#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mkv s THR 3 N 0.00 1.22 -0.01 1.09 2.01 -1.26 -2.20 115.64 116.48 3mkv s THR 3 Ca 0.00 -1.72 -0.16 0.00 0.31 0.00 0.00 61.69 60.12 3mkv s THR 3 Cb 0.00 -1.51 0.03 0.00 0.01 0.00 0.00 72.50 71.03 3mkv s THR 3 CO 0.00 -0.48 0.34 -0.36 -0.69 0.00 0.00 174.62 173.43 3mkv s PHE 4 N -2.30 -0.21 -0.04 4.92 0.08 -0.43 -2.73 117.98 117.26 3mkv s PHE 4 Ca 0.08 0.32 -0.02 0.00 0.12 0.00 0.00 56.93 57.43 3mkv s PHE 4 Cb -0.04 0.12 0.03 0.00 -0.57 0.00 0.00 43.02 42.56 3mkv s PHE 4 CO 0.02 -0.41 0.05 -1.17 -0.10 0.00 0.00 175.22 173.61 3mkv s LEU 5 N -1.35 0.20 -0.13 -0.37 0.20 0.17 -1.11 118.68 116.30 3mkv s LEU 5 Ca -0.13 0.06 -0.06 0.00 0.69 0.00 0.00 54.13 54.69 3mkv s LEU 5 Cb -0.05 -0.17 -0.04 0.00 -0.43 0.00 0.00 46.19 45.51 3mkv s LEU 5 CO 0.04 -0.24 0.10 -0.36 -0.29 0.00 0.00 176.35 175.60 3mkv s PHE 6 N 2.14 3.44 0.24 5.38 0.08 -0.73 0.68 117.98 129.20 3mkv s PHE 6 Ca 0.05 0.38 -0.17 0.00 0.12 0.00 0.00 56.93 57.31 3mkv s PHE 6 Cb -0.12 -1.94 0.01 0.00 -0.57 0.00 0.00 43.02 40.41 3mkv s PHE 6 CO -0.03 0.57 0.57 -0.98 -0.10 0.00 0.00 175.22 175.25 3mkv s ARG 7 N -0.73 1.56 -1.44 0.44 1.70 -0.92 -2.49 118.95 117.07 3mkv s ARG 7 Ca 0.13 -1.03 -0.05 0.00 -0.47 0.00 0.00 55.73 54.30 3mkv s ARG 7 Cb -0.12 0.53 0.01 0.00 -0.57 0.00 0.00 34.95 34.80 3mkv s ARG 7 CO 0.03 -0.67 0.72 -1.71 -1.08 0.00 0.00 175.30 172.58 3mkv n ASN 8 N -0.39 -6.00 -3.84 -2.89 5.15 -1.26 -2.01 115.26 104.02 3mkv n ASN 8 Ca -0.05 -0.33 -0.10 0.00 -0.60 0.00 0.00 54.58 53.49 3mkv n ASN 8 Cb 0.61 -4.77 -0.08 0.00 -0.53 0.00 0.00 39.78 35.01 3mkv n ASN 8 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3mkv s GLY 9 N -2.87 0.03 -0.02 8.20 0.00 -1.26 0.39 107.32 111.79 3mkv s GLY 9 Ca 0.36 -0.32 -0.30 0.00 0.00 0.00 0.00 44.72 44.46 3mkv s GLY 9 CO 0.44 -0.50 1.08 0.00 0.00 0.00 0.00 173.10 174.12 3mkv s ALA 10 N -2.76 3.33 -0.36 3.20 0.00 -0.15 -4.56 121.76 120.46 3mkv s ALA 10 Ca -0.04 0.59 -0.20 0.00 0.00 0.00 0.00 51.96 52.31 3mkv s ALA 10 Cb -0.00 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.70 3mkv s ALA 10 CO -0.05 -0.47 0.61 -1.17 0.00 0.00 0.00 175.76 174.68 3mkv s LEU 11 N 1.49 4.29 -0.52 0.00 2.96 0.27 -0.55 118.68 126.62 3mkv s LEU 11 Ca 0.53 0.08 -0.24 0.00 -0.22 0.00 0.00 54.13 54.28 3mkv s LEU 11 Cb -0.23 -2.74 0.04 0.00 0.50 0.00 0.00 46.19 43.76 3mkv s LEU 11 CO 0.25 -0.58 0.93 -0.22 -1.32 0.00 0.00 176.35 175.41 3mkv s LEU 12 N 2.64 4.08 -0.34 -0.68 0.20 0.51 -0.01 118.68 125.09 3mkv s LEU 12 Ca 0.23 -0.19 -0.11 0.00 0.69 0.00 0.00 54.13 54.74 3mkv s LEU 12 Cb -0.15 -2.95 -0.01 0.00 -0.43 0.00 0.00 46.19 42.66 3mkv s LEU 12 CO 0.15 -1.15 0.21 -0.62 -0.29 0.00 0.00 176.35 174.64 3mkv s ASP 13 N 2.62 5.82 0.58 3.68 -1.08 -1.26 -4.39 116.67 122.64 3mkv s ASP 13 Ca 0.32 -0.55 0.28 0.00 -0.52 0.00 0.00 52.55 52.09 3mkv s ASP 13 Cb -0.12 -2.07 1.54 0.00 -1.46 0.00 0.00 42.92 40.81 3mkv s ASP 13 CO 0.22 -0.25 1.98 -0.65 0.52 0.00 0.00 175.17 176.99 3mkv h PRO 14 N 8.44 0.00 -0.92 4.34 0.11 -1.95 0.28 132.00 142.29 3mkv h PRO 14 Ca -0.31 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.31 3mkv h PRO 14 Cb 1.15 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.97 3mkv h PRO 14 CO 0.64 0.00 0.58 -0.40 -0.21 0.00 0.00 178.00 178.60 3mkv n ASP 15 N -3.80 3.94 -3.75 -2.05 3.85 -1.26 -4.71 116.55 108.77 3mkv n ASP 15 Ca 0.06 -3.65 -0.20 0.00 -0.71 0.00 0.00 54.79 50.29 3mkv n ASP 15 Cb 0.53 -0.82 -0.17 0.00 -1.35 0.00 0.00 41.12 39.30 3mkv n ASP 15 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.20 175.19 3mkv s HIS 16 N -3.34 0.30 -1.16 2.11 3.76 0.09 -5.04 115.29 112.00 3mkv s HIS 16 Ca 0.56 0.06 0.12 0.00 -0.15 0.00 0.00 55.06 55.64 3mkv s HIS 16 Cb 0.47 -0.53 0.53 0.00 1.11 0.00 0.00 32.58 34.17 3mkv s HIS 16 CO 0.09 -0.20 1.34 -0.35 -0.85 0.00 0.00 174.74 174.76 3mkv n PRO 17 N 4.82 0.06 -4.03 8.40 -0.04 -1.26 -4.61 135.00 138.34 3mkv n PRO 17 Ca -0.13 0.25 -0.12 0.00 -0.04 0.00 0.00 63.50 63.46 3mkv n PRO 17 Cb 0.50 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.34 3mkv n PRO 17 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3mkv s ASP 18 N -2.84 0.52 0.23 3.54 1.01 -1.26 -4.99 116.67 112.88 3mkv s ASP 18 Ca 0.08 -0.38 -0.31 0.00 0.71 0.00 0.00 52.55 52.64 3mkv s ASP 18 Cb 0.08 0.03 -0.14 0.00 1.01 0.00 0.00 42.92 43.90 3mkv s ASP 18 CO 0.20 -0.16 1.33 0.18 0.21 0.00 0.00 175.17 176.93 3mkv n LEU 19 N 1.99 2.69 -4.69 1.23 4.77 -1.26 -4.79 117.00 116.93 3mkv n LEU 19 Ca -0.20 1.15 -0.42 0.00 -0.03 0.00 0.00 56.01 56.51 3mkv n LEU 19 Cb 0.56 -1.37 -0.03 0.00 -2.33 0.00 0.00 43.42 40.25 3mkv n LEU 19 CO 0.22 -0.72 0.75 -0.76 -1.33 0.00 0.00 177.39 175.54 3mkv s LEU 20 N 0.20 4.25 -0.04 2.23 1.43 0.99 -4.86 118.68 122.88 3mkv s LEU 20 Ca 0.68 1.48 0.01 0.00 -1.03 0.00 0.00 54.13 55.27 3mkv s LEU 20 Cb -0.70 -3.50 -0.03 0.00 0.03 0.00 0.00 46.19 41.99 3mkv s LEU 20 CO 0.51 -0.42 -0.04 -1.58 0.23 0.00 0.00 176.35 175.06 3mkv s GLN 21 N 1.92 2.75 -0.68 1.70 2.00 -1.26 -0.57 119.66 125.53 3mkv s GLN 21 Ca 0.47 -0.58 -0.01 0.00 -2.00 0.00 0.00 55.36 53.24 3mkv s GLN 21 Cb -0.18 -2.63 -0.01 0.00 0.80 0.00 0.00 33.01 30.99 3mkv s GLN 21 CO 0.18 0.65 0.58 0.41 -0.50 0.00 0.00 175.29 176.60 3mkv n GLY 22 N 1.85 -0.10 3.51 2.59 0.00 -1.26 -5.03 105.19 106.74 3mkv n GLY 22 Ca -0.17 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 3mkv n GLY 22 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mkv s PHE 23 N -3.22 2.34 -0.01 1.61 0.08 -1.26 -4.36 117.98 113.16 3mkv s PHE 23 Ca 0.07 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 56.69 3mkv s PHE 23 Cb -0.01 -1.20 0.01 0.00 -0.57 0.00 0.00 43.02 41.25 3mkv s PHE 23 CO 0.43 0.64 0.00 -1.21 -0.10 0.00 0.00 175.22 174.98 3mkv s GLU 24 N -3.57 0.08 -0.13 0.44 2.02 -0.54 -4.57 118.70 112.44 3mkv s GLU 24 Ca 0.31 0.05 0.01 0.00 0.02 0.00 0.00 54.97 55.36 3mkv s GLU 24 Cb -0.01 -0.20 -0.01 0.00 0.10 0.00 0.00 34.13 34.01 3mkv s GLU 24 CO 0.16 -0.06 -0.15 0.42 0.02 0.00 0.00 175.26 175.64 3mkv s ILE 25 N 0.49 2.83 -0.19 -1.63 1.01 -1.04 -2.73 121.20 119.95 3mkv s ILE 25 Ca -0.04 -0.74 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 3mkv s ILE 25 Cb -0.07 -2.18 -0.01 0.00 0.01 0.00 0.00 42.46 40.22 3mkv s ILE 25 CO -0.01 0.53 -0.08 -0.22 0.00 0.00 0.00 174.94 175.16 3mkv s LEU 26 N 0.42 2.82 -0.16 2.97 2.96 -0.66 -1.77 118.68 125.26 3mkv s LEU 26 Ca -0.12 -0.38 -0.04 0.00 -0.22 0.00 0.00 54.13 53.38 3mkv s LEU 26 Cb -0.16 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 3mkv s LEU 26 CO 0.06 0.04 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.47 3mkv s ILE 27 N 1.10 3.98 -0.04 6.68 -1.09 -0.26 -0.16 121.20 131.41 3mkv s ILE 27 Ca 0.01 -0.33 -0.01 0.00 -2.23 0.00 0.00 60.65 58.09 3mkv s ILE 27 Cb -0.15 -2.75 0.03 0.00 -1.58 0.00 0.00 42.46 38.02 3mkv s ILE 27 CO -0.01 0.49 0.06 -0.70 -1.23 0.00 0.00 174.94 173.55 3mkv s GLU 28 N 0.38 -0.02 -1.39 2.79 2.12 -0.54 -1.31 118.70 120.73 3mkv s GLU 28 Ca -0.03 0.28 -0.07 0.00 0.36 0.00 0.00 54.97 55.51 3mkv s GLU 28 Cb -0.14 -0.30 0.03 0.00 0.26 0.00 0.00 34.13 33.99 3mkv s GLU 28 CO 0.03 -0.21 0.97 -0.25 -0.54 0.00 0.00 175.26 175.25 3mkv n ASP 29 N 4.51 -3.93 -1.38 -1.70 10.43 -0.93 -2.45 116.55 121.09 3mkv n ASP 29 Ca -0.21 -0.71 -0.14 0.00 2.57 0.00 0.00 54.79 56.31 3mkv n ASP 29 Cb 0.50 -4.40 -0.03 0.00 1.84 0.00 0.00 41.12 39.03 3mkv n ASP 29 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3mkv n GLY 30 N -1.67 0.49 2.98 0.44 0.00 -1.21 -4.96 105.19 101.27 3mkv n GLY 30 Ca -0.10 -0.32 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 3mkv n GLY 30 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mkv s PHE 31 N -2.63 0.12 0.07 1.61 0.08 -1.03 -2.19 117.98 114.01 3mkv s PHE 31 Ca 0.00 -0.25 -0.31 0.00 0.12 0.00 0.00 56.93 56.49 3mkv s PHE 31 Cb 0.00 -0.10 -0.07 0.00 -0.57 0.00 0.00 43.02 42.28 3mkv s PHE 31 CO 0.00 -0.16 1.35 0.42 -0.10 0.00 0.00 175.22 176.73 3mkv s ILE 32 N -0.98 3.59 -0.23 0.64 -1.09 -0.04 -1.47 121.20 121.62 3mkv s ILE 32 Ca -0.11 1.10 -0.14 0.00 -2.23 0.00 0.00 60.65 59.27 3mkv s ILE 32 Cb -0.07 -3.71 -0.09 0.00 -1.58 0.00 0.00 42.46 37.01 3mkv s ILE 32 CO -0.00 0.06 -0.33 -1.14 -1.23 0.00 0.00 174.94 172.30 3mkv n ARG 33 N 4.37 0.52 -3.97 2.79 3.00 0.77 -1.12 116.66 123.03 3mkv n ARG 33 Ca 0.11 0.22 -0.11 0.00 -0.00 0.00 0.00 57.85 58.08 3mkv n ARG 33 Cb 0.44 -1.39 -0.12 0.00 0.00 0.00 0.00 32.46 31.38 3mkv n ARG 33 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 3mkv s GLU 34 N -2.56 0.24 -0.13 -0.14 2.02 -1.20 -4.68 118.70 112.25 3mkv s GLU 34 Ca -0.33 -0.37 -0.03 0.00 0.02 0.00 0.00 54.97 54.26 3mkv s GLU 34 Cb 0.11 -0.03 0.05 0.00 0.10 0.00 0.00 34.13 34.36 3mkv s GLU 34 CO 0.43 -0.00 0.06 0.08 0.02 0.00 0.00 175.26 175.85 3mkv s VAL 35 N -0.79 0.07 0.02 2.63 1.01 -1.26 -1.65 120.40 120.43 3mkv s VAL 35 Ca -0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 3mkv s VAL 35 Cb -0.06 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.78 3mkv s VAL 35 CO -0.00 -0.07 0.03 -0.94 0.00 0.00 0.00 175.10 174.11 3mkv s SER 36 N 2.08 0.21 0.00 3.32 1.04 -1.11 -4.97 113.70 114.28 3mkv s SER 36 Ca 0.03 -0.51 0.20 0.00 0.48 0.00 0.00 55.95 56.15 3mkv s SER 36 Cb -0.15 0.16 0.88 0.00 0.10 0.00 0.00 66.02 67.01 3mkv s SER 36 CO -0.07 -0.40 1.64 -0.90 0.98 0.00 0.00 173.24 174.50 3mkv n ASP 37 N 1.20 0.00 -4.59 7.02 3.85 -1.26 -1.47 116.55 121.31 3mkv n ASP 37 Ca -0.21 0.44 -0.35 0.00 -0.71 0.00 0.00 54.79 53.95 3mkv n ASP 37 Cb 0.57 -0.47 -0.11 0.00 -1.35 0.00 0.00 41.12 39.76 3mkv n ASP 37 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3mkv s LYS 38 N -2.95 3.88 0.51 0.11 1.02 -1.26 -4.72 119.74 116.33 3mkv s LYS 38 Ca 0.11 -0.39 -0.16 0.00 0.02 0.00 0.00 55.97 55.54 3mkv s LYS 38 Cb 0.13 -3.18 -0.14 0.00 -0.52 0.00 0.00 37.83 34.12 3mkv s LYS 38 CO 0.36 0.20 -0.18 -2.30 -0.92 0.00 0.00 175.35 172.51 3mkv n PRO 39 N 3.74 0.00 -4.17 -1.68 -0.02 -1.26 -4.81 135.00 126.80 3mkv n PRO 39 Ca -0.17 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.06 3mkv n PRO 39 Cb 0.52 -0.92 -0.06 0.00 -0.02 0.00 0.00 33.50 33.02 3mkv n PRO 39 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3mkv s ILE 40 N -1.83 4.02 -0.77 4.25 -1.09 -1.26 -5.06 121.20 119.45 3mkv s ILE 40 Ca 0.50 -1.40 -0.23 0.00 -2.23 0.00 0.00 60.65 57.29 3mkv s ILE 40 Cb -0.42 -3.08 0.06 0.00 -1.58 0.00 0.00 42.46 37.44 3mkv s ILE 40 CO 0.62 -0.19 1.15 -0.54 -1.23 0.00 0.00 174.94 174.75 3mkv s LYS 41 N -3.26 3.27 -0.48 2.79 1.02 -1.26 -4.97 119.74 116.85 3mkv s LYS 41 Ca 0.30 -0.82 -0.16 0.00 0.02 0.00 0.00 55.97 55.31 3mkv s LYS 41 Cb -0.09 -4.47 0.08 0.00 -0.52 0.00 0.00 37.83 32.83 3mkv s LYS 41 CO 0.21 -1.97 0.41 -1.54 -0.92 0.00 0.00 175.35 171.54 3mkv s SER 42 N 3.88 6.15 -0.26 2.83 1.04 -1.26 -4.88 113.70 121.20 3mkv s SER 42 Ca 0.31 -1.38 -0.16 0.00 0.48 0.00 0.00 55.95 55.20 3mkv s SER 42 Cb -0.10 -2.19 -0.14 0.00 0.10 0.00 0.00 66.02 63.69 3mkv s SER 42 CO 0.06 -0.68 -0.18 -0.24 0.98 0.00 0.00 173.24 173.18 3mkv n SER 43 N 5.22 1.93 -2.52 7.02 2.88 -1.26 -4.67 113.62 122.22 3mkv n SER 43 Ca -0.13 0.35 -0.24 0.00 -1.33 0.00 0.00 58.87 57.53 3mkv n SER 43 Cb 0.43 -0.85 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 3mkv n SER 43 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3mkv n ASN 44 N -4.27 4.10 -4.16 -3.46 4.05 -1.26 -5.04 115.26 105.21 3mkv n ASN 44 Ca -0.48 -3.53 -0.30 0.00 0.45 0.00 0.00 54.58 50.71 3mkv n ASN 44 Cb 0.83 -0.47 -0.17 0.00 1.23 0.00 0.00 39.78 41.20 3mkv n ASN 44 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3mkv s ALA 45 N -3.46 1.97 0.23 5.20 0.00 -1.26 -4.35 121.76 120.09 3mkv s ALA 45 Ca 0.44 -0.87 -0.30 0.00 0.00 0.00 0.00 51.96 51.23 3mkv s ALA 45 Cb 0.41 -0.80 -0.10 0.00 0.00 0.00 0.00 23.12 22.63 3mkv s ALA 45 CO -0.15 0.17 1.48 -1.58 0.00 0.00 0.00 175.76 175.69 3mkv s HIS 46 N 0.53 3.02 -0.13 0.00 2.46 -1.11 -4.66 115.29 115.41 3mkv s HIS 46 Ca -0.15 0.90 -0.07 0.00 0.47 0.00 0.00 55.06 56.21 3mkv s HIS 46 Cb -0.17 -3.86 -0.04 0.00 -0.13 0.00 0.00 32.58 28.38 3mkv s HIS 46 CO 0.05 -2.92 0.11 0.08 -2.47 0.00 0.00 174.74 169.59 3mkv s VAL 47 N 0.33 5.25 -0.15 0.89 1.01 -1.26 0.46 120.40 126.92 3mkv s VAL 47 Ca 0.63 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.73 3mkv s VAL 47 Cb -0.43 -3.29 0.02 0.00 0.00 0.00 0.00 36.38 32.68 3mkv s VAL 47 CO 0.40 0.58 -0.16 -0.63 0.00 0.00 0.00 175.10 175.30 3mkv s ILE 48 N -0.73 1.69 -0.51 2.22 1.01 0.21 -4.93 121.20 120.17 3mkv s ILE 48 Ca 0.13 -0.71 -0.19 0.00 0.00 0.00 0.00 60.65 59.88 3mkv s ILE 48 Cb -0.12 -1.57 0.06 0.00 0.01 0.00 0.00 42.46 40.85 3mkv s ILE 48 CO 0.03 0.48 0.61 -0.62 0.00 0.00 0.00 174.94 175.44 3mkv s ASP 49 N 1.41 6.21 0.55 3.58 2.15 -1.26 -2.17 116.67 127.14 3mkv s ASP 49 Ca 0.04 -0.99 0.33 0.00 0.43 0.00 0.00 52.55 52.36 3mkv s ASP 49 Cb -0.13 -2.28 1.54 0.00 -0.30 0.00 0.00 42.92 41.75 3mkv s ASP 49 CO -0.11 -0.89 2.06 0.58 -0.17 0.00 0.00 175.17 176.65 3mkv h VAL 50 N 5.86 0.20 -5.99 1.11 2.07 -1.57 -3.47 116.25 114.46 3mkv h VAL 50 Ca -0.28 -0.50 -0.39 0.00 0.82 0.00 0.00 66.70 66.36 3mkv h VAL 50 Cb 1.10 1.41 0.10 0.00 -1.52 0.00 0.00 31.29 32.37 3mkv h VAL 50 CO 0.97 0.06 -0.88 0.29 0.02 0.00 0.00 177.57 178.03 3mkv n LYS 51 N -3.25 -2.99 -1.26 1.57 5.02 -0.72 -2.64 118.16 113.90 3mkv n LYS 51 Ca -0.01 0.62 -0.09 0.00 -2.02 0.00 0.00 58.31 56.81 3mkv n LYS 51 Cb 0.26 -4.95 -0.04 0.00 -0.02 0.00 0.00 35.03 30.28 3mkv n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mkv n GLY 52 N -1.54 1.04 3.99 0.72 0.00 1.26 -4.96 105.19 105.72 3mkv n GLY 52 Ca -0.17 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.18 3mkv n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mkv s LYS 53 N -2.59 2.11 -0.11 1.61 1.02 -1.08 -4.49 119.74 116.21 3mkv s LYS 53 Ca 0.00 -1.09 -0.17 0.00 0.02 0.00 0.00 55.97 54.73 3mkv s LYS 53 Cb 0.00 -2.45 -0.04 0.00 -0.52 0.00 0.00 37.83 34.81 3mkv s LYS 53 CO 0.00 -1.06 0.44 0.99 -0.92 0.00 0.00 175.35 174.80 3mkv s THR 54 N -2.91 5.19 -0.23 2.17 2.01 -0.64 -0.98 115.64 120.26 3mkv s THR 54 Ca 0.62 0.88 -0.12 0.00 0.31 0.00 0.00 61.69 63.37 3mkv s THR 54 Cb -0.07 -3.78 -0.05 0.00 0.01 0.00 0.00 72.50 68.61 3mkv s THR 54 CO 0.41 0.36 0.24 -0.63 -0.69 0.00 0.00 174.62 174.31 3mkv s ILE 55 N 0.43 5.30 0.20 1.82 1.01 0.28 0.19 121.20 130.45 3mkv s ILE 55 Ca 0.24 0.35 0.03 0.00 0.00 0.00 0.00 60.65 61.27 3mkv s ILE 55 Cb -0.15 -3.58 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 3mkv s ILE 55 CO 0.09 0.31 0.00 0.00 0.00 0.00 0.00 174.94 175.34 3mkv s MET 56 N 1.19 1.23 0.55 2.79 0.23 -0.24 -0.36 119.30 124.69 3mkv s MET 56 Ca 0.11 -1.61 -0.21 0.00 -1.03 0.00 0.00 55.69 52.95 3mkv s MET 56 Cb -0.14 -0.44 -0.05 0.00 -1.53 0.00 0.00 34.83 32.67 3mkv s MET 56 CO 0.06 -0.12 1.31 -2.14 -2.03 0.00 0.00 175.02 172.10 3mkv s PRO 57 N -3.89 3.15 0.46 3.16 0.02 -1.26 0.15 135.00 136.79 3mkv s PRO 57 Ca 0.27 2.12 -0.24 0.00 0.02 0.00 0.00 61.00 63.17 3mkv s PRO 57 Cb 0.06 -2.20 -0.09 0.00 0.02 0.00 0.00 34.50 32.29 3mkv s PRO 57 CO 0.07 -1.15 1.13 0.41 -0.33 0.00 0.00 177.00 177.14 3mkv n GLY 58 N 0.69 0.15 3.86 0.52 0.00 -1.09 -4.57 105.19 104.75 3mkv n GLY 58 Ca 0.11 0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 3mkv n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mkv s LEU 59 N -1.46 3.43 -0.09 0.99 1.43 -0.23 -4.57 118.68 118.17 3mkv s LEU 59 Ca 0.65 1.46 0.01 0.00 -1.03 0.00 0.00 54.13 55.22 3mkv s LEU 59 Cb -0.50 -4.45 0.02 0.00 0.03 0.00 0.00 46.19 41.28 3mkv s LEU 59 CO 0.55 -0.73 -0.10 -0.63 0.23 0.00 0.00 176.35 175.67 3mkv s ILE 60 N -2.91 1.11 -0.34 -0.59 1.01 0.25 -1.92 121.20 117.81 3mkv s ILE 60 Ca 0.56 -0.40 -0.07 0.00 0.00 0.00 0.00 60.65 60.74 3mkv s ILE 60 Cb -0.10 -1.07 0.04 0.00 0.01 0.00 0.00 42.46 41.33 3mkv s ILE 60 CO 0.44 0.37 0.12 -0.62 0.00 0.00 0.00 174.94 175.24 3mkv s ASP 61 N 1.20 5.39 0.00 3.58 -1.08 -0.95 -4.65 116.67 120.15 3mkv s ASP 61 Ca -0.04 -1.10 0.23 0.00 -0.52 0.00 0.00 52.55 51.11 3mkv s ASP 61 Cb -0.14 -1.90 1.01 0.00 -1.46 0.00 0.00 42.92 40.43 3mkv s ASP 61 CO -0.03 -0.33 1.74 0.18 0.52 0.00 0.00 175.17 177.25 3mkv n LEU 62 N 4.85 0.00 -3.47 -1.34 4.77 0.47 -0.02 117.00 122.27 3mkv n LEU 62 Ca -0.12 0.46 -0.28 0.00 -0.03 0.00 0.00 56.01 56.04 3mkv n LEU 62 Cb 0.45 -0.46 -0.12 0.00 -2.33 0.00 0.00 43.42 40.95 3mkv n LEU 62 CO 0.32 -0.10 -0.31 -2.28 -1.33 0.00 0.00 177.39 173.69 3mkv s HIS 63 N -2.93 0.56 0.17 -1.77 2.46 -1.24 -4.48 115.29 108.07 3mkv s HIS 63 Ca 0.13 -1.42 0.04 0.00 0.47 0.00 0.00 55.06 54.28 3mkv s HIS 63 Cb 0.15 -0.86 -0.05 0.00 -0.13 0.00 0.00 32.58 31.69 3mkv s HIS 63 CO 0.41 -0.84 -0.07 0.14 -2.47 0.00 0.00 174.74 171.91 3mkv s VAL 64 N 1.28 1.11 -0.36 0.89 -7.23 -0.55 -0.77 120.40 114.78 3mkv s VAL 64 Ca 0.16 -2.05 -0.00 0.00 -1.81 0.00 0.00 61.98 58.28 3mkv s VAL 64 Cb -0.21 -2.01 0.12 0.00 0.56 0.00 0.00 36.38 34.84 3mkv s VAL 64 CO -0.06 -0.60 0.18 -1.00 -0.31 0.00 0.00 175.10 173.31 3mkv s HIS 65 N -3.37 1.34 -0.02 2.82 3.76 -1.26 -0.45 115.29 118.11 3mkv s HIS 65 Ca 0.21 -1.81 0.31 0.00 -0.15 0.00 0.00 55.06 53.62 3mkv s HIS 65 Cb 0.04 -1.44 1.38 0.00 1.11 0.00 0.00 32.58 33.67 3mkv s HIS 65 CO 0.03 -0.83 1.93 -0.39 -0.85 0.00 0.00 174.74 174.64 3mkv h VAL 66 N 5.67 0.00 -0.31 -0.90 -1.51 -1.94 -2.38 116.25 114.89 3mkv h VAL 66 Ca -0.05 -0.32 0.00 0.00 -1.23 0.00 0.00 66.70 65.10 3mkv h VAL 66 Cb 0.97 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 31.34 3mkv h VAL 66 CO 0.41 0.00 0.00 1.33 -1.23 0.00 0.00 177.57 178.08 3mkv n VAL 67 N -2.78 0.41 -2.57 7.19 0.24 -1.26 -4.53 118.33 115.04 3mkv n VAL 67 Ca 0.00 -0.70 -0.43 0.00 -2.04 0.00 0.00 64.34 61.17 3mkv n VAL 67 Cb 0.23 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.68 3mkv n VAL 67 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3mkv n ALA 68 N 1.43 3.64 1.15 2.33 0.00 -0.90 -4.69 120.51 123.48 3mkv n ALA 68 Ca 0.18 -3.87 0.12 0.00 0.00 0.00 0.00 53.44 49.87 3mkv n ALA 68 Cb 0.60 -3.58 0.30 0.00 0.00 0.00 0.00 19.45 16.77 3mkv n ALA 68 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3mkv n ILE 69 N 6.26 0.00 -3.82 0.00 -5.35 -1.26 -1.99 119.36 113.19 3mkv n ILE 69 Ca 0.49 -0.09 -0.09 0.00 -0.27 0.00 0.00 62.75 62.78 3mkv n ILE 69 Cb 0.46 0.42 -0.07 0.00 -1.74 0.00 0.00 39.64 38.71 3mkv n ILE 69 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3mkv s GLU 70 N -2.66 0.94 0.29 6.28 2.02 -1.26 -4.42 118.70 119.88 3mkv s GLU 70 Ca 0.20 -0.94 0.06 0.00 0.02 0.00 0.00 54.97 54.31 3mkv s GLU 70 Cb 0.19 0.37 0.43 0.00 0.10 0.00 0.00 34.13 35.22 3mkv s GLU 70 CO 0.59 -0.32 1.69 0.74 0.02 0.00 0.00 175.26 177.98 3mkv h PHE 71 N 2.64 0.32 -1.95 1.61 -1.00 -1.87 -3.38 116.94 113.31 3mkv h PHE 71 Ca -0.34 -0.09 -0.59 0.00 2.81 0.00 0.00 57.97 59.77 3mkv h PHE 71 Cb 1.22 -0.07 -0.11 0.00 3.61 0.00 0.00 35.95 40.60 3mkv h PHE 71 CO 0.40 0.64 1.13 1.21 -1.61 0.00 0.00 178.31 180.08 3mkv s ASN 72 N -6.87 6.34 0.05 2.17 2.47 -1.26 -4.81 114.94 113.02 3mkv s ASN 72 Ca -0.05 -1.06 -0.19 0.00 0.42 0.00 0.00 52.86 51.99 3mkv s ASN 72 Cb 0.13 -2.53 -0.15 0.00 -1.45 0.00 0.00 41.25 37.26 3mkv s ASN 72 CO 0.78 -1.58 1.31 -0.07 -3.72 0.00 0.00 177.10 173.81 3mkv h LEU 73 N 12.44 0.50 -1.59 3.21 3.38 -1.85 -2.51 115.31 128.90 3mkv h LEU 73 Ca -0.06 -0.54 0.11 0.00 0.09 0.00 0.00 57.88 57.48 3mkv h LEU 73 Cb 1.04 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 3mkv h LEU 73 CO 1.30 0.95 0.43 -0.65 0.09 0.00 0.00 178.44 180.56 3mkv h PRO 74 N 0.08 0.44 -0.32 1.13 0.11 -1.89 -0.46 132.00 131.10 3mkv h PRO 74 Ca 0.01 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 3mkv h PRO 74 Cb 0.85 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 3mkv h PRO 74 CO 0.06 0.29 -0.21 -0.09 -0.21 0.00 0.00 178.00 177.85 3mkv h ARG 75 N 0.46 0.60 -0.49 1.05 2.43 -1.89 -3.08 114.38 113.45 3mkv h ARG 75 Ca 0.30 -0.22 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 3mkv h ARG 75 Cb 0.58 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 3mkv h ARG 75 CO -0.09 0.77 0.15 0.28 -1.51 0.00 0.00 179.97 179.57 3mkv h VAL 76 N 0.54 1.20 0.00 0.20 2.07 -0.64 -1.01 116.25 118.61 3mkv h VAL 76 Ca 0.08 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.92 3mkv h VAL 76 Cb 0.65 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 3mkv h VAL 76 CO 0.05 0.26 0.00 0.00 0.02 0.00 0.00 177.57 177.90 3mkv h ALA 77 N 1.45 1.00 0.00 1.67 0.00 -1.42 -2.31 119.26 119.65 3mkv h ALA 77 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3mkv h ALA 77 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3mkv h ALA 77 CO -0.01 0.00 -1.05 0.25 0.00 0.00 0.00 179.25 178.44 3mkv n THR 78 N -2.68 0.03 -2.29 0.00 -2.24 -0.40 -4.71 114.28 102.00 3mkv n THR 78 Ca -0.01 -0.10 -0.40 0.00 -2.27 0.00 0.00 64.05 61.27 3mkv n THR 78 Cb 0.11 0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 68.94 3mkv n THR 78 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3mkv s LEU 79 N -3.35 4.36 0.25 3.22 1.43 -0.87 -4.97 118.68 118.75 3mkv s LEU 79 Ca 0.06 2.43 -0.29 0.00 -1.03 0.00 0.00 54.13 55.30 3mkv s LEU 79 Cb 0.16 -3.80 -0.15 0.00 0.03 0.00 0.00 46.19 42.42 3mkv s LEU 79 CO 0.84 -0.49 0.86 -2.65 0.23 0.00 0.00 176.35 175.14 3mkv n PRO 80 N 0.59 0.89 -0.05 1.29 -0.02 -1.26 -4.75 135.00 131.69 3mkv n PRO 80 Ca 0.02 0.31 0.02 0.00 -2.02 0.00 0.00 63.50 61.83 3mkv n PRO 80 Cb 0.45 -1.57 0.35 0.00 -0.02 0.00 0.00 33.50 32.71 3mkv n PRO 80 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3mkv h ASN 81 N 1.79 0.58 -0.65 2.55 2.35 -1.96 -1.82 115.58 118.41 3mkv h ASN 81 Ca -0.36 -0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.37 3mkv h ASN 81 Cb 1.37 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 39.56 3mkv h ASN 81 CO 0.60 0.46 0.42 0.58 -1.65 0.00 0.00 177.43 177.84 3mkv h VAL 82 N 0.66 1.12 -0.12 2.81 2.07 -2.00 -1.99 116.25 118.80 3mkv h VAL 82 Ca 0.17 -0.29 -0.09 0.00 0.82 0.00 0.00 66.70 67.32 3mkv h VAL 82 Cb 0.00 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 29.99 3mkv h VAL 82 CO -0.03 0.15 -0.27 -0.07 0.02 0.00 0.00 177.57 177.37 3mkv h LEU 83 N 0.83 0.45 -0.52 2.57 3.38 -1.71 -2.25 115.31 118.07 3mkv h LEU 83 Ca 0.25 -0.57 -0.00 0.00 0.09 0.00 0.00 57.88 57.65 3mkv h LEU 83 Cb -0.04 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3mkv h LEU 83 CO -0.08 0.94 0.30 0.58 0.09 0.00 0.00 178.44 180.28 3mkv h VAL 84 N -0.01 1.16 -0.05 1.22 2.07 -1.33 -1.19 116.25 118.12 3mkv h VAL 84 Ca 0.00 -0.38 0.03 0.00 0.82 0.00 0.00 66.70 67.18 3mkv h VAL 84 Cb 0.87 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 3mkv h VAL 84 CO 0.06 0.17 -0.20 0.74 0.02 0.00 0.00 177.57 178.36 3mkv h THR 85 N 0.69 0.52 -0.39 2.57 2.02 -1.37 -2.69 112.91 114.27 3mkv h THR 85 Ca 0.18 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.32 3mkv h THR 85 Cb 0.00 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 3mkv h THR 85 CO -0.03 0.00 0.05 -0.07 0.37 0.00 0.00 175.52 175.84 3mkv h LEU 86 N -0.29 0.55 -0.07 2.58 4.07 -1.03 -2.69 115.31 118.43 3mkv h LEU 86 Ca 0.07 -0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.94 3mkv h LEU 86 Cb 0.39 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.99 3mkv h LEU 86 CO -0.22 0.58 0.00 0.54 -1.08 0.00 0.00 178.44 178.26 3mkv n ARG 87 N -4.29 0.22 0.16 1.13 1.74 -0.48 -2.77 116.66 112.36 3mkv n ARG 87 Ca 0.02 0.21 0.12 0.00 -0.77 0.00 0.00 57.85 57.43 3mkv n ARG 87 Cb 0.22 -1.77 0.27 0.00 -1.02 0.00 0.00 32.46 30.16 3mkv n ARG 87 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3mkv h ALA 88 N 2.56 0.96 0.68 7.54 0.00 -1.14 -3.35 119.26 126.50 3mkv h ALA 88 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3mkv h ALA 88 Cb 0.67 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.46 3mkv h ALA 88 CO 0.00 0.00 -0.33 0.28 0.00 0.00 0.00 179.25 179.20 3mkv h VAL 89 N 0.00 0.09 -1.00 0.00 2.07 -1.53 -0.75 116.25 115.13 3mkv h VAL 89 Ca 0.00 -0.31 0.19 0.00 0.82 0.00 0.00 66.70 67.40 3mkv h VAL 89 Cb 0.87 0.12 -0.11 0.00 -1.52 0.00 0.00 31.29 30.65 3mkv h VAL 89 CO 0.00 0.01 0.60 1.55 0.02 0.00 0.00 177.57 179.75 3mkv h PRO 90 N -1.19 0.72 0.91 1.57 0.13 -1.75 -2.24 132.00 130.14 3mkv h PRO 90 Ca -0.09 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 64.95 3mkv h PRO 90 Cb 0.72 -0.16 0.01 0.00 0.13 0.00 0.00 31.00 31.69 3mkv h PRO 90 CO 0.15 0.47 -0.46 0.82 -0.23 0.00 0.00 178.00 178.75 3mkv h ILE 91 N 0.74 0.00 -0.89 -3.56 2.04 -1.66 -1.54 117.51 112.64 3mkv h ILE 91 Ca 0.58 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.67 3mkv h ILE 91 Cb 0.92 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.95 3mkv h ILE 91 CO -0.39 0.00 0.61 0.24 0.00 0.00 0.00 178.15 178.61 3mkv h MET 92 N -1.25 0.19 0.01 2.37 2.86 -0.73 -1.92 114.93 116.46 3mkv h MET 92 Ca -0.12 -0.01 -0.18 0.00 -2.06 0.00 0.00 59.70 57.32 3mkv h MET 92 Cb 0.97 -0.04 0.02 0.00 0.06 0.00 0.00 31.60 32.60 3mkv h MET 92 CO 0.19 0.13 -0.72 -0.09 1.06 0.00 0.00 176.91 177.47 3mkv h ARG 93 N 0.20 0.47 -0.61 1.72 2.43 -1.05 -2.80 114.38 114.74 3mkv h ARG 93 Ca 0.45 -0.52 0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3mkv h ARG 93 Cb 1.44 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 31.11 3mkv h ARG 93 CO -0.10 1.17 0.41 0.00 -1.51 0.00 0.00 179.97 179.94 3mkv h ALA 94 N 0.32 1.58 -0.47 2.80 0.00 -0.53 -2.08 119.26 120.88 3mkv h ALA 94 Ca -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3mkv h ALA 94 Cb 1.43 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3mkv h ALA 94 CO 0.14 0.38 0.31 0.52 0.00 0.00 0.00 179.25 180.60 3mkv h MET 95 N 0.81 0.63 -0.63 0.00 2.86 -1.30 -2.24 114.93 115.06 3mkv h MET 95 Ca 0.23 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.76 3mkv h MET 95 Cb -0.06 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.43 3mkv h MET 95 CO -0.05 0.42 0.13 1.25 1.06 0.00 0.00 176.91 179.72 3mkv h LEU 96 N 0.64 0.97 -0.56 1.22 5.85 -1.14 -2.62 115.31 119.68 3mkv h LEU 96 Ca 0.17 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.71 3mkv h LEU 96 Cb -0.07 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 40.65 3mkv h LEU 96 CO -0.04 0.97 0.26 -0.09 -0.34 0.00 0.00 178.44 179.19 3mkv h ARG 97 N 0.93 0.47 0.00 1.25 9.65 -1.19 -2.04 114.38 123.45 3mkv h ARG 97 Ca 0.19 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 3mkv h ARG 97 Cb 0.39 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 3mkv h ARG 97 CO 0.01 0.31 0.00 0.54 2.80 0.00 0.00 179.97 183.63 3mkv n ARG 98 N -4.92 0.45 0.00 0.20 1.74 -0.86 -4.53 116.66 108.74 3mkv n ARG 98 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 3mkv n ARG 98 Cb 0.19 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 3mkv n ARG 98 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3mkv n GLY 99 N -0.06 0.39 3.48 -0.13 0.00 -0.77 -4.82 105.19 103.28 3mkv n GLY 99 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 3mkv n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mkv s PHE 100 N -2.00 2.60 -0.07 1.61 0.08 -1.05 -1.07 117.98 118.08 3mkv s PHE 100 Ca 0.00 -0.49 0.14 0.00 0.12 0.00 0.00 56.93 56.70 3mkv s PHE 100 Cb 0.00 -4.38 -0.17 0.00 -0.57 0.00 0.00 43.02 37.90 3mkv s PHE 100 CO 0.00 -1.75 0.84 1.79 -0.10 0.00 0.00 175.22 176.00 3mkv h THR 101 N 6.00 0.76 -4.28 0.64 1.35 -1.69 -3.36 112.91 112.34 3mkv h THR 101 Ca -0.25 -2.41 -0.56 0.00 -0.55 0.00 0.00 66.41 62.64 3mkv h THR 101 Cb 1.06 2.28 -0.28 0.00 -1.73 0.00 0.00 68.15 69.48 3mkv h THR 101 CO 1.21 0.43 -0.84 -0.89 -0.25 0.00 0.00 175.52 175.18 3mkv s THR 102 N -2.78 1.47 0.03 6.82 2.01 -1.14 0.86 115.64 122.91 3mkv s THR 102 Ca -0.03 -0.89 0.02 0.00 0.31 0.00 0.00 61.69 61.10 3mkv s THR 102 Cb 0.08 -1.24 -0.02 0.00 0.01 0.00 0.00 72.50 71.34 3mkv s THR 102 CO 0.81 0.33 -0.07 0.68 -0.69 0.00 0.00 174.62 175.69 3mkv s VAL 103 N -0.54 0.47 -0.25 3.82 -7.23 0.24 -2.24 120.40 114.66 3mkv s VAL 103 Ca 0.07 -0.87 -0.14 0.00 -1.81 0.00 0.00 61.98 59.22 3mkv s VAL 103 Cb -0.07 -0.52 -0.04 0.00 0.56 0.00 0.00 36.38 36.30 3mkv s VAL 103 CO -0.00 -0.28 0.32 -0.60 -0.31 0.00 0.00 175.10 174.23 3mkv s ARG 104 N -1.25 4.04 -0.01 4.82 3.52 0.97 -0.85 118.95 130.20 3mkv s ARG 104 Ca -0.08 -0.03 -0.26 0.00 -0.13 0.00 0.00 55.73 55.23 3mkv s ARG 104 Cb -0.08 -3.62 -0.04 0.00 -1.56 0.00 0.00 34.95 29.65 3mkv s ARG 104 CO 0.00 -0.17 0.81 0.34 -0.81 0.00 0.00 175.30 175.47 3mkv s ASP 105 N 1.46 7.19 0.00 -2.12 -1.08 0.55 -1.48 116.67 121.19 3mkv s ASP 105 Ca 0.13 1.43 0.22 0.00 -0.52 0.00 0.00 52.55 53.82 3mkv s ASP 105 Cb -0.15 -2.48 0.62 0.00 -1.46 0.00 0.00 42.92 39.45 3mkv s ASP 105 CO 0.09 -0.12 1.52 0.00 0.52 0.00 0.00 175.17 177.19 3mkv n ALA 106 N 3.48 2.39 0.00 3.66 0.00 0.40 -3.00 120.51 127.43 3mkv n ALA 106 Ca 0.01 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.20 3mkv n ALA 106 Cb 0.51 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 19.02 3mkv n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mkv n GLY 107 N 1.64 3.47 0.00 0.00 0.00 -1.26 -4.75 105.19 104.29 3mkv n GLY 107 Ca 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3mkv n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mkv n GLY 108 N 0.00 1.48 3.54 -0.02 0.00 0.77 -4.75 105.19 106.21 3mkv n GLY 108 Ca 0.00 -0.86 -0.59 0.00 0.00 0.00 0.00 46.02 44.57 3mkv n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mkv n ALA 109 N -0.77 -3.07 -3.24 4.61 0.00 -1.26 -4.40 120.51 112.37 3mkv n ALA 109 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.02 3mkv n ALA 109 Cb 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 17.63 3mkv n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mkv n GLY 110 N 1.90 3.43 0.31 0.00 0.00 -1.26 -3.30 105.19 106.27 3mkv n GLY 110 Ca 0.21 -2.14 0.09 0.00 0.00 0.00 0.00 46.02 44.18 3mkv n GLY 110 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3mkv h TYR 111 N 0.36 0.79 -0.81 1.61 3.20 -1.81 -2.51 116.97 117.81 3mkv h TYR 111 Ca 0.00 0.04 0.18 0.00 3.14 0.00 0.00 58.73 62.08 3mkv h TYR 111 Cb 0.00 -0.22 -0.11 0.00 1.54 0.00 0.00 36.73 37.94 3mkv h TYR 111 CO 0.00 0.16 0.31 -1.35 -1.64 0.00 0.00 178.16 175.64 3mkv h PRO 112 N 0.61 0.38 -0.60 1.82 0.11 -1.96 0.22 132.00 132.60 3mkv h PRO 112 Ca 0.49 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.53 3mkv h PRO 112 Cb 0.74 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.74 3mkv h PRO 112 CO -0.39 0.25 0.20 0.74 -0.21 0.00 0.00 178.00 178.60 3mkv h PHE 113 N 0.39 0.95 0.15 0.65 0.04 -1.84 0.11 116.94 117.39 3mkv h PHE 113 Ca 0.47 -0.09 0.01 0.00 2.80 0.00 0.00 57.97 61.16 3mkv h PHE 113 Cb 0.81 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.66 3mkv h PHE 113 CO -0.18 0.78 -0.19 -0.22 -0.60 0.00 0.00 178.31 177.90 3mkv h LYS 114 N 0.84 -0.38 0.00 1.51 3.64 -0.67 -1.47 116.57 120.03 3mkv h LYS 114 Ca 0.19 0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.51 3mkv h LYS 114 Cb 0.27 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3mkv h LYS 114 CO -0.01 -0.25 -0.43 -0.56 -2.27 0.00 0.00 179.45 175.92 3mkv h GLN 115 N -0.39 0.00 -0.61 1.90 3.07 -0.66 -0.41 115.11 118.00 3mkv h GLN 115 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.73 3mkv h GLN 115 Cb 0.39 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.92 3mkv h GLN 115 CO -0.08 0.43 0.30 0.00 0.09 0.00 0.00 178.83 179.57 3mkv h ALA 116 N 1.57 1.38 0.02 0.06 0.00 -0.58 -0.72 119.26 120.97 3mkv h ALA 116 Ca -0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 3mkv h ALA 116 Cb 0.79 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3mkv h ALA 116 CO 0.06 0.49 -0.21 0.28 0.00 0.00 0.00 179.25 179.87 3mkv h VAL 117 N 0.86 1.63 -0.26 0.00 2.07 -0.91 -1.40 116.25 118.23 3mkv h VAL 117 Ca 0.21 -2.11 0.02 0.00 0.82 0.00 0.00 66.70 65.64 3mkv h VAL 117 Cb 0.08 3.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 3mkv h VAL 117 CO -0.03 0.57 0.18 -0.33 0.02 0.00 0.00 177.57 177.97 3mkv h GLU 118 N -0.67 0.25 0.00 1.57 4.39 -0.96 -1.89 114.58 117.26 3mkv h GLU 118 Ca -0.03 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.65 3mkv h GLU 118 Cb 1.04 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 3mkv h GLU 118 CO 0.04 0.17 -0.30 0.66 -1.16 0.00 0.00 179.01 178.41 3mkv h SER 119 N 0.26 0.00 0.00 1.42 4.64 -1.20 -3.47 113.55 115.19 3mkv h SER 119 Ca 0.11 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3mkv h SER 119 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3mkv h SER 119 CO -0.02 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.56 3mkv n GLY 120 N 1.19 0.35 0.28 -0.77 0.00 -0.71 -4.95 105.19 100.58 3mkv n GLY 120 Ca 0.03 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.07 3mkv n GLY 120 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3mkv h LEU 121 N 0.00 -0.69 -8.72 0.99 3.38 -1.49 -3.42 115.31 105.35 3mkv h LEU 121 Ca 0.00 0.23 -0.32 0.00 0.09 0.00 0.00 57.88 57.88 3mkv h LEU 121 Cb 0.00 0.47 -0.15 0.00 0.09 0.00 0.00 40.66 41.07 3mkv h LEU 121 CO 0.00 -0.25 -0.67 0.68 0.09 0.00 0.00 178.44 178.29 3mkv s VAL 122 N -6.23 0.87 -0.07 1.22 -7.23 -1.08 -5.05 120.40 102.83 3mkv s VAL 122 Ca -0.14 -2.01 -0.01 0.00 -1.81 0.00 0.00 61.98 58.01 3mkv s VAL 122 Cb 0.22 -2.14 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 3mkv s VAL 122 CO 0.75 -0.48 -0.01 -1.61 -0.31 0.00 0.00 175.10 173.45 3mkv s GLU 123 N -3.87 2.91 0.00 4.82 2.02 -1.26 -4.44 118.70 118.88 3mkv s GLU 123 Ca 0.24 -0.46 0.00 0.00 0.02 0.00 0.00 54.97 54.77 3mkv s GLU 123 Cb 0.05 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.54 3mkv s GLU 123 CO 0.05 0.68 0.00 0.41 0.02 0.00 0.00 175.26 176.42 3mkv n GLY 124 N 2.00 -1.28 3.80 -1.39 0.00 -1.26 -3.82 105.19 103.24 3mkv n GLY 124 Ca -0.18 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 3mkv n GLY 124 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3mkv s PRO 125 N -0.68 2.81 0.38 1.61 0.02 -1.26 -4.93 135.00 132.95 3mkv s PRO 125 Ca 0.00 1.10 -0.28 0.00 0.02 0.00 0.00 61.00 61.84 3mkv s PRO 125 Cb 0.00 -1.97 -0.11 0.00 0.02 0.00 0.00 34.50 32.44 3mkv s PRO 125 CO 0.00 -1.21 1.46 0.50 -0.33 0.00 0.00 177.00 177.43 3mkv s ARG 126 N -4.75 4.12 -0.13 5.54 3.52 0.25 -4.79 118.95 122.71 3mkv s ARG 126 Ca 0.61 2.53 -0.02 0.00 -0.13 0.00 0.00 55.73 58.71 3mkv s ARG 126 Cb -0.16 -2.96 -0.03 0.00 -1.56 0.00 0.00 34.95 30.24 3mkv s ARG 126 CO 0.51 -0.51 -0.06 -0.51 -0.81 0.00 0.00 175.30 173.92 3mkv s LEU 127 N -2.09 3.15 -0.32 -0.88 1.43 -1.26 -0.60 118.68 118.11 3mkv s LEU 127 Ca 0.53 -0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 53.45 3mkv s LEU 127 Cb -0.46 -1.73 0.04 0.00 0.03 0.00 0.00 46.19 44.07 3mkv s LEU 127 CO 0.62 0.21 0.06 -0.36 0.23 0.00 0.00 176.35 177.11 3mkv s PHE 128 N 0.08 3.25 -0.11 0.29 0.40 -0.03 -4.94 117.98 116.91 3mkv s PHE 128 Ca -0.01 -1.58 -0.04 0.00 -0.60 0.00 0.00 56.93 54.69 3mkv s PHE 128 Cb -0.14 -2.20 -0.04 0.00 0.51 0.00 0.00 43.02 41.16 3mkv s PHE 128 CO 0.03 -0.75 0.04 0.14 0.70 0.00 0.00 175.22 175.38 3mkv s VAL 129 N 1.35 4.60 -0.19 -0.44 -7.23 -1.26 -0.33 120.40 116.89 3mkv s VAL 129 Ca -0.03 -0.13 0.20 0.00 -1.81 0.00 0.00 61.98 60.22 3mkv s VAL 129 Cb -0.19 -2.98 -0.06 0.00 0.56 0.00 0.00 36.38 33.71 3mkv s VAL 129 CO 0.01 0.58 0.95 -1.20 -0.31 0.00 0.00 175.10 175.13 3mkv n SER 130 N 2.40 0.84 0.00 4.85 7.64 -1.16 0.70 113.62 128.88 3mkv n SER 130 Ca -0.19 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.04 3mkv n SER 130 Cb 0.54 0.36 0.00 0.00 -1.01 0.00 0.00 64.21 64.10 3mkv n SER 130 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mkv n GLY 131 N 1.26 0.41 3.81 0.23 0.00 -1.21 -4.68 105.19 105.02 3mkv n GLY 131 Ca -0.04 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.75 3mkv n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mkv s ARG 132 N 0.00 3.94 0.36 1.61 0.52 -1.26 -0.16 118.95 123.95 3mkv s ARG 132 Ca 0.00 0.26 -0.27 0.00 -0.52 0.00 0.00 55.73 55.19 3mkv s ARG 132 Cb 0.00 -3.27 -0.10 0.00 0.52 0.00 0.00 34.95 32.10 3mkv s ARG 132 CO 0.00 0.57 1.27 0.00 0.02 0.00 0.00 175.30 177.16 3mkv s ALA 133 N -0.62 3.38 -0.02 2.13 0.00 -0.78 -4.75 121.76 121.10 3mkv s ALA 133 Ca 0.21 1.19 -0.23 0.00 0.00 0.00 0.00 51.96 53.13 3mkv s ALA 133 Cb -0.15 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.47 3mkv s ALA 133 CO 0.10 -0.65 0.68 -0.51 0.00 0.00 0.00 175.76 175.38 3mkv s LEU 134 N -2.05 4.37 0.01 0.00 1.02 -1.26 -0.82 118.68 119.96 3mkv s LEU 134 Ca 0.52 1.23 0.00 0.00 0.02 0.00 0.00 54.13 55.91 3mkv s LEU 134 Cb -0.38 -3.06 -0.01 0.00 0.02 0.00 0.00 46.19 42.76 3mkv s LEU 134 CO 0.49 -0.02 -0.03 -0.55 0.02 0.00 0.00 176.35 176.26 3mkv s SER 135 N 0.33 0.24 0.94 2.29 0.15 -0.46 -1.52 113.70 115.66 3mkv s SER 135 Ca 0.36 -0.29 -0.12 0.00 0.70 0.00 0.00 55.95 56.59 3mkv s SER 135 Cb -0.18 0.05 0.15 0.00 -1.71 0.00 0.00 66.02 64.32 3mkv s SER 135 CO 0.19 -0.15 1.11 0.00 1.20 0.00 0.00 173.24 175.58 3mkv s GLN 136 N -0.84 0.93 0.15 5.44 -2.07 -1.26 -1.07 119.66 120.94 3mkv s GLN 136 Ca -0.08 0.49 -0.31 0.00 -1.82 0.00 0.00 55.36 53.63 3mkv s GLN 136 Cb -0.06 -1.80 -0.10 0.00 -1.09 0.00 0.00 33.01 29.97 3mkv s GLN 136 CO -0.00 -2.39 1.58 0.99 -1.32 0.00 0.00 175.29 174.15 3mkv s THR 137 N -3.09 2.66 0.00 3.63 2.01 -1.26 -1.35 115.64 118.24 3mkv s THR 137 Ca 0.64 0.44 0.00 0.00 0.31 0.00 0.00 61.69 63.08 3mkv s THR 137 Cb -0.17 -3.28 0.00 0.00 0.01 0.00 0.00 72.50 69.06 3mkv s THR 137 CO 0.56 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.13 3mkv n GLY 138 N 3.79 0.55 3.97 4.40 0.00 -1.26 -5.04 105.19 111.60 3mkv n GLY 138 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 3mkv n GLY 138 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mkv s GLY 139 N -2.00 1.79 0.37 -0.02 0.00 -0.46 -4.37 107.32 102.63 3mkv s GLY 139 Ca 0.00 -1.56 0.12 0.00 0.00 0.00 0.00 44.72 43.27 3mkv s GLY 139 CO 0.00 -0.83 1.85 0.84 0.00 0.00 0.00 173.10 174.96 3mkv h HIS 140 N -1.22 0.74 -0.53 1.90 -0.00 -1.86 -0.57 115.15 113.61 3mkv h HIS 140 Ca -0.40 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 59.96 3mkv h HIS 140 Cb 1.24 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 28.40 3mkv h HIS 140 CO -0.90 0.23 0.05 0.00 -0.00 0.00 0.00 177.93 177.31 3mkv n ALA 141 N -2.45 3.83 -2.69 5.26 0.00 -1.26 -4.47 120.51 118.73 3mkv n ALA 141 Ca 0.19 -1.72 -0.44 0.00 0.00 0.00 0.00 53.44 51.47 3mkv n ALA 141 Cb 0.57 -1.13 -0.08 0.00 0.00 0.00 0.00 19.45 18.80 3mkv n ALA 141 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3mkv s ASP 142 N -0.69 6.16 0.10 0.00 -1.08 -0.23 -4.29 116.67 116.64 3mkv s ASP 142 Ca 0.47 -1.04 0.23 0.00 -0.52 0.00 0.00 52.55 51.69 3mkv s ASP 142 Cb 0.36 -2.21 0.91 0.00 -1.46 0.00 0.00 42.92 40.52 3mkv s ASP 142 CO 0.13 -0.64 1.71 -0.81 0.52 0.00 0.00 175.17 176.08 3mkv n PRO 143 N 5.44 0.10 -1.96 4.34 -0.04 -1.26 -4.64 135.00 136.97 3mkv n PRO 143 Ca -0.10 0.22 -0.42 0.00 -0.04 0.00 0.00 63.50 63.16 3mkv n PRO 143 Cb 0.45 -1.65 -0.03 0.00 -0.04 0.00 0.00 33.50 32.24 3mkv n PRO 143 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3mkv s ARG 144 N -3.09 4.23 0.93 0.54 0.52 -1.26 -4.86 118.95 115.96 3mkv s ARG 144 Ca 0.09 2.33 -0.12 0.00 -0.52 0.00 0.00 55.73 57.51 3mkv s ARG 144 Cb 0.13 -3.14 0.15 0.00 0.52 0.00 0.00 34.95 32.60 3mkv s ARG 144 CO 0.43 -0.55 1.12 0.00 0.02 0.00 0.00 175.30 176.32 3mkv s ALA 145 N 0.80 1.57 -0.22 2.13 0.00 -1.26 -4.72 121.76 120.05 3mkv s ALA 145 Ca 0.67 -0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.05 3mkv s ALA 145 Cb -0.43 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 3mkv s ALA 145 CO 0.35 -2.40 0.34 0.50 0.00 0.00 0.00 175.76 174.55 3mkv s ARG 146 N -5.16 4.13 0.00 0.00 3.52 -1.26 -5.01 118.95 115.16 3mkv s ARG 146 Ca 0.64 0.07 0.00 0.00 -0.13 0.00 0.00 55.73 56.31 3mkv s ARG 146 Cb -0.16 -3.55 0.00 0.00 -1.56 0.00 0.00 34.95 29.68 3mkv s ARG 146 CO 0.55 -0.05 0.00 0.45 -0.81 0.00 0.00 175.30 175.44 3mkv n SER 147 N 4.55 0.00 -1.42 -2.12 2.88 -1.26 -5.05 113.62 111.20 3mkv n SER 147 Ca -0.10 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.56 3mkv n SER 147 Cb 0.51 0.00 0.33 0.00 -0.75 0.00 0.00 64.21 64.31 3mkv n SER 147 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3mkv n ASP 148 N 0.00 4.13 -3.96 -3.46 5.75 -1.26 -4.95 116.55 112.81 3mkv n ASP 148 Ca 0.00 -2.09 -0.08 0.00 -0.01 0.00 0.00 54.79 52.60 3mkv n ASP 148 Cb 0.00 -0.51 -0.09 0.00 -1.03 0.00 0.00 41.12 39.49 3mkv n ASP 148 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 3mkv s TYR 149 N -1.19 0.29 -0.40 2.11 -0.85 -1.26 -5.12 117.35 110.93 3mkv s TYR 149 Ca 0.50 -0.71 -0.04 0.00 -0.52 0.00 0.00 57.07 56.30 3mkv s TYR 149 Cb 0.27 -0.20 0.10 0.00 0.38 0.00 0.00 41.96 42.52 3mkv s TYR 149 CO 0.32 -0.42 0.20 -1.64 -1.52 0.00 0.00 175.55 172.49 3mkv s MET 150 N -3.38 2.20 0.74 -3.49 -1.94 -1.26 -5.02 119.30 107.15 3mkv s MET 150 Ca 0.02 -1.69 -0.15 0.00 -1.71 0.00 0.00 55.69 52.16 3mkv s MET 150 Cb 0.03 -3.60 0.04 0.00 2.01 0.00 0.00 34.83 33.32 3mkv s MET 150 CO -0.08 -1.01 1.19 -1.25 -0.01 0.00 0.00 175.02 173.86 3mkv s PRO 151 N 1.22 2.11 0.52 2.03 0.04 -1.26 -4.95 135.00 134.71 3mkv s PRO 151 Ca 0.06 1.71 -0.23 0.00 0.04 0.00 0.00 61.00 62.58 3mkv s PRO 151 Cb -0.23 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.42 3mkv s PRO 151 CO -0.02 -1.85 1.37 -2.30 0.04 0.00 0.00 177.00 174.23 3mkv n PRO 152 N -2.82 1.81 -0.28 0.56 -0.02 -1.26 -4.85 135.00 128.13 3mkv n PRO 152 Ca 0.13 0.66 0.13 0.00 -2.02 0.00 0.00 63.50 62.40 3mkv n PRO 152 Cb 0.50 -2.58 0.25 0.00 -0.02 0.00 0.00 33.50 31.66 3mkv n PRO 152 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3mkv n ASP 153 N -0.79 -0.07 -3.91 2.55 4.64 -1.26 -4.62 116.55 113.09 3mkv n ASP 153 Ca 0.09 1.36 -0.09 0.00 -1.38 0.00 0.00 54.79 54.77 3mkv n ASP 153 Cb 0.44 -0.51 -0.06 0.00 -1.04 0.00 0.00 41.12 39.95 3mkv n ASP 153 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3mkv s SER 154 N -4.98 -0.05 0.01 1.67 1.04 -1.26 -4.88 113.70 105.24 3mkv s SER 154 Ca -0.10 -0.78 -0.03 0.00 0.48 0.00 0.00 55.95 55.52 3mkv s SER 154 Cb 0.24 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.84 3mkv s SER 154 CO 0.63 -0.97 1.04 -0.65 0.98 0.00 0.00 173.24 174.27 3mkv h PRO 155 N 2.42 -0.05 -4.32 4.02 0.11 -1.96 -3.38 132.00 128.84 3mkv h PRO 155 Ca -0.30 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.18 3mkv h PRO 155 Cb 1.24 0.01 -0.39 0.00 0.11 0.00 0.00 31.00 31.97 3mkv h PRO 155 CO 0.44 -0.03 -0.75 0.00 -0.21 0.00 0.00 178.00 177.45 3mkv n GLY 157 N 4.52 -0.28 0.11 0.00 0.00 -1.26 -1.80 105.19 106.48 3mkv n GLY 157 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 3mkv n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mkv s VAL 160 N 1.76 2.93 -0.08 0.00 1.01 -1.26 -4.79 120.40 119.97 3mkv s VAL 160 Ca 0.15 0.72 -0.24 0.00 0.00 0.00 0.00 61.98 62.61 3mkv s VAL 160 Cb -0.15 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 3mkv s VAL 160 CO 0.09 0.08 0.75 -0.13 0.00 0.00 0.00 175.10 175.89 3mkv s ARG 161 N 0.42 4.42 0.35 2.72 1.81 -1.26 -4.96 118.95 122.45 3mkv s ARG 161 Ca 0.63 0.94 0.08 0.00 -1.72 0.00 0.00 55.73 55.66 3mkv s ARG 161 Cb -0.40 -3.48 0.80 0.00 -0.45 0.00 0.00 34.95 31.43 3mkv s ARG 161 CO 0.36 -0.03 1.86 0.28 -0.68 0.00 0.00 175.30 177.09 3mkv h VAL 162 N 4.85 0.82 -0.00 3.52 2.07 -1.91 -0.99 116.25 124.61 3mkv h VAL 162 Ca -0.39 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3mkv h VAL 162 Cb 1.19 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3mkv h VAL 162 CO 0.77 0.13 -0.02 0.61 0.02 0.00 0.00 177.57 179.07 3mkv n GLY 163 N -1.42 -1.16 3.68 2.17 0.00 -1.26 -4.78 105.19 102.41 3mkv n GLY 163 Ca 0.18 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3mkv n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mkv s ALA 164 N -2.46 3.56 -0.20 4.61 0.00 -0.38 -3.60 121.76 123.30 3mkv s ALA 164 Ca 0.32 0.65 0.19 0.00 0.00 0.00 0.00 51.96 53.12 3mkv s ALA 164 Cb 0.21 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 3mkv s ALA 164 CO 0.45 -0.93 1.08 -0.07 0.00 0.00 0.00 175.76 176.29 3mkv h LEU 165 N 8.71 0.00 0.00 0.00 3.38 -1.88 -3.37 115.31 122.15 3mkv h LEU 165 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3mkv h LEU 165 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3mkv h LEU 165 CO 0.91 0.31 0.00 0.61 0.09 0.00 0.00 178.44 180.36 3mkv n GLY 166 N 1.26 3.61 3.49 0.83 0.00 -1.26 -1.86 105.19 111.26 3mkv n GLY 166 Ca -0.03 -1.43 -0.17 0.00 0.00 0.00 0.00 46.02 44.39 3mkv n GLY 166 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3mkv s ARG 167 N -1.50 0.98 -0.15 1.61 1.70 0.00 -4.75 118.95 116.84 3mkv s ARG 167 Ca 0.00 0.28 -0.14 0.00 -0.47 0.00 0.00 55.73 55.40 3mkv s ARG 167 Cb 0.00 0.46 -0.05 0.00 -0.57 0.00 0.00 34.95 34.80 3mkv s ARG 167 CO 0.00 -0.29 0.29 0.08 -1.08 0.00 0.00 175.30 174.31 3mkv s VAL 168 N -1.04 5.30 -0.07 4.99 1.01 -1.26 -1.35 120.40 127.98 3mkv s VAL 168 Ca -0.10 0.55 -0.04 0.00 0.00 0.00 0.00 61.98 62.39 3mkv s VAL 168 Cb -0.01 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.78 3mkv s VAL 168 CO 0.08 0.40 0.17 0.00 0.00 0.00 0.00 175.10 175.75 3mkv s ALA 169 N 0.37 -0.34 -0.03 5.51 0.00 -0.24 -4.93 121.76 122.10 3mkv s ALA 169 Ca 0.17 0.73 0.05 0.00 0.00 0.00 0.00 51.96 52.91 3mkv s ALA 169 Cb -0.13 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 3mkv s ALA 169 CO 0.04 -0.16 -0.17 -0.51 0.00 0.00 0.00 175.76 174.96 3mkv s ASP 170 N 1.11 2.07 0.00 0.00 1.01 -1.26 -3.98 116.67 115.62 3mkv s ASP 170 Ca -0.08 -0.33 0.00 0.00 0.71 0.00 0.00 52.55 52.85 3mkv s ASP 170 Cb -0.10 -0.41 0.00 0.00 1.01 0.00 0.00 42.92 43.41 3mkv s ASP 170 CO -0.06 0.18 0.00 0.61 0.21 0.00 0.00 175.17 176.11 3mkv n GLY 171 N 2.92 -0.37 0.08 0.21 0.00 -1.26 -4.20 105.19 102.57 3mkv n GLY 171 Ca -0.16 -1.59 -0.13 0.00 0.00 0.00 0.00 46.02 44.13 3mkv n GLY 171 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3mkv h VAL 172 N 0.00 0.94 0.10 1.61 2.07 -1.95 -0.22 116.25 118.80 3mkv h VAL 172 Ca 0.00 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.46 3mkv h VAL 172 Cb 0.00 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3mkv h VAL 172 CO 0.00 0.02 -0.21 0.44 0.02 0.00 0.00 177.57 177.84 3mkv h ASP 173 N -0.15 -0.58 -0.49 0.57 3.45 -1.99 0.88 116.42 118.12 3mkv h ASP 173 Ca -0.01 0.07 0.05 0.00 0.43 0.00 0.00 57.03 57.57 3mkv h ASP 173 Cb 0.12 0.22 -0.05 0.00 -0.56 0.00 0.00 39.33 39.06 3mkv h ASP 173 CO 0.02 -0.29 0.22 -0.08 -1.57 0.00 0.00 179.24 177.54 3mkv h GLU 174 N -0.39 0.42 -0.12 3.56 4.81 -1.68 -0.43 114.58 120.76 3mkv h GLU 174 Ca 0.03 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.09 3mkv h GLU 174 Cb 0.41 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 3mkv h GLU 174 CO -0.12 0.28 -0.54 -0.39 -0.73 0.00 0.00 179.01 177.51 3mkv h VAL 175 N 0.43 1.35 -0.35 0.32 -1.51 -0.79 -1.82 116.25 113.89 3mkv h VAL 175 Ca 0.22 -1.82 -0.06 0.00 -1.23 0.00 0.00 66.70 63.80 3mkv h VAL 175 Cb 0.16 1.85 -0.02 0.00 -2.13 0.00 0.00 31.29 31.16 3mkv h VAL 175 CO -0.18 0.55 -0.06 0.03 -1.23 0.00 0.00 177.57 176.68 3mkv h ARG 176 N 0.28 0.57 0.06 5.19 3.08 -0.23 -1.48 114.38 121.85 3mkv h ARG 176 Ca 0.01 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.91 3mkv h ARG 176 Cb 1.04 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.02 3mkv h ARG 176 CO 0.09 0.63 -0.03 -0.09 -1.07 0.00 0.00 179.97 179.51 3mkv h ARG 177 N 0.53 -0.08 -0.46 0.04 2.43 -0.91 -2.10 114.38 113.83 3mkv h ARG 177 Ca 0.11 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.37 3mkv h ARG 177 Cb 0.43 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 29.92 3mkv h ARG 177 CO 0.02 0.40 -0.01 0.00 -1.51 0.00 0.00 179.97 178.87 3mkv h ALA 178 N 0.29 0.42 -0.05 2.80 0.00 -1.29 0.19 119.26 121.62 3mkv h ALA 178 Ca -0.01 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3mkv h ALA 178 Cb 0.51 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3mkv h ALA 178 CO 0.01 -0.39 0.01 0.28 0.00 0.00 0.00 179.25 179.16 3mkv h VAL 179 N 0.10 0.99 -0.71 0.00 2.07 -1.32 -1.16 116.25 116.22 3mkv h VAL 179 Ca 0.23 -0.01 0.14 0.00 0.82 0.00 0.00 66.70 67.88 3mkv h VAL 179 Cb 0.34 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3mkv h VAL 179 CO -0.39 0.01 0.48 0.03 0.02 0.00 0.00 177.57 177.71 3mkv h ARG 180 N 0.04 0.38 -0.06 1.57 3.08 -0.57 -1.30 114.38 117.52 3mkv h ARG 180 Ca 0.02 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 3mkv h ARG 180 Cb 0.01 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.98 3mkv h ARG 180 CO -0.02 0.25 -0.18 0.93 -1.07 0.00 0.00 179.97 179.88 3mkv h GLU 181 N 0.39 0.22 -0.86 0.04 5.08 -0.03 -0.42 114.58 119.01 3mkv h GLU 181 Ca 0.35 -0.16 0.07 0.00 -1.00 0.00 0.00 59.36 58.61 3mkv h GLU 181 Cb 0.81 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.02 3mkv h GLU 181 CO -0.10 0.79 0.52 0.93 -1.00 0.00 0.00 179.01 180.15 3mkv h GLU 182 N -0.30 0.91 -0.08 2.33 4.39 -0.71 0.46 114.58 121.58 3mkv h GLU 182 Ca -0.01 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.60 3mkv h GLU 182 Cb 0.80 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 3mkv h GLU 182 CO 0.04 0.60 -0.09 -0.07 -1.16 0.00 0.00 179.01 178.33 3mkv h LEU 183 N 0.94 0.22 -0.77 1.33 3.38 -1.29 -1.70 115.31 117.41 3mkv h LEU 183 Ca 0.38 -0.50 0.18 0.00 0.09 0.00 0.00 57.88 58.03 3mkv h LEU 183 Cb 0.22 -0.06 -0.12 0.00 0.09 0.00 0.00 40.66 40.79 3mkv h LEU 183 CO -0.19 0.67 0.16 -0.61 0.09 0.00 0.00 178.44 178.56 3mkv h GLN 184 N -0.23 0.22 0.00 1.13 -0.00 -0.52 -0.14 115.11 115.56 3mkv h GLN 184 Ca 0.01 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3mkv h GLN 184 Cb 0.62 -0.05 0.00 0.00 0.00 0.00 0.00 27.48 28.05 3mkv h GLN 184 CO 0.02 0.14 0.00 -1.33 0.00 0.00 0.00 178.83 177.67 3mkv n MET 185 N -5.21 0.31 0.00 1.69 2.81 0.16 -4.86 117.12 112.02 3mkv n MET 185 Ca 0.16 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 56.13 3mkv n MET 185 Cb 0.51 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.52 3mkv n MET 185 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3mkv n GLY 186 N 0.50 1.35 3.76 3.03 0.00 -0.07 -4.46 105.19 109.30 3mkv n GLY 186 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 3mkv n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mkv s ALA 187 N -2.00 3.12 -0.10 4.61 0.00 -0.68 -4.58 121.76 122.12 3mkv s ALA 187 Ca 0.00 1.32 0.15 0.00 0.00 0.00 0.00 51.96 53.43 3mkv s ALA 187 Cb 0.00 -3.54 -0.13 0.00 0.00 0.00 0.00 23.12 19.45 3mkv s ALA 187 CO 0.00 -1.09 0.89 -0.44 0.00 0.00 0.00 175.76 175.12 3mkv h ASP 188 N 2.18 0.00 -5.10 0.00 3.32 -0.04 -3.45 116.42 113.34 3mkv h ASP 188 Ca -0.50 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.56 3mkv h ASP 188 Cb 1.27 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.75 3mkv h ASP 188 CO 0.60 0.66 0.10 0.00 -1.72 0.00 0.00 179.24 178.88 3mkv s GLN 189 N -2.86 1.73 0.00 3.56 0.00 -1.14 -4.70 119.66 116.25 3mkv s GLN 189 Ca -0.02 -1.12 0.00 0.00 -0.00 0.00 0.00 55.36 54.22 3mkv s GLN 189 Cb 0.08 0.56 0.00 0.00 0.00 0.00 0.00 33.01 33.65 3mkv s GLN 189 CO 0.81 -0.77 0.00 -0.89 0.00 0.00 0.00 175.29 174.44 3mkv n ILE 190 N -0.44 0.00 0.00 3.63 2.08 -0.64 -4.22 119.36 119.77 3mkv n ILE 190 Ca -0.03 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.28 3mkv n ILE 190 Cb 0.60 -0.44 0.00 0.00 -0.75 0.00 0.00 39.64 39.05 3mkv n ILE 190 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 3mkv n ILE 192 N -0.41 0.00 -3.36 1.39 -5.35 0.01 0.18 119.36 111.81 3mkv n ILE 192 Ca 0.00 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 62.07 3mkv n ILE 192 Cb 0.00 0.00 -0.09 0.00 -1.74 0.00 0.00 39.64 37.81 3mkv n ILE 192 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 3mkv s MET 193 N -2.00 3.64 0.00 6.28 -1.94 -0.58 -1.21 119.30 123.49 3mkv s MET 193 Ca 0.00 -0.30 0.14 0.00 -1.71 0.00 0.00 55.69 53.83 3mkv s MET 193 Cb 0.00 -3.78 0.41 0.00 2.01 0.00 0.00 34.83 33.46 3mkv s MET 193 CO 0.00 -0.52 1.34 0.00 -0.01 0.00 0.00 175.02 175.83 3mkv n ALA 194 N 5.46 2.24 -3.83 3.03 0.00 0.37 -4.43 120.51 123.36 3mkv n ALA 194 Ca -0.08 -1.18 -0.07 0.00 0.00 0.00 0.00 53.44 52.11 3mkv n ALA 194 Cb 0.49 -0.59 0.01 0.00 0.00 0.00 0.00 19.45 19.37 3mkv n ALA 194 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3mkv s SER 195 N -1.01 -0.05 1.05 0.00 1.04 -1.13 -0.92 113.70 112.68 3mkv s SER 195 Ca 0.31 -0.91 -0.14 0.00 0.48 0.00 0.00 55.95 55.69 3mkv s SER 195 Cb 0.16 0.74 0.22 0.00 0.10 0.00 0.00 66.02 67.24 3mkv s SER 195 CO 0.21 -1.44 1.09 -0.83 0.98 0.00 0.00 173.24 173.25 3mkv s GLY 196 N -3.10 1.56 0.19 7.32 0.00 0.37 -4.27 107.32 109.38 3mkv s GLY 196 Ca 0.16 -0.48 0.03 0.00 0.00 0.00 0.00 44.72 44.43 3mkv s GLY 196 CO 0.09 0.20 0.11 0.61 0.00 0.00 0.00 173.10 174.11 3mkv n GLY 197 N -0.96 3.56 0.11 0.20 0.00 -1.25 -4.66 105.19 102.19 3mkv n GLY 197 Ca 0.06 -1.89 -0.23 0.00 0.00 0.00 0.00 46.02 43.96 3mkv n GLY 197 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3mkv n VAL 198 N -0.39 1.53 1.43 1.61 0.31 -1.26 -4.45 118.33 117.11 3mkv n VAL 198 Ca 0.01 -0.14 0.02 0.00 -0.01 0.00 0.00 64.34 64.22 3mkv n VAL 198 Cb 0.31 -2.01 0.05 0.00 -0.91 0.00 0.00 33.84 31.27 3mkv n VAL 198 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3mkv n ALA 199 N -3.75 2.54 -2.92 3.52 0.00 -1.26 -4.18 120.51 114.45 3mkv n ALA 199 Ca -0.38 -0.21 -0.25 0.00 0.00 0.00 0.00 53.44 52.60 3mkv n ALA 199 Cb 0.73 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 3mkv n ALA 199 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3mkv s SER 200 N -0.77 6.18 -0.02 0.00 1.04 -1.26 -4.73 113.70 114.13 3mkv s SER 200 Ca 0.07 0.08 -0.26 0.00 0.48 0.00 0.00 55.95 56.33 3mkv s SER 200 Cb 0.04 -1.81 -0.20 0.00 0.10 0.00 0.00 66.02 64.15 3mkv s SER 200 CO 0.04 0.02 1.25 -0.65 0.98 0.00 0.00 173.24 174.88 3mkv h PRO 201 N 1.89 0.02 -0.00 4.02 0.11 -1.88 -3.41 132.00 132.76 3mkv h PRO 201 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3mkv h PRO 201 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3mkv h PRO 201 CO 0.66 0.52 -0.05 0.25 -0.21 0.00 0.00 178.00 179.16 3mkv n THR 202 N -4.83 0.00 -3.64 -1.15 -2.24 -1.26 -4.82 114.28 96.34 3mkv n THR 202 Ca -0.08 -0.47 -0.36 0.00 -2.27 0.00 0.00 64.05 60.86 3mkv n THR 202 Cb 0.27 1.02 -0.09 0.00 -2.10 0.00 0.00 70.33 69.43 3mkv n THR 202 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3mkv s ASP 203 N -0.73 6.21 0.78 3.42 3.84 -1.26 -5.08 116.67 123.85 3mkv s ASP 203 Ca 0.02 0.23 -0.13 0.00 -0.00 0.00 0.00 52.55 52.67 3mkv s ASP 203 Cb 0.02 -2.12 0.07 0.00 -1.38 0.00 0.00 42.92 39.50 3mkv s ASP 203 CO 0.06 0.09 1.17 -2.84 -0.00 0.00 0.00 175.17 173.65 3mkv s PRO 204 N 0.79 1.91 0.25 2.11 0.02 -1.26 -4.00 135.00 134.82 3mkv s PRO 204 Ca 0.10 1.62 0.03 0.00 0.02 0.00 0.00 61.00 62.76 3mkv s PRO 204 Cb -0.13 -1.82 0.32 0.00 0.02 0.00 0.00 34.50 32.89 3mkv s PRO 204 CO 0.03 -1.98 1.63 0.28 -0.33 0.00 0.00 177.00 176.63 3mkv h VAL 205 N -0.77 1.32 0.00 3.83 2.07 -1.83 -3.17 116.25 117.70 3mkv h VAL 205 Ca -0.46 -1.62 0.00 0.00 0.82 0.00 0.00 66.70 65.44 3mkv h VAL 205 Cb 1.28 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.73 3mkv h VAL 205 CO 0.48 0.49 -0.06 0.61 0.02 0.00 0.00 177.57 179.11 3mkv n GLY 206 N -0.04 -1.63 3.75 2.17 0.00 -1.26 -3.58 105.19 104.59 3mkv n GLY 206 Ca -0.02 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 3mkv n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mkv s VAL 207 N -3.08 3.13 0.55 1.61 0.11 -1.20 -4.82 120.40 116.70 3mkv s VAL 207 Ca 0.11 1.03 -0.20 0.00 -2.93 0.00 0.00 61.98 59.99 3mkv s VAL 207 Cb 0.14 -3.66 -0.05 0.00 -1.53 0.00 0.00 36.38 31.28 3mkv s VAL 207 CO 0.60 0.20 1.21 -0.36 -3.33 0.00 0.00 175.10 173.42 3mkv s PHE 208 N -0.56 2.53 -0.29 1.54 0.08 -1.26 -0.48 117.98 119.54 3mkv s PHE 208 Ca 0.51 1.50 -0.07 0.00 0.12 0.00 0.00 56.93 58.99 3mkv s PHE 208 Cb -0.36 -3.48 0.00 0.00 -0.57 0.00 0.00 43.02 38.61 3mkv s PHE 208 CO 0.43 -2.06 0.09 0.20 -0.10 0.00 0.00 175.22 173.78 3mkv s GLY 209 N -1.46 1.79 0.02 4.36 0.00 -0.10 -4.65 107.32 107.27 3mkv s GLY 209 Ca 0.73 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 44.05 3mkv s GLY 209 CO 0.35 0.63 0.00 -1.72 0.00 0.00 0.00 173.10 172.36 3mkv n TYR 210 N 4.89 -0.14 -1.23 1.90 0.53 -1.26 -4.50 117.16 117.34 3mkv n TYR 210 Ca -0.15 0.08 -0.29 0.00 -1.02 0.00 0.00 57.90 56.52 3mkv n TYR 210 Cb 0.49 -0.86 0.17 0.00 -1.03 0.00 0.00 39.34 38.10 3mkv n TYR 210 CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 3mkv s SER 211 N -2.51 2.81 0.18 7.72 1.04 -1.26 -4.90 113.70 116.79 3mkv s SER 211 Ca 0.00 1.16 -0.05 0.00 0.48 0.00 0.00 55.95 57.54 3mkv s SER 211 Cb 0.00 -1.82 0.09 0.00 0.10 0.00 0.00 66.02 64.39 3mkv s SER 211 CO 0.00 -3.01 1.52 -0.33 0.98 0.00 0.00 173.24 172.40 3mkv h GLU 212 N -1.81 0.68 -0.62 4.02 5.08 -1.97 -2.36 114.58 117.60 3mkv h GLU 212 Ca -0.54 -0.38 0.13 0.00 -1.00 0.00 0.00 59.36 57.57 3mkv h GLU 212 Cb 1.33 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 30.50 3mkv h GLU 212 CO 0.58 1.00 0.01 -0.44 -1.00 0.00 0.00 179.01 179.16 3mkv h ASP 213 N 0.55 -0.26 -0.21 1.42 5.19 -1.99 0.12 116.42 121.24 3mkv h ASP 213 Ca 0.03 0.15 -0.12 0.00 -0.62 0.00 0.00 57.03 56.48 3mkv h ASP 213 Cb 1.01 0.26 -0.01 0.00 0.18 0.00 0.00 39.33 40.77 3mkv h ASP 213 CO 0.09 -0.11 -0.27 -0.33 -3.12 0.00 0.00 179.24 175.51 3mkv h GLU 214 N 0.12 0.69 -0.13 3.56 5.08 -1.87 -2.06 114.58 119.98 3mkv h GLU 214 Ca 0.32 -0.29 -0.20 0.00 -1.00 0.00 0.00 59.36 58.20 3mkv h GLU 214 Cb 0.52 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.75 3mkv h GLU 214 CO -0.52 0.88 -0.72 0.82 -1.00 0.00 0.00 179.01 178.47 3mkv h ILE 215 N 0.60 1.33 -0.06 3.13 2.04 -0.72 -1.77 117.51 122.06 3mkv h ILE 215 Ca 0.08 -2.02 -0.13 0.00 1.00 0.00 0.00 64.86 63.79 3mkv h ILE 215 Cb 0.76 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.83 3mkv h ILE 215 CO 0.06 0.62 -0.54 0.03 0.00 0.00 0.00 178.15 178.32 3mkv h ARG 216 N 0.41 0.16 -0.12 2.37 3.08 -0.77 -0.19 114.38 119.32 3mkv h ARG 216 Ca -0.03 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 3mkv h ARG 216 Cb 1.32 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.37 3mkv h ARG 216 CO 0.14 0.66 -0.03 0.00 -1.07 0.00 0.00 179.97 179.67 3mkv h ALA 217 N 1.32 0.17 0.17 0.04 0.00 -1.28 -1.43 119.26 118.25 3mkv h ALA 217 Ca -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3mkv h ALA 217 Cb 1.00 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 3mkv h ALA 217 CO 0.08 -0.08 -0.11 0.82 0.00 0.00 0.00 179.25 179.96 3mkv h ILE 218 N -0.07 0.77 -0.19 0.00 2.04 -1.19 -2.51 117.51 116.35 3mkv h ILE 218 Ca 0.03 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.94 3mkv h ILE 218 Cb 0.46 0.77 -0.05 0.00 -0.74 0.00 0.00 36.82 37.25 3mkv h ILE 218 CO 0.01 0.00 -0.14 0.58 0.00 0.00 0.00 178.15 178.60 3mkv h VAL 219 N -0.27 0.59 -0.74 1.67 2.07 -1.04 -2.16 116.25 116.37 3mkv h VAL 219 Ca -0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.67 3mkv h VAL 219 Cb 0.23 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 3mkv h VAL 219 CO 0.01 0.00 0.50 0.00 0.02 0.00 0.00 177.57 178.10 3mkv h ALA 220 N 0.97 2.22 0.20 1.67 0.00 -1.20 -0.53 119.26 122.60 3mkv h ALA 220 Ca 0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3mkv h ALA 220 Cb 0.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3mkv h ALA 220 CO -0.28 -0.43 -0.10 0.93 0.00 0.00 0.00 179.25 179.37 3mkv h GLU 221 N 0.33 -0.26 -0.38 0.00 4.39 -0.95 -1.11 114.58 116.60 3mkv h GLU 221 Ca 0.36 0.02 0.08 0.00 0.34 0.00 0.00 59.36 60.16 3mkv h GLU 221 Cb 0.95 0.06 -0.09 0.00 -0.10 0.00 0.00 28.75 29.58 3mkv h GLU 221 CO -0.10 0.13 -0.22 0.00 -1.16 0.00 0.00 179.01 177.66 3mkv h ALA 222 N -0.16 0.05 -0.17 3.43 0.00 -0.91 -2.20 119.26 119.29 3mkv h ALA 222 Ca -0.03 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3mkv h ALA 222 Cb 0.51 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3mkv h ALA 222 CO 0.05 -0.59 0.09 1.96 0.00 0.00 0.00 179.25 180.76 3mkv h GLN 223 N -0.15 0.24 -1.45 0.00 4.20 -1.07 0.55 115.11 117.43 3mkv h GLN 223 Ca 0.19 -0.03 0.42 0.00 0.06 0.00 0.00 58.65 59.29 3mkv h GLN 223 Cb 0.44 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.12 3mkv h GLN 223 CO -0.48 0.25 1.09 0.78 -0.67 0.00 0.00 178.83 179.81 3mkv h GLY 224 N 0.17 0.00 -2.93 3.46 0.00 -0.59 1.22 103.07 104.40 3mkv h GLY 224 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 3mkv h GLY 224 CO -0.01 0.00 0.09 -2.13 0.00 0.00 0.00 176.54 174.49 3mkv n ARG 225 N -3.97 3.71 -1.47 4.80 0.63 -0.72 -4.93 116.66 114.71 3mkv n ARG 225 Ca 0.32 -3.06 -0.12 0.00 -0.92 0.00 0.00 57.85 54.07 3mkv n ARG 225 Cb 1.55 -2.10 -0.04 0.00 0.45 0.00 0.00 32.46 32.31 3mkv n ARG 225 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3mkv n GLY 226 N -0.11 1.08 0.00 5.14 0.00 0.42 -4.99 105.19 106.73 3mkv n GLY 226 Ca 0.31 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3mkv n GLY 226 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3mkv n THR 227 N -2.86 0.00 -4.05 2.61 5.66 0.10 -4.96 114.28 110.79 3mkv n THR 227 Ca -0.12 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.78 3mkv n THR 227 Cb 0.42 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.14 3mkv n THR 227 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 3mkv s TYR 228 N 0.45 0.59 -0.13 1.09 -0.85 -1.26 -3.19 117.35 114.05 3mkv s TYR 228 Ca 0.00 -0.91 -0.02 0.00 -0.52 0.00 0.00 57.07 55.61 3mkv s TYR 228 Cb 0.00 0.02 -0.03 0.00 0.38 0.00 0.00 41.96 42.33 3mkv s TYR 228 CO 0.00 -0.95 -0.04 0.08 -1.52 0.00 0.00 175.55 173.12 3mkv s VAL 229 N -3.93 3.89 0.06 -3.49 1.01 -1.26 -1.62 120.40 115.06 3mkv s VAL 229 Ca 0.26 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.89 3mkv s VAL 229 Cb 0.01 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 3mkv s VAL 229 CO 0.11 0.53 0.06 -1.48 0.00 0.00 0.00 175.10 174.32 3mkv s LEU 230 N -0.04 3.76 -0.11 3.92 2.34 0.13 -1.51 118.68 127.17 3mkv s LEU 230 Ca 0.01 0.01 -0.02 0.00 0.06 0.00 0.00 54.13 54.19 3mkv s LEU 230 Cb -0.13 -2.37 0.04 0.00 -0.56 0.00 0.00 46.19 43.16 3mkv s LEU 230 CO 0.03 0.20 -0.00 0.00 -1.06 0.00 0.00 176.35 175.52 3mkv s ALA 231 N -1.32 0.89 -0.15 1.48 0.00 -0.31 -0.81 121.76 121.54 3mkv s ALA 231 Ca 0.27 -0.36 -0.29 0.00 0.00 0.00 0.00 51.96 51.58 3mkv s ALA 231 Cb -0.12 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 22.05 3mkv s ALA 231 CO 0.19 -0.66 1.95 -1.58 0.00 0.00 0.00 175.76 175.66 3mkv s HIS 232 N 1.90 1.50 -0.20 0.00 2.46 -0.35 -0.15 115.29 120.45 3mkv s HIS 232 Ca 0.03 0.25 -0.17 0.00 0.47 0.00 0.00 55.06 55.64 3mkv s HIS 232 Cb -0.14 -4.05 0.05 0.00 -0.13 0.00 0.00 32.58 28.32 3mkv s HIS 232 CO -0.06 -4.14 0.52 0.00 -2.47 0.00 0.00 174.74 168.58 3mkv s ALA 233 N 6.22 -1.29 -0.23 1.58 0.00 -1.07 -0.47 121.76 126.50 3mkv s ALA 233 Ca 0.88 1.51 -0.06 0.00 0.00 0.00 0.00 51.96 54.28 3mkv s ALA 233 Cb -0.33 -0.88 -0.12 0.00 0.00 0.00 0.00 23.12 21.79 3mkv s ALA 233 CO 0.35 -0.25 -0.26 0.66 0.00 0.00 0.00 175.76 176.26 3mkv n TYR 234 N 2.95 0.00 -3.20 0.00 4.01 -1.26 -1.52 117.16 118.14 3mkv n TYR 234 Ca -0.14 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.33 3mkv n TYR 234 Cb 0.56 -0.86 -0.02 0.00 -0.31 0.00 0.00 39.34 38.72 3mkv n TYR 234 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3mkv s THR 235 N -2.44 5.03 0.20 -0.72 -4.23 -1.26 -1.36 115.64 110.86 3mkv s THR 235 Ca -0.32 -0.13 -0.13 0.00 -1.18 0.00 0.00 61.69 59.94 3mkv s THR 235 Cb 0.11 -3.82 0.17 0.00 1.34 0.00 0.00 72.50 70.30 3mkv s THR 235 CO 0.46 -0.54 1.66 -0.65 -0.54 0.00 0.00 174.62 175.02 3mkv h PRO 236 N 0.97 0.09 -0.63 3.99 0.11 -1.94 0.89 132.00 135.49 3mkv h PRO 236 Ca -0.48 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 3mkv h PRO 236 Cb 1.21 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 3mkv h PRO 236 CO 0.63 0.06 0.13 0.00 -0.21 0.00 0.00 178.00 178.61 3mkv h ALA 237 N 1.52 1.04 -0.09 -0.75 0.00 -1.95 0.32 119.26 119.36 3mkv h ALA 237 Ca 0.29 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 3mkv h ALA 237 Cb 0.45 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.01 3mkv h ALA 237 CO -0.50 0.62 -0.55 0.00 0.00 0.00 0.00 179.25 178.82 3mkv h ALA 238 N 1.19 0.18 -0.52 0.00 0.00 -1.78 -2.31 119.26 116.02 3mkv h ALA 238 Ca 0.20 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 3mkv h ALA 238 Cb 0.37 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3mkv h ALA 238 CO 0.00 0.40 0.23 0.82 0.00 0.00 0.00 179.25 180.71 3mkv h ILE 239 N 0.11 1.21 -0.53 0.00 2.04 -0.64 -2.75 117.51 116.95 3mkv h ILE 239 Ca -0.04 -0.61 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 3mkv h ILE 239 Cb 1.20 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.91 3mkv h ILE 239 CO 0.11 0.24 0.16 0.00 0.00 0.00 0.00 178.15 178.66 3mkv h ALA 240 N 1.07 0.70 -0.46 1.87 0.00 -0.32 -1.69 119.26 120.43 3mkv h ALA 240 Ca 0.18 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3mkv h ALA 240 Cb 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3mkv h ALA 240 CO -0.02 0.36 -0.21 0.07 0.00 0.00 0.00 179.25 179.45 3mkv h ARG 241 N 0.73 0.93 0.16 0.00 0.11 -1.40 -1.67 114.38 113.25 3mkv h ARG 241 Ca 0.17 -0.39 0.00 0.00 0.10 0.00 0.00 59.98 59.87 3mkv h ARG 241 Cb 0.29 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.31 3mkv h ARG 241 CO -0.00 1.05 -0.16 0.00 0.10 0.00 0.00 179.97 180.95 3mkv h ALA 242 N 0.94 -0.32 -0.53 0.08 0.00 -1.26 0.48 119.26 118.66 3mkv h ALA 242 Ca 0.11 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.02 3mkv h ALA 242 Cb 0.77 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 3mkv h ALA 242 CO 0.06 -0.70 0.27 0.28 0.00 0.00 0.00 179.25 179.16 3mkv h VAL 243 N -0.35 0.95 -0.05 0.00 2.07 -1.22 -0.66 116.25 116.98 3mkv h VAL 243 Ca 0.00 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 3mkv h VAL 243 Cb 0.33 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 3mkv h VAL 243 CO -0.04 0.10 -0.18 0.03 0.02 0.00 0.00 177.57 177.49 3mkv h ARG 244 N 0.52 0.08 -0.00 1.57 3.08 -1.11 -1.97 114.38 116.56 3mkv h ARG 244 Ca 0.23 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.27 3mkv h ARG 244 Cb 0.14 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3mkv h ARG 244 CO -0.16 0.27 -0.01 0.00 -1.07 0.00 0.00 179.97 178.99 3mkv n GLY 246 N 1.17 0.88 3.76 0.00 0.00 -0.66 -4.39 105.19 105.94 3mkv n GLY 246 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3mkv n GLY 246 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3mkv n VAL 247 N -1.38 1.82 0.00 1.61 0.31 -0.70 -4.83 118.33 115.16 3mkv n VAL 247 Ca 0.00 -0.45 -0.21 0.00 -0.01 0.00 0.00 64.34 63.66 3mkv n VAL 247 Cb 0.00 -1.92 -0.14 0.00 -0.91 0.00 0.00 33.84 30.87 3mkv n VAL 247 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3mkv n ARG 248 N 0.76 0.76 -4.45 5.55 0.63 -0.57 -4.63 116.66 114.70 3mkv n ARG 248 Ca 0.03 0.26 -0.20 0.00 -0.92 0.00 0.00 57.85 57.02 3mkv n ARG 248 Cb 0.38 -1.71 -0.14 0.00 0.45 0.00 0.00 32.46 31.44 3mkv n ARG 248 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3mkv s THR 249 N -2.56 0.99 -0.16 5.15 -4.23 -1.17 -1.45 115.64 112.22 3mkv s THR 249 Ca -0.23 -0.70 -0.06 0.00 -1.18 0.00 0.00 61.69 59.53 3mkv s THR 249 Cb 0.07 -0.86 -0.04 0.00 1.34 0.00 0.00 72.50 73.01 3mkv s THR 249 CO 0.76 0.15 0.03 -0.63 -0.54 0.00 0.00 174.62 174.39 3mkv s ILE 250 N -0.52 4.47 -0.08 2.99 -1.09 0.23 -1.17 121.20 126.04 3mkv s ILE 250 Ca 0.03 -0.15 -0.11 0.00 -2.23 0.00 0.00 60.65 58.18 3mkv s ILE 250 Cb -0.06 -2.98 -0.05 0.00 -1.58 0.00 0.00 42.46 37.79 3mkv s ILE 250 CO 0.00 0.50 0.27 -1.61 -1.23 0.00 0.00 174.94 172.87 3mkv s GLU 251 N 0.15 3.78 1.06 2.79 0.41 0.79 -0.71 118.70 126.97 3mkv s GLU 251 Ca 0.03 0.12 0.00 0.00 -0.41 0.00 0.00 54.97 54.71 3mkv s GLU 251 Cb -0.13 -3.25 0.00 0.00 -1.78 0.00 0.00 34.13 28.98 3mkv s GLU 251 CO 0.01 0.65 0.00 0.72 -0.49 0.00 0.00 175.26 176.15 3mkv n HIS 252 N 2.20 0.00 -2.28 1.61 8.25 -0.33 -2.58 115.22 122.09 3mkv n HIS 252 Ca -0.16 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.14 3mkv n HIS 252 Cb 0.53 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.63 3mkv n HIS 252 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3mkv n GLY 253 N 0.00 -0.23 0.31 -1.41 0.00 -0.58 -4.20 105.19 99.09 3mkv n GLY 253 Ca 0.00 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 45.93 3mkv n GLY 253 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3mkv h ASN 254 N 0.00 0.03 -0.57 1.61 4.21 -1.79 -1.77 115.58 117.30 3mkv h ASN 254 Ca -0.38 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.00 3mkv h ASN 254 Cb 1.27 -0.01 -0.08 0.00 -1.12 0.00 0.00 38.32 38.39 3mkv h ASN 254 CO 0.45 0.02 0.14 0.18 -1.29 0.00 0.00 177.43 176.92 3mkv n LEU 255 N -4.47 5.39 -4.75 1.61 4.77 -0.47 -4.42 117.00 114.66 3mkv n LEU 255 Ca 0.03 -3.19 -0.37 0.00 -0.03 0.00 0.00 56.01 52.44 3mkv n LEU 255 Cb 0.30 -0.68 0.04 0.00 -2.33 0.00 0.00 43.42 40.75 3mkv n LEU 255 CO 0.35 0.79 0.92 -0.51 -1.33 0.00 0.00 177.39 177.61 3mkv s ILE 256 N -2.95 2.32 0.52 -0.08 2.07 -0.67 -3.82 121.20 118.59 3mkv s ILE 256 Ca 0.51 0.22 0.01 0.00 -1.41 0.00 0.00 60.65 59.99 3mkv s ILE 256 Cb 0.41 -3.10 -0.00 0.00 0.13 0.00 0.00 42.46 39.90 3mkv s ILE 256 CO 0.12 -0.02 0.03 1.51 -1.91 0.00 0.00 174.94 174.67 3mkv s ASP 257 N -1.23 4.19 0.13 4.50 1.47 -1.26 -4.86 116.67 119.61 3mkv s ASP 257 Ca 0.74 -1.65 -0.19 0.00 1.18 0.00 0.00 52.55 52.63 3mkv s ASP 257 Cb -0.36 0.60 -0.01 0.00 -0.34 0.00 0.00 42.92 42.81 3mkv s ASP 257 CO 0.41 -0.91 1.73 0.44 0.68 0.00 0.00 175.17 177.52 3mkv h ASP 258 N 1.27 -0.03 -0.54 2.11 3.45 -1.96 0.22 116.42 120.94 3mkv h ASP 258 Ca -0.43 0.04 0.03 0.00 0.43 0.00 0.00 57.03 57.10 3mkv h ASP 258 Cb 1.32 0.06 -0.04 0.00 -0.56 0.00 0.00 39.33 40.12 3mkv h ASP 258 CO 0.72 0.02 0.31 -0.08 -1.57 0.00 0.00 179.24 178.65 3mkv h GLU 259 N 0.11 0.60 -0.22 3.56 4.81 -2.00 -2.29 114.58 119.15 3mkv h GLU 259 Ca 0.11 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 3mkv h GLU 259 Cb 0.12 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 3mkv h GLU 259 CO -0.16 0.40 -0.14 1.15 -0.73 0.00 0.00 179.01 179.53 3mkv h THR 260 N 0.62 1.31 -0.67 0.32 2.02 -1.84 -2.70 112.91 111.97 3mkv h THR 260 Ca 0.22 -1.23 0.18 0.00 0.77 0.00 0.00 66.41 66.35 3mkv h THR 260 Cb 0.05 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 3mkv h THR 260 CO -0.11 0.38 0.47 0.00 0.37 0.00 0.00 175.52 176.63 3mkv h ALA 261 N 0.70 2.50 0.05 6.16 0.00 -0.33 -1.48 119.26 126.85 3mkv h ALA 261 Ca 0.05 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3mkv h ALA 261 Cb 0.65 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.47 3mkv h ALA 261 CO 0.04 -0.68 -0.32 0.00 0.00 0.00 0.00 179.25 178.28 3mkv h ARG 262 N 0.09 0.10 -0.69 0.00 3.08 -1.25 -2.81 114.38 112.91 3mkv h ARG 262 Ca 0.32 -0.17 0.13 0.00 0.07 0.00 0.00 59.98 60.33 3mkv h ARG 262 Cb 1.14 0.06 -0.13 0.00 0.08 0.00 0.00 29.97 31.13 3mkv h ARG 262 CO -0.03 1.08 -0.23 1.25 -1.07 0.00 0.00 179.97 180.98 3mkv h LEU 263 N -0.78 -0.82 -0.54 3.04 5.85 -1.13 0.26 115.31 121.18 3mkv h LEU 263 Ca -0.06 0.22 0.10 0.00 0.84 0.00 0.00 57.88 58.98 3mkv h LEU 263 Cb 1.23 0.49 -0.08 0.00 0.37 0.00 0.00 40.66 42.67 3mkv h LEU 263 CO 0.04 -0.26 0.10 0.58 -0.34 0.00 0.00 178.44 178.56 3mkv h VAL 264 N -0.04 0.67 -0.21 1.05 2.07 -1.30 -0.03 116.25 118.46 3mkv h VAL 264 Ca 0.32 -0.08 -0.17 0.00 0.82 0.00 0.00 66.70 67.59 3mkv h VAL 264 Cb 0.54 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3mkv h VAL 264 CO -0.73 0.04 -0.55 0.00 0.02 0.00 0.00 177.57 176.35 3mkv h ALA 265 N 1.44 0.64 -0.38 1.67 0.00 -0.95 -1.92 119.26 119.75 3mkv h ALA 265 Ca 0.28 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3mkv h ALA 265 Cb 0.40 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3mkv h ALA 265 CO -0.37 0.69 0.05 0.93 0.00 0.00 0.00 179.25 180.55 3mkv h GLU 266 N 0.48 0.57 0.00 0.00 5.08 0.12 -2.82 114.58 118.02 3mkv h GLU 266 Ca 0.01 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3mkv h GLU 266 Cb 1.11 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.27 3mkv h GLU 266 CO 0.11 0.56 -0.41 0.72 -1.00 0.00 0.00 179.01 178.99 3mkv n HIS 267 N -4.30 0.19 -0.74 4.33 8.25 -0.09 -4.94 115.22 117.93 3mkv n HIS 267 Ca 0.02 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 3mkv n HIS 267 Cb 0.22 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 30.89 3mkv n HIS 267 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3mkv n GLY 268 N 1.45 0.70 3.77 -1.41 0.00 -0.85 -5.04 105.19 103.80 3mkv n GLY 268 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3mkv n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mkv s ALA 269 N -2.41 2.45 0.18 4.61 0.00 -0.78 -5.02 121.76 120.78 3mkv s ALA 269 Ca 0.00 0.47 0.06 0.00 0.00 0.00 0.00 51.96 52.49 3mkv s ALA 269 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 3mkv s ALA 269 CO 0.00 -1.35 0.11 0.71 0.00 0.00 0.00 175.76 175.24 3mkv s TYR 270 N -2.47 3.06 -0.06 0.00 2.02 -0.53 -4.47 117.35 114.90 3mkv s TYR 270 Ca 0.65 -0.06 0.06 0.00 -0.37 0.00 0.00 57.07 57.35 3mkv s TYR 270 Cb -0.19 -1.45 -0.01 0.00 -0.40 0.00 0.00 41.96 39.90 3mkv s TYR 270 CO 0.44 0.52 -0.24 0.08 -1.57 0.00 0.00 175.55 174.79 3mkv s VAL 271 N -1.83 1.98 -0.58 0.71 1.01 -0.87 -0.60 120.40 120.22 3mkv s VAL 271 Ca 0.31 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3mkv s VAL 271 Cb -0.09 -1.67 0.15 0.00 0.00 0.00 0.00 36.38 34.76 3mkv s VAL 271 CO 0.22 0.55 0.36 -0.69 0.00 0.00 0.00 175.10 175.54 3mkv s VAL 272 N -0.14 3.21 0.53 2.92 1.01 0.11 -1.30 120.40 126.74 3mkv s VAL 272 Ca -0.03 -3.12 -0.22 0.00 0.00 0.00 0.00 61.98 58.61 3mkv s VAL 272 Cb -0.13 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 3mkv s VAL 272 CO 0.03 -0.84 1.30 -2.16 0.00 0.00 0.00 175.10 173.43 3mkv s PRO 273 N -0.16 3.25 -0.43 2.72 0.04 -1.26 -1.19 135.00 137.97 3mkv s PRO 273 Ca 0.17 2.08 0.08 0.00 0.04 0.00 0.00 61.00 63.38 3mkv s PRO 273 Cb -0.23 -2.25 0.28 0.00 0.04 0.00 0.00 34.50 32.34 3mkv s PRO 273 CO -0.02 -1.05 0.62 0.25 0.04 0.00 0.00 177.00 176.83 3mkv n THR 274 N -0.98 0.01 -0.08 1.26 -2.24 -1.26 -3.45 114.28 107.55 3mkv n THR 274 Ca 0.10 -4.37 -0.14 0.00 -2.27 0.00 0.00 64.05 57.36 3mkv n THR 274 Cb 0.46 -1.60 -0.05 0.00 -2.10 0.00 0.00 70.33 67.05 3mkv n THR 274 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3mkv h LEU 275 N 3.76 0.85 -0.55 3.22 3.38 -1.82 -3.24 115.31 120.91 3mkv h LEU 275 Ca 0.10 -0.53 0.11 0.00 0.09 0.00 0.00 57.88 57.65 3mkv h LEU 275 Cb 0.85 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.26 3mkv h LEU 275 CO 0.54 1.21 -0.10 -0.37 0.09 0.00 0.00 178.44 179.81 3mkv h VAL 276 N 0.51 0.47 -0.93 1.22 -1.51 -1.89 -2.38 116.25 111.75 3mkv h VAL 276 Ca 0.02 -0.01 0.20 0.00 -1.23 0.00 0.00 66.70 65.68 3mkv h VAL 276 Cb 1.05 0.44 -0.11 0.00 -2.13 0.00 0.00 31.29 30.54 3mkv h VAL 276 CO 0.10 0.01 0.48 0.00 -1.23 0.00 0.00 177.57 176.93 3mkv h THR 277 N 0.03 0.58 -0.12 7.19 1.03 -1.59 -0.72 112.91 119.32 3mkv h THR 277 Ca 0.27 -0.19 -0.04 0.00 -0.01 0.00 0.00 66.41 66.45 3mkv h THR 277 Cb 0.42 -0.02 -0.00 0.00 -1.07 0.00 0.00 68.15 67.48 3mkv h THR 277 CO -0.54 0.10 -0.07 1.88 -0.01 0.00 0.00 175.52 176.88 3mkv h TYR 278 N 0.55 0.30 -0.77 0.00 0.05 -1.60 0.39 116.97 115.89 3mkv h TYR 278 Ca 0.56 -0.08 0.14 0.00 0.05 0.00 0.00 58.73 59.40 3mkv h TYR 278 Cb 0.98 -0.07 -0.14 0.00 1.01 0.00 0.00 36.73 38.51 3mkv h TYR 278 CO -0.07 0.61 -0.28 -0.44 -1.05 0.00 0.00 178.16 176.93 3mkv h ASP 279 N -0.10 -1.02 -0.33 3.88 3.45 -1.32 -1.89 116.42 119.08 3mkv h ASP 279 Ca 0.03 0.25 -0.08 0.00 0.43 0.00 0.00 57.03 57.66 3mkv h ASP 279 Cb 0.54 0.58 -0.01 0.00 -0.56 0.00 0.00 39.33 39.88 3mkv h ASP 279 CO 0.02 -0.28 -0.11 0.00 -1.57 0.00 0.00 179.24 177.30 3mkv h ALA 280 N 1.45 0.46 -0.20 3.45 0.00 -0.39 -0.07 119.26 123.97 3mkv h ALA 280 Ca 0.33 -0.31 0.06 0.00 0.00 0.00 0.00 54.91 54.98 3mkv h ALA 280 Cb 0.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3mkv h ALA 280 CO -0.81 0.33 0.14 -0.07 0.00 0.00 0.00 179.25 178.84 3mkv h LEU 281 N 0.44 0.00 0.07 0.00 3.38 0.05 -1.54 115.31 117.71 3mkv h LEU 281 Ca 0.08 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.78 3mkv h LEU 281 Cb 0.62 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3mkv h LEU 281 CO 0.04 0.00 -1.35 0.00 0.09 0.00 0.00 178.44 177.22 3mkv h ALA 282 N 1.90 0.34 -0.02 1.53 0.00 -0.78 -2.05 119.26 120.18 3mkv h ALA 282 Ca 0.09 -1.07 -0.02 0.00 0.00 0.00 0.00 54.91 53.92 3mkv h ALA 282 Cb 0.38 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3mkv h ALA 282 CO -0.00 1.22 -0.06 0.77 0.00 0.00 0.00 179.25 181.18 3mkv h SER 283 N 0.04 0.09 0.00 0.00 0.02 -0.32 -3.41 113.55 109.97 3mkv h SER 283 Ca -0.16 -0.61 -0.08 0.00 -0.84 0.00 0.00 61.79 60.10 3mkv h SER 283 Cb 1.93 -0.03 -0.17 0.00 0.14 0.00 0.00 62.40 64.27 3mkv h SER 283 CO 0.15 0.68 -0.73 -1.84 -1.14 0.00 0.00 176.83 173.95 3mkv n GLU 284 N -4.72 0.06 0.21 3.45 0.28 -0.65 -4.85 120.64 114.42 3mkv n GLU 284 Ca -0.09 -1.53 -0.10 0.00 -0.16 0.00 0.00 57.16 55.28 3mkv n GLU 284 Cb 0.34 -0.32 -0.05 0.00 1.43 0.00 0.00 31.44 32.84 3mkv n GLU 284 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 3mkv h GLY 285 N 0.47 -0.63 0.31 -1.84 0.00 -1.41 -2.76 103.07 97.19 3mkv h GLY 285 Ca -0.10 0.23 0.06 0.00 0.00 0.00 0.00 47.33 47.52 3mkv h GLY 285 CO 0.04 -0.23 -0.13 -2.09 0.00 0.00 0.00 176.54 174.13 3mkv h GLU 286 N -1.12 -0.08 -0.19 4.80 4.57 -1.81 -1.59 114.58 119.16 3mkv h GLU 286 Ca -0.06 0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.18 3mkv h GLU 286 Cb 0.51 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.11 3mkv h GLU 286 CO 0.10 -0.06 0.18 -0.22 -1.18 0.00 0.00 179.01 177.84 3mkv h LYS 287 N -0.09 0.00 -0.60 1.92 3.64 -1.89 -2.56 116.57 116.99 3mkv h LYS 287 Ca 0.15 0.00 -0.40 0.00 -1.27 0.00 0.00 60.65 59.13 3mkv h LYS 287 Cb 0.31 0.00 -0.26 0.00 -0.41 0.00 0.00 32.23 31.87 3mkv h LYS 287 CO -0.34 0.00 -0.22 0.66 -2.27 0.00 0.00 179.45 177.28 3mkv n TYR 288 N -3.95 2.03 -2.30 1.91 4.01 -0.94 -4.96 117.16 112.96 3mkv n TYR 288 Ca 0.02 -2.09 -0.12 0.00 -0.16 0.00 0.00 57.90 55.55 3mkv n TYR 288 Cb 0.31 -0.59 -0.00 0.00 -0.31 0.00 0.00 39.34 38.75 3mkv n TYR 288 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mkv n GLY 289 N -0.93 -0.10 3.70 2.72 0.00 -0.97 -4.39 105.19 105.22 3mkv n GLY 289 Ca 0.42 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3mkv n GLY 289 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3mkv s LEU 290 N -3.52 4.30 0.29 0.99 2.96 -0.64 -4.13 118.68 118.92 3mkv s LEU 290 Ca 0.03 1.65 -0.29 0.00 -0.22 0.00 0.00 54.13 55.30 3mkv s LEU 290 Cb -0.01 -3.56 -0.13 0.00 0.50 0.00 0.00 46.19 42.98 3mkv s LEU 290 CO 0.04 -0.41 1.30 -2.65 -1.32 0.00 0.00 176.35 173.30 3mkv n PRO 291 N 4.62 1.98 0.00 0.98 -0.02 -1.26 -4.58 135.00 136.72 3mkv n PRO 291 Ca 0.08 0.70 0.04 0.00 -2.02 0.00 0.00 63.50 62.30 3mkv n PRO 291 Cb 0.49 -2.28 0.19 0.00 -0.02 0.00 0.00 33.50 31.88 3mkv n PRO 291 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3mkv n PRO 292 N 1.17 0.01 -0.04 0.52 -0.04 -1.26 -1.30 135.00 134.05 3mkv n PRO 292 Ca 0.08 0.34 -0.15 0.00 -0.04 0.00 0.00 63.50 63.73 3mkv n PRO 292 Cb 0.34 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.22 3mkv n PRO 292 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3mkv h GLU 293 N 0.00 0.49 -0.16 0.54 4.39 -1.92 -3.10 114.58 114.82 3mkv h GLU 293 Ca 0.00 -0.35 -0.18 0.00 0.34 0.00 0.00 59.36 59.16 3mkv h GLU 293 Cb 0.15 0.06 0.01 0.00 -0.10 0.00 0.00 28.75 28.86 3mkv h GLU 293 CO 0.00 0.97 -0.61 0.77 -1.16 0.00 0.00 179.01 178.99 3mkv h SER 294 N 0.10 0.82 -0.83 1.42 0.02 -1.36 -3.14 113.55 110.58 3mkv h SER 294 Ca -0.01 -0.61 0.12 0.00 -0.84 0.00 0.00 61.79 60.45 3mkv h SER 294 Cb 1.00 -0.24 -0.08 0.00 0.14 0.00 0.00 62.40 63.22 3mkv h SER 294 CO 0.08 1.29 0.45 0.40 -1.14 0.00 0.00 176.83 177.91 3mkv h ILE 295 N 0.40 0.83 -0.61 3.27 2.04 -1.56 0.31 117.51 122.19 3mkv h ILE 295 Ca -0.03 -0.24 0.12 0.00 1.00 0.00 0.00 64.86 65.71 3mkv h ILE 295 Cb 1.24 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 3mkv h ILE 295 CO 0.13 0.13 0.41 0.00 0.00 0.00 0.00 178.15 178.82 3mkv h ALA 296 N 1.50 2.17 -0.01 1.87 0.00 -1.49 -2.42 119.26 120.87 3mkv h ALA 296 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3mkv h ALA 296 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3mkv h ALA 296 CO -0.30 -0.32 -0.07 1.63 0.00 0.00 0.00 179.25 180.20 3mkv n LYS 297 N -4.45 1.18 -0.03 0.00 5.02 0.09 -4.19 118.16 115.78 3mkv n LYS 297 Ca 0.11 -0.54 -0.17 0.00 -2.02 0.00 0.00 58.31 55.69 3mkv n LYS 297 Cb 0.47 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 33.91 3mkv n LYS 297 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3mkv h ILE 298 N 1.31 1.31 -0.43 -0.18 2.04 -1.33 -3.32 117.51 116.91 3mkv h ILE 298 Ca 0.00 -1.88 -0.04 0.00 1.00 0.00 0.00 64.86 63.94 3mkv h ILE 298 Cb 0.37 2.03 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 3mkv h ILE 298 CO 0.00 0.59 0.10 0.00 0.00 0.00 0.00 178.15 178.83 3mkv h ALA 299 N 0.53 1.37 0.00 1.87 0.00 -1.76 0.32 119.26 121.59 3mkv h ALA 299 Ca -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3mkv h ALA 299 Cb 1.27 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3mkv h ALA 299 CO 0.13 0.45 -0.05 -0.44 0.00 0.00 0.00 179.25 179.35 3mkv h ASP 300 N 0.63 0.00 0.00 0.00 3.32 -1.81 -3.20 116.42 115.36 3mkv h ASP 300 Ca 0.14 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 3mkv h ASP 300 Cb 0.25 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 3mkv h ASP 300 CO -0.00 0.05 -1.11 0.52 -1.72 0.00 0.00 179.24 176.97 3mkv n VAL 301 N -3.40 0.07 -0.12 -1.35 0.31 -0.98 -4.85 118.33 108.02 3mkv n VAL 301 Ca -0.02 -0.06 -0.11 0.00 -0.01 0.00 0.00 64.34 64.14 3mkv n VAL 301 Cb 0.18 -0.25 -0.02 0.00 -0.91 0.00 0.00 33.84 32.84 3mkv n VAL 301 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 3mkv h HIS 302 N 0.00 0.63 -0.40 3.52 6.17 -0.37 -3.31 115.15 121.39 3mkv h HIS 302 Ca -0.03 -0.10 0.07 0.00 0.71 0.00 0.00 60.37 61.02 3mkv h HIS 302 Cb 0.61 -0.17 -0.06 0.00 2.52 0.00 0.00 27.41 30.31 3mkv h HIS 302 CO 0.00 0.69 0.05 0.78 0.71 0.00 0.00 177.93 180.16 3mkv h GLY 303 N 0.40 0.44 2.00 5.26 0.00 -1.83 -3.00 103.07 106.33 3mkv h GLY 303 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3mkv h GLY 303 CO 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 176.54 176.50 3mkv n ALA 304 N -2.48 1.67 -0.37 3.60 0.00 -1.25 -4.23 120.51 117.46 3mkv n ALA 304 Ca 0.03 0.06 -0.06 0.00 0.00 0.00 0.00 53.44 53.46 3mkv n ALA 304 Cb 0.19 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 3mkv n ALA 304 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3mkv h GLY 305 N 2.34 -0.40 1.01 0.00 0.00 -1.65 -2.08 103.07 102.28 3mkv h GLY 305 Ca 0.00 0.65 -0.12 0.00 0.00 0.00 0.00 47.33 47.86 3mkv h GLY 305 CO 0.00 -0.09 -0.28 1.41 0.00 0.00 0.00 176.54 177.58 3mkv h LEU 306 N -0.04 0.81 -1.04 3.11 3.38 -1.84 -3.14 115.31 116.56 3mkv h LEU 306 Ca 0.24 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.67 3mkv h LEU 306 Cb 0.51 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3mkv h LEU 306 CO -0.92 1.10 -0.43 -0.74 0.09 0.00 0.00 178.44 177.53 3mkv h HIS 307 N 0.54 0.00 -0.30 1.13 2.76 -1.76 -2.55 115.15 114.97 3mkv h HIS 307 Ca 0.06 0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.30 3mkv h HIS 307 Cb 0.85 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.79 3mkv h HIS 307 CO 0.07 0.43 0.21 0.66 -1.30 0.00 0.00 177.93 178.00 3mkv h SER 308 N 0.00 0.08 -0.48 3.26 4.64 -1.33 -0.18 113.55 119.53 3mkv h SER 308 Ca -0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.18 3mkv h SER 308 Cb 0.86 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 3mkv h SER 308 CO 0.06 0.05 -0.22 0.40 -0.87 0.00 0.00 176.83 176.25 3mkv h ILE 309 N 0.09 1.27 -0.25 0.95 1.08 -1.53 -1.12 117.51 118.01 3mkv h ILE 309 Ca 0.14 -1.39 -0.05 0.00 -0.39 0.00 0.00 64.86 63.17 3mkv h ILE 309 Cb 0.44 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 35.30 3mkv h ILE 309 CO -0.01 0.48 -0.06 -0.33 -0.69 0.00 0.00 178.15 177.53 3mkv h GLU 310 N 0.86 0.48 -0.38 2.37 5.08 -1.14 0.87 114.58 122.72 3mkv h GLU 310 Ca 0.11 -0.18 0.07 0.00 -1.00 0.00 0.00 59.36 58.36 3mkv h GLU 310 Cb 0.80 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.95 3mkv h GLU 310 CO 0.07 0.70 -0.08 0.82 -1.00 0.00 0.00 179.01 179.52 3mkv h ILE 311 N 0.22 0.64 -0.31 3.13 2.04 -1.12 0.76 117.51 122.87 3mkv h ILE 311 Ca 0.06 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 3mkv h ILE 311 Cb 0.53 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 3mkv h ILE 311 CO 0.02 0.00 0.03 0.24 0.00 0.00 0.00 178.15 178.45 3mkv h MET 312 N 0.02 0.52 -0.84 2.37 2.86 -0.81 -1.93 114.93 117.12 3mkv h MET 312 Ca 0.18 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 3mkv h MET 312 Cb 0.27 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.84 3mkv h MET 312 CO -0.37 0.63 0.43 -0.22 1.06 0.00 0.00 176.91 178.44 3mkv h LYS 313 N 0.34 1.19 -1.00 1.72 3.64 -0.66 -0.36 116.57 121.43 3mkv h LYS 313 Ca 0.09 -0.16 0.10 0.00 -1.27 0.00 0.00 60.65 59.41 3mkv h LYS 313 Cb 0.38 -0.22 -0.08 0.00 -0.41 0.00 0.00 32.23 31.89 3mkv h LYS 313 CO 0.01 0.89 0.64 -0.09 -2.27 0.00 0.00 179.45 178.63 3mkv h ARG 314 N 1.18 1.03 0.00 1.90 2.43 -0.43 -1.50 114.38 119.00 3mkv h ARG 314 Ca 0.29 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3mkv h ARG 314 Cb 0.07 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 3mkv h ARG 314 CO -0.04 0.68 -0.29 0.00 -1.51 0.00 0.00 179.97 178.81 3mkv n ALA 315 N -2.35 2.90 -0.83 2.80 0.00 -0.76 -4.92 120.51 117.35 3mkv n ALA 315 Ca 0.17 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3mkv n ALA 315 Cb 0.29 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.45 3mkv n ALA 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mkv n GLY 316 N 1.46 0.53 3.69 0.00 0.00 -0.23 -4.87 105.19 105.76 3mkv n GLY 316 Ca 0.06 -0.54 -0.44 0.00 0.00 0.00 0.00 46.02 45.10 3mkv n GLY 316 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3mkv n VAL 317 N -2.83 0.05 -2.33 1.61 0.31 -0.67 -4.93 118.33 109.55 3mkv n VAL 317 Ca 0.00 -0.01 -0.43 0.00 -0.01 0.00 0.00 64.34 63.89 3mkv n VAL 317 Cb 0.00 -1.79 -0.02 0.00 -0.91 0.00 0.00 33.84 31.11 3mkv n VAL 317 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3mkv s LYS 318 N 1.30 3.53 -0.18 5.55 1.02 -1.26 -4.70 119.74 125.00 3mkv s LYS 318 Ca 0.78 0.92 -0.09 0.00 0.02 0.00 0.00 55.97 57.61 3mkv s LYS 318 Cb -0.59 -4.05 -0.05 0.00 -0.52 0.00 0.00 37.83 32.63 3mkv s LYS 318 CO 0.36 -1.63 0.12 -1.64 -0.92 0.00 0.00 175.35 171.63 3mkv s MET 319 N 5.05 3.98 0.47 1.68 -1.94 -1.26 -2.05 119.30 125.24 3mkv s MET 319 Ca 0.62 -0.23 0.09 0.00 -1.71 0.00 0.00 55.69 54.45 3mkv s MET 319 Cb -0.14 -3.32 0.03 0.00 2.01 0.00 0.00 34.83 33.41 3mkv s MET 319 CO 0.32 0.39 0.63 0.20 -0.01 0.00 0.00 175.02 176.56 3mkv s GLY 320 N 0.07 1.89 -0.03 -0.03 0.00 -0.42 -4.55 107.32 104.26 3mkv s GLY 320 Ca 0.08 -1.83 -0.14 0.00 0.00 0.00 0.00 44.72 42.84 3mkv s GLY 320 CO -0.00 -1.57 0.37 -0.12 0.00 0.00 0.00 173.10 171.77 3mkv s PHE 321 N -2.46 3.69 0.11 1.90 5.36 -0.57 -4.16 117.98 121.84 3mkv s PHE 321 Ca 0.57 0.90 -0.25 0.00 -0.96 0.00 0.00 56.93 57.19 3mkv s PHE 321 Cb -0.08 -2.25 0.08 0.00 -0.34 0.00 0.00 43.02 40.42 3mkv s PHE 321 CO 0.35 0.62 0.77 0.20 -1.46 0.00 0.00 175.22 175.69 3mkv s GLY 322 N -0.92 -0.45 0.00 13.12 0.00 -1.22 -0.39 107.32 117.46 3mkv s GLY 322 Ca 0.22 0.54 0.00 0.00 0.00 0.00 0.00 44.72 45.48 3mkv s GLY 322 CO 0.11 0.17 0.00 -1.30 0.00 0.00 0.00 173.10 172.09 3mkv n THR 323 N -0.35 0.00 -3.30 0.90 -2.24 -1.16 -4.23 114.28 103.89 3mkv n THR 323 Ca -0.11 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.50 3mkv n THR 323 Cb 0.63 -0.73 0.06 0.00 -2.10 0.00 0.00 70.33 68.19 3mkv n THR 323 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3mkv n ASP 324 N -2.52 -4.91 -4.82 3.42 2.03 0.06 -3.50 116.55 106.31 3mkv n ASP 324 Ca 0.00 -0.42 -0.36 0.00 0.52 0.00 0.00 54.79 54.53 3mkv n ASP 324 Cb 0.18 -3.94 -0.06 0.00 -0.72 0.00 0.00 41.12 36.58 3mkv n ASP 324 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3mkv s LEU 325 N -5.72 4.35 0.06 -2.67 1.43 -1.26 -4.74 118.68 110.13 3mkv s LEU 325 Ca 0.39 1.33 0.06 0.00 -1.03 0.00 0.00 54.13 54.87 3mkv s LEU 325 Cb -0.17 -3.47 -0.04 0.00 0.03 0.00 0.00 46.19 42.54 3mkv s LEU 325 CO 0.55 0.06 -0.10 -0.76 0.23 0.00 0.00 176.35 176.33 3mkv s LEU 326 N -1.92 3.01 0.00 1.79 1.43 -1.26 -4.65 118.68 117.08 3mkv s LEU 326 Ca 0.41 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 3mkv s LEU 326 Cb -0.16 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 44.28 3mkv s LEU 326 CO 0.20 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.62 3mkv n GLY 327 N 1.16 2.02 0.41 -3.19 0.00 -0.84 -2.02 105.19 102.73 3mkv n GLY 327 Ca -0.15 -0.43 0.23 0.00 0.00 0.00 0.00 46.02 45.68 3mkv n GLY 327 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3mkv h GLU 328 N 0.00 0.00 0.00 1.61 9.09 -1.91 0.10 114.58 123.48 3mkv h GLU 328 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3mkv h GLU 328 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3mkv h GLU 328 CO 0.00 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.06 3mkv n ALA 329 N -2.59 1.32 0.03 1.06 0.00 -0.85 -2.73 120.51 116.74 3mkv n ALA 329 Ca 0.12 0.08 0.22 0.00 0.00 0.00 0.00 53.44 53.86 3mkv n ALA 329 Cb 0.73 -1.25 0.73 0.00 0.00 0.00 0.00 19.45 19.66 3mkv n ALA 329 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3mkv h GLN 330 N 0.00 0.00 0.00 0.00 1.08 -0.82 -1.38 115.11 113.99 3mkv h GLN 330 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3mkv h GLN 330 Cb 0.15 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 3mkv h GLN 330 CO 0.00 0.00 0.00 0.07 -0.95 0.00 0.00 178.83 177.95 3mkv h ARG 331 N 0.00 0.00 -0.42 1.46 0.11 -1.76 -3.09 114.38 110.68 3mkv h ARG 331 Ca 0.24 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.32 3mkv h ARG 331 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 3mkv h ARG 331 CO -0.00 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.35 3mkv n LEU 332 N -2.51 2.04 -0.22 0.08 4.77 -0.52 -4.59 117.00 116.05 3mkv n LEU 332 Ca -0.00 -1.02 0.01 0.00 -0.03 0.00 0.00 56.01 54.96 3mkv n LEU 332 Cb 0.15 -0.29 0.09 0.00 -2.33 0.00 0.00 43.42 41.05 3mkv n LEU 332 CO 0.18 0.45 0.79 -0.61 -1.33 0.00 0.00 177.39 176.86 3mkv h GLN 333 N 1.95 0.06 0.00 3.23 4.15 -1.77 -0.96 115.11 121.78 3mkv h GLN 333 Ca 0.00 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 3mkv h GLN 333 Cb 0.58 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.25 3mkv h GLN 333 CO 0.04 0.04 -0.00 0.77 -1.93 0.00 0.00 178.83 177.74 3mkv h SER 334 N 0.06 0.00 -0.58 -0.69 0.02 -1.82 -2.96 113.55 107.57 3mkv h SER 334 Ca 0.33 0.00 0.13 0.00 -0.84 0.00 0.00 61.79 61.41 3mkv h SER 334 Cb 0.53 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 3mkv h SER 334 CO -0.60 0.00 0.40 0.44 -1.14 0.00 0.00 176.83 175.94 3mkv h ASP 335 N 0.00 0.19 -0.97 3.07 3.32 -1.52 -1.60 116.42 118.90 3mkv h ASP 335 Ca -0.00 0.01 0.17 0.00 0.02 0.00 0.00 57.03 57.23 3mkv h ASP 335 Cb 0.44 -0.03 -0.09 0.00 0.22 0.00 0.00 39.33 39.87 3mkv h ASP 335 CO 0.00 0.10 0.61 -0.08 -1.72 0.00 0.00 179.24 178.15 3mkv h GLU 336 N 0.20 0.71 -0.47 3.56 4.57 -1.68 0.18 114.58 121.66 3mkv h GLU 336 Ca 0.28 -0.04 0.07 0.00 -1.18 0.00 0.00 59.36 58.48 3mkv h GLU 336 Cb 0.82 -0.16 -0.06 0.00 -0.16 0.00 0.00 28.75 29.20 3mkv h GLU 336 CO -0.05 0.47 0.14 0.74 -1.18 0.00 0.00 179.01 179.13 3mkv h PHE 337 N 0.73 0.25 0.55 0.92 0.04 -1.53 -1.44 116.94 116.46 3mkv h PHE 337 Ca 0.52 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 61.29 3mkv h PHE 337 Cb 0.84 -0.04 0.01 0.00 2.20 0.00 0.00 35.95 38.95 3mkv h PHE 337 CO -0.00 0.07 -0.27 -0.09 -0.60 0.00 0.00 178.31 177.42 3mkv h ARG 338 N 0.30 -0.72 -0.93 1.51 2.43 -0.83 -2.09 114.38 114.05 3mkv h ARG 338 Ca 0.22 0.05 0.35 0.00 -0.81 0.00 0.00 59.98 59.79 3mkv h ARG 338 Cb 0.25 0.16 -0.17 0.00 -0.42 0.00 0.00 29.97 29.79 3mkv h ARG 338 CO -0.25 -0.48 0.36 -0.89 -1.51 0.00 0.00 179.97 177.20 3mkv n ILE 339 N -4.40 -0.39 0.09 1.20 5.41 -0.27 0.32 119.36 121.31 3mkv n ILE 339 Ca -0.09 1.94 -0.06 0.00 1.00 0.00 0.00 62.75 65.54 3mkv n ILE 339 Cb 0.29 -3.06 0.07 0.00 -0.71 0.00 0.00 39.64 36.23 3mkv n ILE 339 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3mkv h LEU 340 N 0.00 0.26 0.00 1.39 3.38 -1.05 -3.03 115.31 116.25 3mkv h LEU 340 Ca 0.73 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.52 3mkv h LEU 340 Cb 1.82 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.49 3mkv h LEU 340 CO -0.77 0.89 0.00 0.00 0.09 0.00 0.00 178.44 178.65 3mkv n ALA 341 N -2.46 1.86 0.60 1.53 0.00 0.15 -0.30 120.51 121.89 3mkv n ALA 341 Ca -0.03 -0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.46 3mkv n ALA 341 Cb 0.70 -1.26 0.45 0.00 0.00 0.00 0.00 19.45 19.34 3mkv n ALA 341 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3mkv n GLU 342 N -1.31 0.21 0.00 0.00 1.02 -1.14 -4.23 120.64 115.19 3mkv n GLU 342 Ca 0.07 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 3mkv n GLU 342 Cb 0.13 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.77 3mkv n GLU 342 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3mkv n VAL 343 N -2.15 0.00 -3.97 2.62 0.31 -0.52 -5.09 118.33 109.54 3mkv n VAL 343 Ca 0.05 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.10 3mkv n VAL 343 Cb 0.36 -0.25 -0.04 0.00 -0.91 0.00 0.00 33.84 33.00 3mkv n VAL 343 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3mkv s LEU 344 N -3.71 4.22 0.41 7.52 1.43 0.59 -5.05 118.68 124.09 3mkv s LEU 344 Ca 0.00 0.13 -0.24 0.00 -1.03 0.00 0.00 54.13 52.98 3mkv s LEU 344 Cb 0.00 -2.81 -0.08 0.00 0.03 0.00 0.00 46.19 43.33 3mkv s LEU 344 CO 0.00 0.08 1.11 -0.94 0.23 0.00 0.00 176.35 176.83 3mkv s SER 345 N -3.03 6.58 0.31 2.29 1.04 -1.26 -4.17 113.70 115.46 3mkv s SER 345 Ca 0.34 2.20 0.01 0.00 0.48 0.00 0.00 55.95 58.97 3mkv s SER 345 Cb -0.11 -2.60 0.73 0.00 0.10 0.00 0.00 66.02 64.14 3mkv s SER 345 CO 0.27 -0.62 1.57 -0.65 0.98 0.00 0.00 173.24 174.79 3mkv h PRO 346 N 2.50 0.00 -0.67 4.02 0.11 -1.87 0.70 132.00 136.80 3mkv h PRO 346 Ca -0.49 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.68 3mkv h PRO 346 Cb 1.23 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 3mkv h PRO 346 CO 0.62 0.00 0.38 0.00 -0.21 0.00 0.00 178.00 178.79 3mkv h ALA 347 N 1.99 0.89 -0.09 -0.75 0.00 -1.82 -0.96 119.26 118.51 3mkv h ALA 347 Ca 0.59 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.53 3mkv h ALA 347 Cb 1.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 3mkv h ALA 347 CO -0.94 0.06 -0.02 0.93 0.00 0.00 0.00 179.25 179.28 3mkv h GLU 348 N 0.70 -0.00 -0.53 0.00 5.08 0.03 -0.59 114.58 119.25 3mkv h GLU 348 Ca 0.29 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.55 3mkv h GLU 348 Cb 0.17 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 3mkv h GLU 348 CO -0.17 -0.00 -0.08 -0.39 -1.00 0.00 0.00 179.01 177.37 3mkv h VAL 349 N -0.00 1.27 -0.70 3.13 -1.51 -0.94 -2.33 116.25 115.16 3mkv h VAL 349 Ca 0.04 -1.22 -0.01 0.00 -1.23 0.00 0.00 66.70 64.28 3mkv h VAL 349 Cb 0.07 0.97 -0.03 0.00 -2.13 0.00 0.00 31.29 30.16 3mkv h VAL 349 CO -0.09 0.43 0.40 0.40 -1.23 0.00 0.00 177.57 177.47 3mkv h ILE 350 N 0.87 1.21 -0.34 7.19 5.03 -1.05 -1.42 117.51 129.00 3mkv h ILE 350 Ca 0.14 -0.50 -0.08 0.00 -0.12 0.00 0.00 64.86 64.31 3mkv h ILE 350 Cb 0.64 0.24 -0.02 0.00 -3.03 0.00 0.00 36.82 34.65 3mkv h ILE 350 CO 0.04 0.23 -0.12 0.00 -0.68 0.00 0.00 178.15 177.62 3mkv h ALA 351 N 1.46 1.16 0.00 1.87 0.00 -0.85 -2.82 119.26 120.08 3mkv h ALA 351 Ca 0.25 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3mkv h ALA 351 Cb 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3mkv h ALA 351 CO -0.04 0.53 -0.32 0.66 0.00 0.00 0.00 179.25 180.08 3mkv h SER 352 N 0.54 0.00 -0.67 0.00 4.64 -0.72 -0.44 113.55 116.89 3mkv h SER 352 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3mkv h SER 352 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3mkv h SER 352 CO 0.03 0.32 0.00 0.00 -0.87 0.00 0.00 176.83 176.31 3mkv n ALA 353 N -2.38 2.98 -1.43 5.18 0.00 -0.91 -1.52 120.51 122.44 3mkv n ALA 353 Ca -0.01 -1.53 0.00 0.00 0.00 0.00 0.00 53.44 51.90 3mkv n ALA 353 Cb 0.40 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.84 3mkv n ALA 353 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3mkv n THR 354 N 1.25 0.00 -0.20 0.00 -2.24 -1.07 -0.58 114.28 111.44 3mkv n THR 354 Ca 0.26 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 62.00 3mkv n THR 354 Cb 0.85 0.00 0.15 0.00 -2.10 0.00 0.00 70.33 69.22 3mkv n THR 354 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 3mkv h ILE 355 N 0.00 1.24 -0.10 2.28 3.07 -1.58 0.77 117.51 123.18 3mkv h ILE 355 Ca 0.00 -0.79 -0.05 0.00 1.55 0.00 0.00 64.86 65.58 3mkv h ILE 355 Cb 0.00 0.49 -0.00 0.00 -0.27 0.00 0.00 36.82 37.04 3mkv h ILE 355 CO 0.00 0.31 -0.11 0.58 -1.05 0.00 0.00 178.15 177.88 3mkv h VAL 356 N 0.95 1.36 -0.77 0.16 2.07 -1.31 -1.76 116.25 116.96 3mkv h VAL 356 Ca 0.22 -1.29 0.02 0.00 0.82 0.00 0.00 66.70 66.47 3mkv h VAL 356 Cb 0.24 1.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 3mkv h VAL 356 CO -0.01 0.37 0.51 0.28 0.02 0.00 0.00 177.57 178.74 3mkv h SER 357 N -0.16 0.85 0.04 0.57 0.02 -1.47 -1.98 113.55 111.42 3mkv h SER 357 Ca 0.01 -0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 3mkv h SER 357 Cb 0.64 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 3mkv h SER 357 CO 0.03 0.59 -0.38 0.00 -1.14 0.00 0.00 176.83 175.94 3mkv h ALA 358 N 1.54 0.98 -0.17 3.77 0.00 -0.69 -2.18 119.26 122.51 3mkv h ALA 358 Ca 0.30 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3mkv h ALA 358 Cb -0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3mkv h ALA 358 CO -0.08 0.61 0.11 1.49 0.00 0.00 0.00 179.25 181.38 3mkv h GLU 359 N 0.38 0.22 -0.86 0.00 4.81 -0.69 -0.27 114.58 118.17 3mkv h GLU 359 Ca 0.04 -0.01 0.20 0.00 -0.13 0.00 0.00 59.36 59.45 3mkv h GLU 359 Cb 0.83 -0.05 -0.12 0.00 0.63 0.00 0.00 28.75 30.05 3mkv h GLU 359 CO 0.07 0.15 0.37 0.28 -0.73 0.00 0.00 179.01 179.15 3mkv h VAL 360 N 0.22 0.53 0.00 0.32 2.07 -0.95 0.07 116.25 118.50 3mkv h VAL 360 Ca 0.06 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3mkv h VAL 360 Cb -0.02 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 3mkv h VAL 360 CO -0.01 0.08 0.00 0.18 0.02 0.00 0.00 177.57 177.83 3mkv n LEU 361 N -5.03 0.00 -2.06 2.57 4.77 -0.86 -4.87 117.00 111.52 3mkv n LEU 361 Ca 0.20 0.36 -0.16 0.00 -0.03 0.00 0.00 56.01 56.39 3mkv n LEU 361 Cb 0.58 -0.36 0.02 0.00 -2.33 0.00 0.00 43.42 41.32 3mkv n LEU 361 CO 0.14 -0.07 -0.06 0.61 -1.33 0.00 0.00 177.39 176.69 3mkv n GLY 362 N 0.88 -0.20 1.01 -0.72 0.00 0.01 -4.91 105.19 101.25 3mkv n GLY 362 Ca 0.10 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 45.96 3mkv n GLY 362 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3mkv n MET 363 N -2.89 1.62 -1.91 1.61 2.00 -0.17 -5.04 117.12 112.35 3mkv n MET 363 Ca -0.11 -3.23 -0.41 0.00 0.00 0.00 0.00 57.70 53.95 3mkv n MET 363 Cb 0.60 -1.46 -0.02 0.00 0.00 0.00 0.00 33.22 32.35 3mkv n MET 363 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 175.97 177.11 3mkv s GLN 364 N -2.80 4.20 0.00 0.03 0.00 -1.23 -1.12 119.66 118.75 3mkv s GLN 364 Ca 0.39 2.43 0.00 0.00 -0.00 0.00 0.00 55.36 58.18 3mkv s GLN 364 Cb 0.38 -3.06 0.00 0.00 0.00 0.00 0.00 33.01 30.33 3mkv s GLN 364 CO -0.07 -0.50 0.00 -0.25 0.00 0.00 0.00 175.29 174.47 3mkv n ASP 365 N 1.95 0.00 -0.05 12.60 10.43 -1.26 -4.70 116.55 135.51 3mkv n ASP 365 Ca 0.06 0.00 -0.05 0.00 2.57 0.00 0.00 54.79 57.37 3mkv n ASP 365 Cb 0.39 -0.42 -0.08 0.00 1.84 0.00 0.00 41.12 42.85 3mkv n ASP 365 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3mkv n LYS 366 N -2.00 2.27 -4.31 -1.24 5.02 -0.72 -3.60 118.16 113.58 3mkv n LYS 366 Ca 0.00 -0.01 -0.16 0.00 -2.02 0.00 0.00 58.31 56.12 3mkv n LYS 366 Cb 0.00 -1.27 -0.10 0.00 -0.02 0.00 0.00 35.03 33.64 3mkv n LYS 366 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3mkv s LEU 367 N -4.77 1.99 0.00 -0.35 1.43 -0.27 -0.29 118.68 116.43 3mkv s LEU 367 Ca -0.05 -1.27 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 3mkv s LEU 367 Cb 0.03 -0.13 0.00 0.00 0.03 0.00 0.00 46.19 46.12 3mkv s LEU 367 CO 0.43 -0.60 0.00 0.61 0.23 0.00 0.00 176.35 177.02 3mkv n GLY 368 N -0.41 0.94 3.35 -3.19 0.00 -1.26 -4.77 105.19 99.85 3mkv n GLY 368 Ca -0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 3mkv n GLY 368 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mkv s ARG 369 N -0.20 0.65 -0.71 1.61 3.52 -1.26 -3.82 118.95 118.74 3mkv s ARG 369 Ca 0.00 0.39 -0.20 0.00 -0.13 0.00 0.00 55.73 55.79 3mkv s ARG 369 Cb 0.00 0.31 0.10 0.00 -1.56 0.00 0.00 34.95 33.80 3mkv s ARG 369 CO 0.00 -0.13 0.91 0.42 -0.81 0.00 0.00 175.30 175.69 3mkv s ILE 370 N -0.34 4.64 0.10 4.11 1.01 -1.26 -4.83 121.20 124.64 3mkv s ILE 370 Ca -0.05 -0.96 -0.13 0.00 0.00 0.00 0.00 60.65 59.51 3mkv s ILE 370 Cb -0.03 -4.63 0.02 0.00 0.01 0.00 0.00 42.46 37.82 3mkv s ILE 370 CO 0.03 -1.34 0.30 0.68 0.00 0.00 0.00 174.94 174.61 3mkv s VAL 371 N 3.10 0.10 -0.25 2.92 -7.23 -1.26 -5.00 120.40 112.78 3mkv s VAL 371 Ca 0.21 -0.84 -0.34 0.00 -1.81 0.00 0.00 61.98 59.21 3mkv s VAL 371 Cb -0.16 -1.22 -0.10 0.00 0.56 0.00 0.00 36.38 35.46 3mkv s VAL 371 CO 0.03 -0.46 2.10 -2.65 -0.31 0.00 0.00 175.10 173.81 3mkv n PRO 372 N -0.09 1.57 0.00 4.82 -0.02 -1.26 -1.39 135.00 138.63 3mkv n PRO 372 Ca -0.16 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 3mkv n PRO 372 Cb 0.63 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3mkv n PRO 372 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mkv n GLY 373 N 5.71 2.57 3.81 -1.23 0.00 -0.28 -5.01 105.19 110.76 3mkv n GLY 373 Ca 0.33 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.03 3mkv n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mkv s ALA 374 N -2.33 2.69 0.45 4.61 0.00 -0.49 -4.76 121.76 121.92 3mkv s ALA 374 Ca 0.00 0.22 -0.24 0.00 0.00 0.00 0.00 51.96 51.93 3mkv s ALA 374 Cb 0.00 -3.20 -0.08 0.00 0.00 0.00 0.00 23.12 19.84 3mkv s ALA 374 CO 0.00 -1.06 1.29 -1.01 0.00 0.00 0.00 175.76 174.97 3mkv s HIS 375 N -2.79 2.72 -1.49 0.00 3.76 0.61 -0.86 115.29 117.22 3mkv s HIS 375 Ca 0.60 1.43 -0.11 0.00 -0.15 0.00 0.00 55.06 56.83 3mkv s HIS 375 Cb -0.15 -3.64 0.01 0.00 1.11 0.00 0.00 32.58 29.92 3mkv s HIS 375 CO 0.47 -2.14 2.49 0.00 -0.85 0.00 0.00 174.74 174.71 3mkv n ALA 376 N -0.25 6.43 -2.75 -1.40 0.00 -0.93 -4.58 120.51 117.03 3mkv n ALA 376 Ca 0.06 -3.82 -0.39 0.00 0.00 0.00 0.00 53.44 49.29 3mkv n ALA 376 Cb 0.45 -3.34 -0.11 0.00 0.00 0.00 0.00 19.45 16.44 3mkv n ALA 376 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3mkv s ASP 377 N 2.27 5.72 0.02 0.00 1.11 -1.26 -2.19 116.67 122.35 3mkv s ASP 377 Ca 0.56 -0.40 -0.06 0.00 0.18 0.00 0.00 52.55 52.83 3mkv s ASP 377 Cb 0.15 -2.05 -0.01 0.00 1.07 0.00 0.00 42.92 42.09 3mkv s ASP 377 CO -0.07 -0.17 0.10 -0.69 1.18 0.00 0.00 175.17 175.52 3mkv s VAL 378 N 1.66 0.11 0.13 -1.27 1.01 0.16 -2.67 120.40 119.52 3mkv s VAL 378 Ca 0.05 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.22 3mkv s VAL 378 Cb -0.17 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 3mkv s VAL 378 CO 0.08 -0.48 -0.14 -0.76 0.00 0.00 0.00 175.10 173.79 3mkv s LEU 379 N -1.68 2.41 -0.13 3.92 1.43 0.12 -0.96 118.68 123.79 3mkv s LEU 379 Ca -0.11 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.19 3mkv s LEU 379 Cb -0.06 -0.57 0.01 0.00 0.03 0.00 0.00 46.19 45.60 3mkv s LEU 379 CO -0.01 -0.14 -0.20 -0.69 0.23 0.00 0.00 176.35 175.55 3mkv s VAL 380 N -2.13 1.88 0.05 -1.59 1.01 0.10 -1.08 120.40 118.63 3mkv s VAL 380 Ca 0.09 -0.87 0.08 0.00 0.00 0.00 0.00 61.98 61.29 3mkv s VAL 380 Cb -0.05 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 3mkv s VAL 380 CO 0.03 0.51 -0.23 -0.69 0.00 0.00 0.00 175.10 174.73 3mkv s VAL 381 N 0.89 2.41 -1.32 2.92 1.01 0.13 -2.74 120.40 123.69 3mkv s VAL 381 Ca -0.06 -1.32 -0.09 0.00 0.00 0.00 0.00 61.98 60.50 3mkv s VAL 381 Cb -0.15 -1.98 0.13 0.00 0.00 0.00 0.00 36.38 34.39 3mkv s VAL 381 CO -0.02 0.34 2.05 -0.67 0.00 0.00 0.00 175.10 176.80 3mkv n ASP 382 N 1.65 5.52 0.00 3.32 2.03 0.15 -1.62 116.55 127.60 3mkv n ASP 382 Ca -0.17 -3.06 0.00 0.00 0.52 0.00 0.00 54.79 52.08 3mkv n ASP 382 Cb 0.52 -1.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.43 3mkv n ASP 382 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3mkv n GLY 383 N 2.83 -1.86 2.88 0.27 0.00 -1.26 -4.90 105.19 103.14 3mkv n GLY 383 Ca 0.46 -1.32 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 3mkv n GLY 383 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3mkv s ASN 384 N -2.20 4.18 0.52 1.61 2.47 -1.26 -4.09 114.94 116.17 3mkv s ASN 384 Ca 0.00 -2.69 0.27 0.00 0.42 0.00 0.00 52.86 50.86 3mkv s ASN 384 Cb 0.00 -1.42 1.38 0.00 -1.45 0.00 0.00 41.25 39.76 3mkv s ASN 384 CO 0.00 -0.28 1.93 -0.65 -3.72 0.00 0.00 177.10 174.38 3mkv h PRO 385 N 6.83 0.07 0.00 0.43 0.11 -1.96 0.31 132.00 137.79 3mkv h PRO 385 Ca -0.06 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3mkv h PRO 385 Cb 0.93 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3mkv h PRO 385 CO 0.59 0.05 0.00 -0.07 -0.21 0.00 0.00 178.00 178.36 3mkv h LEU 386 N 0.07 0.00 0.00 2.35 3.38 -1.93 -2.96 115.31 116.22 3mkv h LEU 386 Ca 0.36 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.07 3mkv h LEU 386 Cb 1.34 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.04 3mkv h LEU 386 CO -0.03 0.00 -2.01 0.29 0.09 0.00 0.00 178.44 176.78 3mkv n LYS 387 N -2.62 0.47 -3.67 1.13 5.02 0.10 -4.40 118.16 114.20 3mkv n LYS 387 Ca -0.01 0.10 -0.09 0.00 -2.02 0.00 0.00 58.31 56.29 3mkv n LYS 387 Cb 0.10 -1.36 -0.10 0.00 -0.02 0.00 0.00 35.03 33.65 3mkv n LYS 387 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3mkv s SER 388 N -5.71 -0.28 0.00 4.39 0.15 -0.80 -4.88 113.70 106.57 3mkv s SER 388 Ca -0.24 0.96 0.08 0.00 0.70 0.00 0.00 55.95 57.45 3mkv s SER 388 Cb 0.06 1.20 0.37 0.00 -1.71 0.00 0.00 66.02 65.93 3mkv s SER 388 CO 0.41 -0.22 1.21 1.33 1.20 0.00 0.00 173.24 177.17 3mkv n VAL 389 N 5.14 1.23 0.02 4.45 0.24 -1.25 -3.95 118.33 124.22 3mkv n VAL 389 Ca -0.12 0.31 0.13 0.00 -2.04 0.00 0.00 64.34 62.62 3mkv n VAL 389 Cb 0.51 -1.17 0.59 0.00 -1.47 0.00 0.00 33.84 32.30 3mkv n VAL 389 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 3mkv h ASP 390 N 0.00 0.17 1.08 -1.34 3.32 -1.95 -1.27 116.42 116.44 3mkv h ASP 390 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3mkv h ASP 390 Cb 0.12 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.63 3mkv h ASP 390 CO 0.00 0.11 0.00 0.00 -1.72 0.00 0.00 179.24 177.63 3mkv n LEU 392 N -3.06 0.00 -4.78 0.00 4.77 -0.48 -4.19 117.00 109.26 3mkv n LEU 392 Ca 0.01 0.48 -0.31 0.00 -0.03 0.00 0.00 56.01 56.16 3mkv n LEU 392 Cb 0.32 -0.48 0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3mkv n LEU 392 CO 0.27 -0.02 0.70 -0.76 -1.33 0.00 0.00 177.39 176.25 3mkv s LEU 393 N -2.97 3.05 0.00 2.23 1.43 -0.81 -4.71 118.68 116.90 3mkv s LEU 393 Ca 0.14 1.78 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 3mkv s LEU 393 Cb 0.18 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.89 3mkv s LEU 393 CO 0.50 -1.91 0.00 0.61 0.23 0.00 0.00 176.35 175.78 3mkv n GLY 394 N -1.37 0.46 1.78 -3.19 0.00 -1.26 -3.98 105.19 97.63 3mkv n GLY 394 Ca 0.09 -0.95 -0.19 0.00 0.00 0.00 0.00 46.02 44.96 3mkv n GLY 394 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3mkv n GLN 395 N 9.38 2.78 -0.78 1.61 1.13 -1.26 -4.64 117.38 125.60 3mkv n GLN 395 Ca 0.00 -3.64 0.00 0.00 -1.94 0.00 0.00 57.00 51.42 3mkv n GLN 395 Cb 0.00 -2.12 0.00 0.00 0.11 0.00 0.00 30.24 28.23 3mkv n GLN 395 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3mkv n GLY 396 N -0.90 0.71 0.35 1.08 0.00 -1.26 -4.64 105.19 100.52 3mkv n GLY 396 Ca 0.44 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.42 3mkv n GLY 396 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3mkv n GLU 397 N -2.51 -0.27 -0.38 1.61 4.71 -1.26 0.82 120.64 123.36 3mkv n GLU 397 Ca 0.00 1.34 0.02 0.00 -0.01 0.00 0.00 57.16 58.51 3mkv n GLU 397 Cb 0.00 -1.99 0.16 0.00 -1.01 0.00 0.00 31.44 28.60 3mkv n GLU 397 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 3mkv n HIS 398 N -5.23 0.88 -3.89 -0.32 8.25 -1.26 -4.35 115.22 109.31 3mkv n HIS 398 Ca 0.06 -0.35 -0.28 0.00 -0.26 0.00 0.00 57.72 56.89 3mkv n HIS 398 Cb 0.31 -0.29 -0.12 0.00 1.12 0.00 0.00 29.99 31.01 3mkv n HIS 398 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3mkv s ILE 399 N -1.69 2.70 -0.36 1.59 1.01 0.24 0.31 121.20 125.01 3mkv s ILE 399 Ca 0.22 -3.98 0.27 0.00 0.00 0.00 0.00 60.65 57.16 3mkv s ILE 399 Cb 0.17 -2.80 0.31 0.00 0.01 0.00 0.00 42.46 40.15 3mkv s ILE 399 CO 0.06 -0.97 1.79 1.55 0.00 0.00 0.00 174.94 177.38 3mkv h PRO 400 N 5.67 0.00 -3.07 2.79 0.13 -1.70 -3.43 132.00 132.40 3mkv h PRO 400 Ca 0.10 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.90 3mkv h PRO 400 Cb 0.79 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.55 3mkv h PRO 400 CO 0.69 0.00 -0.67 -1.17 -0.23 0.00 0.00 178.00 176.63 3mkv s LEU 401 N -5.15 0.01 -0.15 1.56 0.20 -1.21 -0.75 118.68 113.19 3mkv s LEU 401 Ca 0.05 0.12 0.01 0.00 0.69 0.00 0.00 54.13 55.00 3mkv s LEU 401 Cb 0.09 0.15 0.02 0.00 -0.43 0.00 0.00 46.19 46.02 3mkv s LEU 401 CO 0.50 -0.27 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.42 3mkv s VAL 402 N 2.26 1.87 -0.08 1.68 1.01 -0.50 -0.72 120.40 125.93 3mkv s VAL 402 Ca 0.04 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.20 3mkv s VAL 402 Cb -0.13 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.57 3mkv s VAL 402 CO -0.06 0.51 -0.16 -0.32 0.00 0.00 0.00 175.10 175.07 3mkv s MET 403 N 1.12 2.09 -0.07 2.72 0.00 -0.13 -1.30 119.30 123.73 3mkv s MET 403 Ca -0.01 -0.55 0.02 0.00 0.00 0.00 0.00 55.69 55.16 3mkv s MET 403 Cb -0.14 -1.67 0.01 0.00 0.00 0.00 0.00 34.83 33.03 3mkv s MET 403 CO -0.07 0.07 -0.14 0.21 0.00 0.00 0.00 175.02 175.09 3mkv s LYS 404 N 0.57 1.97 -1.07 4.11 2.20 -0.03 -0.66 119.74 126.82 3mkv s LYS 404 Ca -0.16 -0.50 0.00 0.00 -0.36 0.00 0.00 55.97 54.95 3mkv s LYS 404 Cb -0.16 -1.59 0.00 0.00 -1.51 0.00 0.00 37.83 34.56 3mkv s LYS 404 CO 0.05 0.04 0.00 -0.25 -0.36 0.00 0.00 175.35 174.84 3mkv n ASP 405 N 3.80 -5.21 0.00 1.43 10.43 -1.13 -1.89 116.55 123.99 3mkv n ASP 405 Ca -0.22 0.25 0.00 0.00 2.57 0.00 0.00 54.79 57.39 3mkv n ASP 405 Cb 0.52 -3.60 0.00 0.00 1.84 0.00 0.00 41.12 39.88 3mkv n ASP 405 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3mkv n GLY 406 N -0.42 0.76 3.14 0.44 0.00 -0.93 -3.30 105.19 104.88 3mkv n GLY 406 Ca -0.10 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 3mkv n GLY 406 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mkv s ARG 407 N -1.12 1.22 -0.20 1.61 0.52 -0.79 -4.61 118.95 115.58 3mkv s ARG 407 Ca 0.00 -0.61 -0.29 0.00 -0.52 0.00 0.00 55.73 54.32 3mkv s ARG 407 Cb 0.00 -1.19 0.00 0.00 0.52 0.00 0.00 34.95 34.28 3mkv s ARG 407 CO 0.00 0.32 1.01 -0.51 0.02 0.00 0.00 175.30 176.15 3mkv s LEU 408 N -0.52 4.13 -0.09 2.53 1.43 -1.26 -0.85 118.68 124.04 3mkv s LEU 408 Ca 0.05 1.39 -0.14 0.00 -1.03 0.00 0.00 54.13 54.40 3mkv s LEU 408 Cb -0.06 -3.51 -0.28 0.00 0.03 0.00 0.00 46.19 42.36 3mkv s LEU 408 CO -0.00 -0.60 0.56 0.15 0.23 0.00 0.00 176.35 176.69 3mkv h PHE 409 N 7.38 0.50 -3.87 0.29 3.04 -1.56 -3.48 116.94 119.24 3mkv h PHE 409 Ca -0.22 -0.37 -0.24 0.00 3.98 0.00 0.00 57.97 61.12 3mkv h PHE 409 Cb 1.08 -0.02 -0.25 0.00 2.56 0.00 0.00 35.95 39.32 3mkv h PHE 409 CO 0.74 1.60 -0.72 0.08 -2.02 0.00 0.00 178.31 177.98 3mkv s VAL 410 N -2.50 0.20 -0.45 1.41 1.01 -0.90 -4.99 120.40 114.17 3mkv s VAL 410 Ca -0.19 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.35 3mkv s VAL 410 Cb 0.05 -0.24 0.19 0.00 0.00 0.00 0.00 36.38 36.38 3mkv s VAL 410 CO 0.78 -0.18 0.80 0.21 0.00 0.00 0.00 175.10 176.71 3mkv s ASN 411 N -0.68 -1.17 -1.16 3.32 2.47 -1.22 -1.40 114.94 115.10 3mkv s ASN 411 Ca -0.06 -1.14 -0.04 0.00 0.42 0.00 0.00 52.86 52.05 3mkv s ASN 411 Cb -0.05 1.52 0.24 0.00 -1.45 0.00 0.00 41.25 41.51 3mkv s ASN 411 CO -0.00 -0.07 1.96 -1.84 -3.72 0.00 0.00 177.10 173.43 3mkv n GLU 412 N 3.28 4.86 0.04 0.43 0.28 0.07 -4.40 120.64 125.20 3mkv n GLU 412 Ca 0.14 -4.15 -0.00 0.00 -0.16 0.00 0.00 57.16 52.99 3mkv n GLU 412 Cb 0.58 -2.57 -0.00 0.00 1.43 0.00 0.00 31.44 30.88 3mkv n GLU 412 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3mkv n LEU 413 N 1.10 0.83 0.00 -1.84 4.77 -1.26 -4.93 117.00 115.67 3mkv n LEU 413 Ca 0.48 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 3mkv n LEU 413 Cb 0.28 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3mkv n LEU 413 CO 0.63 -0.55 0.01 -0.62 -1.33 0.00 0.00 177.39 175.53