05 -3.24 118.16 116.45 3hs0 n LYS 582 Ca -0.02 0.01 0.07 0.00 -2.87 0.00 0.00 58.31 55.50 3hs0 n LYS 582 Cb 0.30 -1.51 0.37 0.00 -1.84 0.00 0.00 35.03 32.35 3hs0 n LYS 582 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 3hs0 n SER 583 N -1.54 5.28 -4.72 4.39 7.64 -0.69 -4.97 113.62 119.00 3hs0 n SER 583 Ca 0.06 -2.98 -0.42 0.00 1.01 0.00 0.00 58.87 56.55 3hs0 n SER 583 Cb 0.34 -0.66 -0.03 0.00 -1.01 0.00 0.00 64.21 62.85 3hs0 n SER 583 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3hs0 s ASP 584 N -1.08 6.95 0.00 6.43 -1.08 -1.20 -4.88 116.67 121.82 3hs0 s ASP 584 Ca 0.52 2.25 0.27 0.00 -0.52 0.00 0.00 52.55 55.07 3hs0 s ASP 584 Cb 0.40 -2.59 1.20 0.00 -1.46 0.00 0.00 42.92 40.47 3hs0 s ASP 584 CO 0.14 -0.52 1.88 0.49 0.52 0.00 0.00 175.17 177.68 3hs0 n PHE 585 N 3.34 0.00 -3.25 -5.34 3.72 -1.26 -4.71 117.46 109.96 3hs0 n PHE 585 Ca 0.08 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.09 3hs0 n PHE 585 Cb 0.44 -0.45 -0.06 0.00 -0.94 0.00 0.00 39.48 38.46 3hs0 n PHE 585 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3hs0 s GLY 586 N -2.91 2.69 -0.05 1.37 0.00 -1.26 -4.19 107.32 102.98 3hs0 s GLY 586 Ca 0.16 0.06 -0.05 0.00 0.00 0.00 0.00 44.72 44.88 3hs0 s GLY 586 CO 0.47 0.50 -0.10 0.00 0.00 0.00 0.00 173.10 173.97 3hs0 n THR 588 N -3.10 0.00 -0.50 0.00 -2.24 -1.19 -5.02 114.28 102.23 3hs0 n THR 588 Ca -0.04 -0.91 0.09 0.00 -2.27 0.00 0.00 64.05 60.92 3hs0 n THR 588 Cb 0.15 -1.29 0.31 0.00 -2.10 0.00 0.00 70.33 67.39 3hs0 n THR 588 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hs0 n ALA 589 N -3.19 2.72 0.00 6.98 0.00 -1.26 -4.90 120.51 120.86 3hs0 n ALA 589 Ca -0.13 -1.49 0.00 0.00 0.00 0.00 0.00 53.44 51.82 3hs0 n ALA 589 Cb 0.40 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.98 3hs0 n ALA 589 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hs0 n GLY 590 N 1.05 3.45 7.00 0.00 0.00 -1.26 -2.99 105.19 112.44 3hs0 n GLY 590 Ca 0.23 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.92 3hs0 n GLY 590 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3hs0 n SER 591 N 0.00 -0.23 0.00 1.61 2.88 -1.04 -4.47 113.62 112.37 3hs0 n SER 591 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3hs0 n SER 591 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3hs0 n SER 591 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hs0 n GLY 592 N 0.00 -0.93 0.00 0.46 0.00 -1.26 -4.14 105.19 99.32 3hs0 n GLY 592 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.80 3hs0 n GLY 592 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3hs0 n GLN 593 N -0.68 0.00 -1.03 1.61 -0.06 -1.26 -4.51 117.38 111.45 3hs0 n GLN 593 Ca 0.00 0.00 -0.30 0.00 -2.00 0.00 0.00 57.00 54.70 3hs0 n GLN 593 Cb 0.00 -0.16 0.23 0.00 -4.06 0.00 0.00 30.24 26.25 3hs0 n GLN 593 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 3hs0 s ASN 594 N -1.46 1.21 0.41 1.69 4.22 -1.26 -1.91 114.94 117.83 3hs0 s ASN 594 Ca 0.00 0.83 0.09 0.00 -2.14 0.00 0.00 52.86 51.64 3hs0 s ASN 594 Cb 0.00 -1.22 0.86 0.00 1.28 0.00 0.00 41.25 42.17 3hs0 s ASN 594 CO 0.00 -3.97 1.99 -0.55 -2.04 0.00 0.00 177.10 172.53 3hs0 h ASN 595 N -2.47 0.30 -0.57 3.54 7.08 -1.88 -1.98 115.58 119.60 3hs0 h ASN 595 Ca -0.48 -0.04 -0.03 0.00 -3.08 0.00 0.00 56.30 52.67 3hs0 h ASN 595 Cb 1.31 -0.08 -0.03 0.00 -2.08 0.00 0.00 38.32 37.45 3hs0 h ASN 595 CO 0.41 0.34 0.25 -0.07 -2.08 0.00 0.00 177.43 176.28 3hs0 h LEU 596 N 0.33 0.77 -0.80 6.14 3.38 -1.94 -3.16 115.31 120.03 3hs0 h LEU 596 Ca 0.08 -0.15 0.10 0.00 0.09 0.00 0.00 57.88 58.00 3hs0 h LEU 596 Cb 0.17 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.65 3hs0 h LEU 596 CO 0.00 0.70 0.45 1.23 0.09 0.00 0.00 178.44 180.91 3hs0 h GLY 597 N 0.78 1.24 0.25 0.83 0.00 -1.69 -0.06 103.07 104.42 3hs0 h GLY 597 Ca 0.19 -0.29 0.02 0.00 0.00 0.00 0.00 47.33 47.25 3hs0 h GLY 597 CO -0.02 0.10 -0.45 -2.08 0.00 0.00 0.00 176.54 174.09 3hs0 h VAL 598 N 0.74 0.11 0.37 4.60 2.07 -1.49 0.23 116.25 122.88 3hs0 h VAL 598 Ca 0.39 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.90 3hs0 h VAL 598 Cb 0.39 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 3hs0 h VAL 598 CO -0.26 0.00 -0.25 -0.26 0.02 0.00 0.00 177.57 176.82 3hs0 h PHE 599 N -0.70 -0.66 -0.78 1.57 0.04 -1.51 -1.72 116.94 113.18 3hs0 h PHE 599 Ca 0.01 -0.00 0.17 0.00 2.80 0.00 0.00 57.97 60.95 3hs0 h PHE 599 Cb 0.71 0.24 -0.11 0.00 2.20 0.00 0.00 35.95 38.99 3hs0 h PHE 599 CO -0.38 -0.38 0.24 0.93 -0.60 0.00 0.00 178.31 178.12 3hs0 h GLU 600 N -0.60 0.31 0.00 1.51 5.08 -0.87 -0.77 114.58 119.23 3hs0 h GLU 600 Ca -0.03 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3hs0 h GLU 600 Cb 0.51 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 3hs0 h GLU 600 CO 0.02 0.21 -0.12 -0.44 -1.00 0.00 0.00 179.01 177.68 3hs0 h ASP 601 N 0.32 0.00 1.02 1.42 5.19 -0.21 -2.59 116.42 121.57 3hs0 h ASP 601 Ca 0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.86 3hs0 h ASP 601 Cb 0.79 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.30 3hs0 h ASP 601 CO -0.51 0.12 -0.33 0.00 -3.12 0.00 0.00 179.24 175.40 3hs0 n ALA 602 N -2.16 2.74 -0.58 3.45 0.00 -0.41 -1.82 120.51 121.73 3hs0 n ALA 602 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3hs0 n ALA 602 Cb 0.40 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.55 3hs0 n ALA 602 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hs0 n GLY 603 N 1.38 1.25 3.74 0.00 0.00 -0.97 -4.13 105.19 106.47 3hs0 n GLY 603 Ca 0.05 -0.32 -0.22 0.00 0.00 0.00 0.00 46.02 45.52 3hs0 n GLY 603 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hs0 s LEU 604 N 0.00 3.51 -0.14 0.99 1.43 -0.55 -0.98 118.68 122.95 3hs0 s LEU 604 Ca 0.00 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.66 3hs0 s LEU 604 Cb 0.00 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.18 3hs0 s LEU 604 CO 0.00 -0.04 -0.19 0.00 0.23 0.00 0.00 176.35 176.35 3hs0 s ALA 605 N -2.24 2.37 -0.01 4.21 0.00 0.32 -3.92 121.76 122.49 3hs0 s ALA 605 Ca 0.33 -1.04 0.08 0.00 0.00 0.00 0.00 51.96 51.33 3hs0 s ALA 605 Cb -0.07 -1.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.95 3hs0 s ALA 605 CO 0.23 0.04 -0.25 -1.17 0.00 0.00 0.00 175.76 174.61 3hs0 s LEU 606 N 0.70 2.06 -0.08 0.00 2.96 -1.26 -1.13 118.68 121.93 3hs0 s LEU 606 Ca -0.09 -0.47 -0.10 0.00 -0.22 0.00 0.00 54.13 53.26 3hs0 s LEU 606 Cb -0.16 -1.28 0.02 0.00 0.50 0.00 0.00 46.19 45.27 3hs0 s LEU 606 CO 0.01 0.30 0.26 0.28 -1.32 0.00 0.00 176.35 175.89 3hs0 s THR 607 N -0.61 0.01 0.29 3.68 -1.32 -0.79 -1.88 115.64 115.03 3hs0 s THR 607 Ca 0.10 -0.11 0.03 0.00 -1.21 0.00 0.00 61.69 60.50 3hs0 s THR 607 Cb -0.10 -0.41 -0.04 0.00 -1.51 0.00 0.00 72.50 70.44 3hs0 s THR 607 CO -0.01 -0.06 0.16 0.42 -2.21 0.00 0.00 174.62 172.92 3hs0 s THR 608 N -0.15 0.31 -1.46 5.08 -4.23 -1.19 -0.33 115.64 113.67 3hs0 s THR 608 Ca -0.03 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.50 3hs0 s THR 608 Cb -0.03 -2.52 0.06 0.00 1.34 0.00 0.00 72.50 71.35 3hs0 s THR 608 CO 0.01 0.00 0.82 -1.54 -0.54 0.00 0.00 174.62 173.37 3hs0 n SER 609 N -0.88 0.85 -0.73 3.99 3.41 -0.41 -3.18 113.62 116.67 3hs0 n SER 609 Ca 0.01 -2.04 0.06 0.00 -0.26 0.00 0.00 58.87 56.64 3hs0 n SER 609 Cb 0.65 -0.28 0.17 0.00 -0.26 0.00 0.00 64.21 64.48 3hs0 n SER 609 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3hs0 n THR 610 N -0.14 1.73 -1.83 6.66 -2.24 -1.26 -4.95 114.28 112.26 3hs0 n THR 610 Ca 0.02 -2.70 -0.20 0.00 -2.27 0.00 0.00 64.05 58.90 3hs0 n THR 610 Cb 0.19 0.01 -0.06 0.00 -2.10 0.00 0.00 70.33 68.36 3hs0 n THR 610 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3hs0 n ASN 611 N -0.82 -5.39 -4.43 3.42 3.02 -1.19 -4.92 115.26 104.96 3hs0 n ASN 611 Ca 0.16 0.35 -0.44 0.00 -0.03 0.00 0.00 54.58 54.61 3hs0 n ASN 611 Cb 0.77 -4.69 -0.03 0.00 -0.61 0.00 0.00 39.78 35.23 3hs0 n ASN 611 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3hs0 s LEU 612 N -5.04 5.29 0.05 3.41 2.96 -1.26 -4.97 118.68 119.12 3hs0 s LEU 612 Ca 0.00 -2.05 0.04 0.00 -0.22 0.00 0.00 54.13 51.91 3hs0 s LEU 612 Cb 0.00 -2.37 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 3hs0 s LEU 612 CO 0.00 -1.01 -0.05 0.20 -1.32 0.00 0.00 176.35 174.17 3hs0 s ASN 613 N 3.41 4.74 -0.10 3.68 -0.87 -1.26 -3.15 114.94 121.39 3hs0 s ASN 613 Ca 0.29 -0.20 -0.26 0.00 -1.57 0.00 0.00 52.86 51.12 3hs0 s ASN 613 Cb -0.07 -1.08 -0.02 0.00 -0.02 0.00 0.00 41.25 40.05 3hs0 s ASN 613 CO -0.07 0.23 0.82 0.42 -2.57 0.00 0.00 177.10 175.93 3hs0 s THR 614 N -1.15 4.93 0.78 1.60 -4.23 -0.79 -5.00 115.64 111.78 3hs0 s THR 614 Ca 0.21 1.67 -0.16 0.00 -1.18 0.00 0.00 61.69 62.23 3hs0 s THR 614 Cb -0.11 -4.15 -0.08 0.00 1.34 0.00 0.00 72.50 69.50 3hs0 s THR 614 CO 0.13 0.13 0.04 2.29 -0.54 0.00 0.00 174.62 176.66 3hs0 n LYS 615 N 4.48 0.08 -0.97 3.99 2.85 -1.26 -4.84 118.16 122.49 3hs0 n LYS 615 Ca 0.03 0.05 -0.30 0.00 -1.05 0.00 0.00 58.31 57.04 3hs0 n LYS 615 Cb 0.50 -1.46 0.15 0.00 -0.65 0.00 0.00 35.03 33.58 3hs0 n LYS 615 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 3hs0 s GLN 616 N -2.34 1.04 -0.13 -1.58 -1.52 -1.26 -5.02 119.66 108.85 3hs0 s GLN 616 Ca 0.56 1.10 0.02 0.00 -1.95 0.00 0.00 55.36 55.09 3hs0 s GLN 616 Cb -0.32 -1.76 -0.00 0.00 -0.22 0.00 0.00 33.01 30.71 3hs0 s GLN 616 CO 0.67 -2.47 -0.19 0.50 -0.25 0.00 0.00 175.29 173.55 3hs0 s ARG 617 N -4.77 3.15 0.00 2.91 3.52 -1.26 -5.06 118.95 117.43 3hs0 s ARG 617 Ca 0.65 -0.80 0.00 0.00 -0.13 0.00 0.00 55.73 55.44 3hs0 s ARG 617 Cb -0.20 -2.48 0.00 0.00 -1.56 0.00 0.00 34.95 30.71 3hs0 s ARG 617 CO 0.58 0.10 0.41 0.43 -0.81 0.00 0.00 175.30 176.01 3hs0 n SER 618 N 3.80 0.00 -4.47 -2.12 7.64 -1.26 -4.93 113.62 112.28 3hs0 n SER 618 Ca -0.19 0.43 -0.23 0.00 1.01 0.00 0.00 58.87 59.89 3hs0 n SER 618 Cb 0.52 -0.08 -0.10 0.00 -1.01 0.00 0.00 64.21 63.54 3hs0 n SER 618 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hs0 s ALA 619 N -2.64 2.60 -0.56 -0.43 0.00 -1.26 -5.03 121.76 114.44 3hs0 s ALA 619 Ca 0.00 -1.96 0.23 0.00 0.00 0.00 0.00 51.96 50.23 3hs0 s ALA 619 Cb 0.00 0.04 0.94 0.00 0.00 0.00 0.00 23.12 24.10 3hs0 s ALA 619 CO 0.00 0.03 1.70 0.00 0.00 0.00 0.00 175.76 177.49 3hs0 n ALA 620 N -0.66 1.74 -2.76 0.00 0.00 -1.26 -4.69 120.51 112.89 3hs0 n ALA 620 Ca -0.05 0.06 -0.34 0.00 0.00 0.00 0.00 53.44 53.11 3hs0 n ALA 620 Cb 0.63 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.58 3hs0 n ALA 620 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3hs0 s LYS 621 N -3.26 3.16 0.53 0.00 1.02 -1.26 -4.70 119.74 115.22 3hs0 s LYS 621 Ca 0.05 -0.52 -0.20 0.00 0.02 0.00 0.00 55.97 55.32 3hs0 s LYS 621 Cb 0.10 -2.74 -0.06 0.00 -0.52 0.00 0.00 37.83 34.60 3hs0 s LYS 621 CO 0.41 0.50 1.14 0.00 -0.92 0.00 0.00 175.35 176.47 3hs0 n PRO 623 N -1.19 0.18 0.00 0.00 -0.02 -1.26 -5.16 135.00 127.56 3hs0 n PRO 623 Ca 0.11 0.10 0.14 0.00 -2.02 0.00 0.00 63.50 61.82 3hs0 n PRO 623 Cb 0.50 -1.66 0.44 0.00 -0.02 0.00 0.00 33.50 32.76 3hs0 n PRO 623 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48