#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lua s LYS 3 N 0.00 4.19 -0.48 1.43 -0.14 -1.26 -4.98 119.74 118.50 1lua s LYS 3 Ca 0.00 1.73 -0.27 0.00 -1.36 0.00 0.00 55.97 56.07 1lua s LYS 3 Cb 0.00 -2.72 0.03 0.00 -1.68 0.00 0.00 37.83 33.46 1lua s LYS 3 CO 0.00 -0.17 1.03 0.15 -0.76 0.00 0.00 175.35 175.60 1lua s LYS 4 N -2.21 3.59 -0.24 1.68 1.02 -1.26 -4.74 119.74 117.58 1lua s LYS 4 Ca 0.55 0.29 -0.08 0.00 0.02 0.00 0.00 55.97 56.76 1lua s LYS 4 Cb -0.28 -3.94 -0.03 0.00 -0.52 0.00 0.00 37.83 33.06 1lua s LYS 4 CO 0.35 -1.34 0.08 -0.51 -0.92 0.00 0.00 175.35 173.01 1lua s LEU 5 N 4.15 3.52 -0.21 3.17 1.43 0.57 -0.56 118.68 130.75 1lua s LEU 5 Ca 0.41 -0.16 -0.07 0.00 -1.03 0.00 0.00 54.13 53.28 1lua s LEU 5 Cb -0.09 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 1lua s LEU 5 CO 0.28 -0.02 0.06 -0.22 0.23 0.00 0.00 176.35 176.69 1lua s LEU 6 N 1.51 3.66 -0.28 1.79 2.96 -0.09 -1.26 118.68 126.96 1lua s LEU 6 Ca 0.06 -0.03 -0.09 0.00 -0.22 0.00 0.00 54.13 53.84 1lua s LEU 6 Cb -0.15 -1.94 -0.02 0.00 0.50 0.00 0.00 46.19 44.57 1lua s LEU 6 CO 0.04 0.10 0.13 -0.36 -1.32 0.00 0.00 176.35 174.94 1lua s PHE 7 N 0.84 3.15 -0.36 5.38 0.40 -0.07 -1.20 117.98 126.12 1lua s PHE 7 Ca 0.03 -0.38 -0.15 0.00 -0.60 0.00 0.00 56.93 55.83 1lua s PHE 7 Cb -0.14 -2.32 -0.01 0.00 0.51 0.00 0.00 43.02 41.07 1lua s PHE 7 CO 0.02 -0.36 0.35 -1.14 0.70 0.00 0.00 175.22 174.79 1lua s GLN 8 N 1.64 3.44 -0.35 0.44 0.74 -0.50 -1.14 119.66 123.94 1lua s GLN 8 Ca 0.06 -0.54 -0.08 0.00 0.05 0.00 0.00 55.36 54.85 1lua s GLN 8 Cb -0.16 -3.84 0.03 0.00 1.10 0.00 0.00 33.01 30.14 1lua s GLN 8 CO 0.06 -0.58 0.13 -0.06 -0.55 0.00 0.00 175.29 174.29 1lua s PHE 9 N 1.98 3.24 -0.10 1.67 2.99 -0.07 -0.53 117.98 127.17 1lua s PHE 9 Ca 0.11 -1.26 0.00 0.00 0.00 0.00 0.00 56.93 55.78 1lua s PHE 9 Cb -0.17 -2.32 -0.02 0.00 0.00 0.00 0.00 43.02 40.50 1lua s PHE 9 CO 0.12 -0.70 -0.10 0.34 -0.00 0.00 0.00 175.22 174.89 1lua s ASP 10 N 1.45 4.38 0.10 1.36 -1.08 -0.34 -1.33 116.67 121.21 1lua s ASP 10 Ca -0.00 -0.16 0.27 0.00 -0.52 0.00 0.00 52.55 52.14 1lua s ASP 10 Cb -0.19 -1.32 1.02 0.00 -1.46 0.00 0.00 42.92 40.96 1lua s ASP 10 CO 0.04 0.27 1.84 0.35 0.52 0.00 0.00 175.17 178.19 1lua n THR 11 N 2.81 0.33 -2.13 1.71 -2.24 -0.78 -2.31 114.28 111.66 1lua n THR 11 Ca -0.18 -0.12 -0.28 0.00 -2.27 0.00 0.00 64.05 61.21 1lua n THR 11 Cb 0.53 -0.57 0.14 0.00 -2.10 0.00 0.00 70.33 68.32 1lua n THR 11 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1lua s ASP 12 N -3.73 3.78 0.41 3.42 1.01 -1.26 -4.28 116.67 116.01 1lua s ASP 12 Ca 0.12 0.18 0.09 0.00 0.71 0.00 0.00 52.55 53.65 1lua s ASP 12 Cb 0.15 -0.43 0.89 0.00 1.01 0.00 0.00 42.92 44.55 1lua s ASP 12 CO 0.55 -2.29 2.03 0.00 0.21 0.00 0.00 175.17 175.67 1lua h ALA 13 N -1.17 1.79 -2.81 5.23 0.00 -1.94 0.25 119.26 120.61 1lua h ALA 13 Ca -0.43 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.28 1lua h ALA 13 Cb 1.26 -0.15 -0.19 0.00 0.00 0.00 0.00 17.79 18.71 1lua h ALA 13 CO 0.44 0.15 -0.70 0.95 0.00 0.00 0.00 179.25 180.09 1lua s THR 14 N -5.49 0.23 0.35 0.00 -4.23 -1.26 -4.02 115.64 101.22 1lua s THR 14 Ca -0.08 -1.18 -0.28 0.00 -1.18 0.00 0.00 61.69 58.97 1lua s THR 14 Cb 0.18 -0.66 -0.10 0.00 1.34 0.00 0.00 72.50 73.27 1lua s THR 14 CO 0.74 -0.61 1.30 -2.84 -0.54 0.00 0.00 174.62 172.67 1lua s PRO 15 N -2.13 4.25 0.13 3.99 0.02 -1.26 -4.89 135.00 135.12 1lua s PRO 15 Ca -0.09 2.18 -0.31 0.00 0.02 0.00 0.00 61.00 62.80 1lua s PRO 15 Cb -0.05 -2.98 -0.11 0.00 0.02 0.00 0.00 34.50 31.38 1lua s PRO 15 CO -0.03 -0.26 1.82 0.45 -0.33 0.00 0.00 177.00 178.65 1lua n SER 16 N 0.60 4.01 -0.28 2.53 2.88 -1.26 -4.91 113.62 117.19 1lua n SER 16 Ca 0.01 1.00 -0.06 0.00 -1.33 0.00 0.00 58.87 58.49 1lua n SER 16 Cb 0.42 -1.54 0.06 0.00 -0.75 0.00 0.00 64.21 62.40 1lua n SER 16 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1lua h VAL 17 N 4.55 1.25 -0.51 2.46 2.07 -2.01 -2.88 116.25 121.19 1lua h VAL 17 Ca -0.46 -0.76 0.06 0.00 0.82 0.00 0.00 66.70 66.35 1lua h VAL 17 Cb 1.22 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 1lua h VAL 17 CO 0.95 0.31 0.22 0.15 0.02 0.00 0.00 177.57 179.22 1lua h PHE 18 N 1.10 0.40 0.00 1.57 3.57 -2.01 -1.90 116.94 119.66 1lua h PHE 18 Ca 0.26 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.73 1lua h PHE 18 Cb 0.18 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1lua h PHE 18 CO 0.02 0.16 -0.27 -0.44 -2.23 0.00 0.00 178.31 175.55 1lua h ASP 19 N 0.43 0.00 -0.01 0.41 3.32 -1.91 -2.72 116.42 115.94 1lua h ASP 19 Ca 0.24 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 1lua h ASP 19 Cb 0.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 1lua h ASP 19 CO -0.20 0.27 -0.01 0.58 -1.72 0.00 0.00 179.24 178.16 1lua h VAL 20 N 0.00 1.34 0.05 -1.35 2.07 -1.20 -1.64 116.25 115.52 1lua h VAL 20 Ca -0.00 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1lua h VAL 20 Cb 0.53 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 1lua h VAL 20 CO 0.03 0.26 -0.06 0.58 0.02 0.00 0.00 177.57 178.41 1lua h VAL 21 N -0.39 0.85 -0.47 2.57 2.07 -1.33 -1.95 116.25 117.60 1lua h VAL 21 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1lua h VAL 21 Cb 0.43 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1lua h VAL 21 CO 0.00 0.00 0.18 0.58 0.02 0.00 0.00 177.57 178.36 1lua h VAL 22 N -0.14 1.18 -0.38 2.57 2.07 -1.55 -1.06 116.25 118.95 1lua h VAL 22 Ca 0.01 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1lua h VAL 22 Cb 0.14 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1lua h VAL 22 CO -0.03 0.22 0.22 1.23 0.02 0.00 0.00 177.57 179.24 1lua h GLY 23 N 0.83 0.55 1.09 2.17 0.00 -0.96 -1.00 103.07 105.75 1lua h GLY 23 Ca 0.16 -0.23 -0.10 0.00 0.00 0.00 0.00 47.33 47.15 1lua h GLY 23 CO -0.02 0.23 -0.04 -0.97 0.00 0.00 0.00 176.54 175.74 1lua h TYR 24 N 0.49 1.17 0.00 5.60 -1.99 -0.82 -2.60 116.97 118.83 1lua h TYR 24 Ca 0.14 -0.22 0.00 0.00 2.00 0.00 0.00 58.73 60.65 1lua h TYR 24 Cb 0.01 -0.30 0.00 0.00 2.00 0.00 0.00 36.73 38.44 1lua h TYR 24 CO -0.03 1.05 0.00 -0.44 -0.00 0.00 0.00 178.16 178.74 1lua h ASP 25 N 0.96 0.00 0.40 3.88 3.32 -1.00 -1.63 116.42 122.35 1lua h ASP 25 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1lua h ASP 25 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1lua h ASP 25 CO 0.04 0.00 -0.15 0.61 -1.72 0.00 0.00 179.24 178.02 1lua n GLY 26 N -0.04 -0.96 0.00 2.75 0.00 -0.40 -4.94 105.19 101.60 1lua n GLY 26 Ca 0.01 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1lua n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lua n GLY 27 N 1.32 1.01 3.77 -0.02 0.00 -0.61 -3.12 105.19 107.54 1lua n GLY 27 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1lua n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lua s ALA 28 N -2.00 3.52 -0.00 4.61 0.00 -1.06 -4.89 121.76 121.94 1lua s ALA 28 Ca 0.00 1.30 0.02 0.00 0.00 0.00 0.00 51.96 53.28 1lua s ALA 28 Cb 0.00 -3.50 -0.25 0.00 0.00 0.00 0.00 23.12 19.37 1lua s ALA 28 CO 0.00 -0.70 0.83 -0.44 0.00 0.00 0.00 175.76 175.45 1lua h ASP 29 N 3.47 0.23 -3.97 0.00 3.32 -1.19 -3.43 116.42 114.85 1lua h ASP 29 Ca -0.49 -0.36 -0.17 0.00 0.02 0.00 0.00 57.03 56.03 1lua h ASP 29 Cb 1.23 -0.08 -0.25 0.00 0.22 0.00 0.00 39.33 40.45 1lua h ASP 29 CO 0.66 1.30 -0.47 -1.00 -1.72 0.00 0.00 179.24 178.01 1lua s HIS 30 N -2.62 -0.19 -0.13 4.55 3.76 -0.90 -4.99 115.29 114.77 1lua s HIS 30 Ca -0.08 0.47 0.02 0.00 -0.15 0.00 0.00 55.06 55.32 1lua s HIS 30 Cb 0.08 0.06 0.01 0.00 1.11 0.00 0.00 32.58 33.84 1lua s HIS 30 CO 0.83 -0.14 -0.17 0.42 -0.85 0.00 0.00 174.74 174.83 1lua s ILE 31 N -0.09 1.70 -0.22 0.60 1.01 -1.26 -0.91 121.20 122.03 1lua s ILE 31 Ca -0.02 -0.76 -0.02 0.00 0.00 0.00 0.00 60.65 59.85 1lua s ILE 31 Cb -0.02 -1.54 0.01 0.00 0.01 0.00 0.00 42.46 40.91 1lua s ILE 31 CO 0.01 0.48 -0.07 -0.89 0.00 0.00 0.00 174.94 174.46 1lua s THR 32 N 1.00 3.01 0.03 2.92 2.01 -0.34 -4.99 115.64 119.28 1lua s THR 32 Ca -0.05 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.27 1lua s THR 32 Cb -0.15 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.92 1lua s THR 32 CO -0.03 0.38 -0.03 -0.83 -0.69 0.00 0.00 174.62 173.41 1lua s GLY 33 N 1.41 1.83 -0.02 4.40 0.00 -1.26 -1.41 107.32 112.27 1lua s GLY 33 Ca 0.04 -1.05 0.04 0.00 0.00 0.00 0.00 44.72 43.76 1lua s GLY 33 CO -0.05 -0.95 -0.15 -0.19 0.00 0.00 0.00 173.10 171.75 1lua s TYR 34 N -1.12 1.42 0.56 1.90 1.51 0.31 -4.94 117.35 116.99 1lua s TYR 34 Ca 0.20 -0.31 0.07 0.00 -1.01 0.00 0.00 57.07 56.03 1lua s TYR 34 Cb -0.11 -0.93 0.07 0.00 -0.11 0.00 0.00 41.96 40.88 1lua s TYR 34 CO 0.12 -0.06 0.62 0.41 -1.11 0.00 0.00 175.55 175.52 1lua n GLY 35 N 2.85 2.32 2.43 0.71 0.00 -1.26 -1.20 105.19 111.04 1lua n GLY 35 Ca -0.16 -2.26 -0.12 0.00 0.00 0.00 0.00 46.02 43.49 1lua n GLY 35 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lua n ASN 36 N -2.11 -3.72 -4.72 1.61 3.02 0.87 -4.85 115.26 105.37 1lua n ASN 36 Ca 0.08 0.22 -0.42 0.00 -0.03 0.00 0.00 54.58 54.43 1lua n ASN 36 Cb 0.61 -3.18 -0.03 0.00 -0.61 0.00 0.00 39.78 36.57 1lua n ASN 36 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1lua s VAL 37 N -2.56 3.96 0.27 2.41 1.01 -0.98 -5.00 120.40 119.51 1lua s VAL 37 Ca 0.00 1.52 0.04 0.00 0.00 0.00 0.00 61.98 63.54 1lua s VAL 37 Cb 0.00 -3.97 -0.06 0.00 0.00 0.00 0.00 36.38 32.35 1lua s VAL 37 CO 0.00 0.18 0.01 0.42 0.00 0.00 0.00 175.10 175.72 1lua s THR 38 N 0.48 1.15 0.54 3.92 -4.23 -1.26 -4.51 115.64 111.73 1lua s THR 38 Ca 0.54 -2.04 0.20 0.00 -1.18 0.00 0.00 61.69 59.21 1lua s THR 38 Cb -0.29 -2.52 0.29 0.00 1.34 0.00 0.00 72.50 71.32 1lua s THR 38 CO 0.32 -0.20 2.17 -0.65 -0.54 0.00 0.00 174.62 175.72 1lua h PRO 39 N 2.33 0.00 0.07 3.99 0.11 -1.92 -1.87 132.00 134.71 1lua h PRO 39 Ca -0.39 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.47 1lua h PRO 39 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1lua h PRO 39 CO 0.66 0.01 -1.12 -0.44 -0.21 0.00 0.00 178.00 176.90 1lua h ASP 40 N 0.00 0.27 0.10 -2.05 3.45 -1.96 -3.36 116.42 112.87 1lua h ASP 40 Ca -0.00 -0.28 0.00 0.00 0.43 0.00 0.00 57.03 57.18 1lua h ASP 40 Cb 0.01 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 1lua h ASP 40 CO 0.00 1.20 -0.61 -0.46 -1.57 0.00 0.00 179.24 177.81 1lua n ASN 41 N -3.49 1.35 0.19 6.45 0.23 -1.05 -4.38 115.26 114.56 1lua n ASN 41 Ca -0.05 -1.09 0.07 0.00 -0.53 0.00 0.00 54.58 52.98 1lua n ASN 41 Cb 0.97 0.55 0.29 0.00 -2.08 0.00 0.00 39.78 39.51 1lua n ASN 41 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 1lua h VAL 42 N 1.17 0.63 -0.72 3.53 3.04 -1.49 -3.30 116.25 119.11 1lua h VAL 42 Ca 0.00 -1.49 0.05 0.00 -1.01 0.00 0.00 66.70 64.26 1lua h VAL 42 Cb 0.60 2.01 -0.05 0.00 -2.01 0.00 0.00 31.29 31.83 1lua h VAL 42 CO 0.00 0.30 0.42 1.23 -1.01 0.00 0.00 177.57 178.51 1lua h GLY 43 N 2.68 1.06 1.48 3.17 0.00 -1.78 -0.89 103.07 108.79 1lua h GLY 43 Ca -0.00 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 1lua h GLY 43 CO 0.04 0.21 0.06 0.00 0.00 0.00 0.00 176.54 176.84 1lua h ALA 44 N 1.35 1.31 -0.42 3.60 0.00 -1.88 -1.04 119.26 122.18 1lua h ALA 44 Ca 0.31 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1lua h ALA 44 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1lua h ALA 44 CO -0.16 0.48 -0.16 1.88 0.00 0.00 0.00 179.25 181.29 1lua h TYR 45 N 0.63 0.97 -0.79 0.00 0.99 -1.47 -2.93 116.97 114.37 1lua h TYR 45 Ca 0.14 -0.23 -0.04 0.00 2.00 0.00 0.00 58.73 60.60 1lua h TYR 45 Cb 0.31 -0.23 -0.04 0.00 1.00 0.00 0.00 36.73 37.78 1lua h TYR 45 CO 0.01 0.99 0.33 0.28 -0.00 0.00 0.00 178.16 179.77 1lua h VAL 46 N 0.67 1.26 -0.90 -2.88 2.07 -0.71 -2.34 116.25 113.41 1lua h VAL 46 Ca 0.10 -0.79 0.13 0.00 0.82 0.00 0.00 66.70 66.96 1lua h VAL 46 Cb 0.71 0.29 -0.07 0.00 -1.52 0.00 0.00 31.29 30.70 1lua h VAL 46 CO 0.05 0.33 0.58 0.44 0.02 0.00 0.00 177.57 178.99 1lua h ASP 47 N 1.15 0.73 0.56 0.57 3.32 -1.03 0.67 116.42 122.39 1lua h ASP 47 Ca 0.27 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1lua h ASP 47 Cb 0.19 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1lua h ASP 47 CO -0.03 0.39 0.00 1.23 -1.72 0.00 0.00 179.24 179.11 1lua h GLY 48 N 0.78 0.00 0.66 2.75 0.00 -1.28 -2.31 103.07 103.67 1lua h GLY 48 Ca 0.44 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.73 1lua h GLY 48 CO -0.20 0.00 -1.42 -1.30 0.00 0.00 0.00 176.54 173.61 1lua n THR 49 N -3.07 0.57 0.82 4.70 -2.24 0.19 -4.25 114.28 111.00 1lua n THR 49 Ca -0.01 -0.57 0.09 0.00 -2.27 0.00 0.00 64.05 61.29 1lua n THR 49 Cb 0.20 -0.31 -0.11 0.00 -2.10 0.00 0.00 70.33 68.01 1lua n THR 49 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1lua n ILE 50 N -2.59 0.00 -0.27 2.28 -5.35 -0.96 -4.48 119.36 107.98 1lua n ILE 50 Ca -0.04 -0.08 0.04 0.00 -0.27 0.00 0.00 62.75 62.40 1lua n ILE 50 Cb 0.63 0.92 0.11 0.00 -1.74 0.00 0.00 39.64 39.56 1lua n ILE 50 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1lua n TYR 51 N -1.51 0.34 0.22 4.28 0.53 -0.90 -4.64 117.16 115.47 1lua n TYR 51 Ca 0.03 -0.57 0.08 0.00 -1.02 0.00 0.00 57.90 56.41 1lua n TYR 51 Cb 0.32 -0.07 -0.12 0.00 -1.03 0.00 0.00 39.34 38.44 1lua n TYR 51 CO 0.00 0.00 0.00 0.25 -1.02 0.00 0.00 176.86 176.09 1lua n THR 52 N -0.05 0.00 -4.04 -0.72 -2.24 -1.26 -5.02 114.28 100.95 1lua n THR 52 Ca 0.09 -0.30 -0.08 0.00 -2.27 0.00 0.00 64.05 61.49 1lua n THR 52 Cb 0.44 0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 68.95 1lua n THR 52 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1lua s ARG 53 N -2.95 0.50 0.21 -0.78 0.52 -1.26 -5.10 118.95 110.10 1lua s ARG 53 Ca -0.02 -0.97 0.04 0.00 -0.52 0.00 0.00 55.73 54.25 1lua s ARG 53 Cb 0.11 0.18 -0.05 0.00 0.52 0.00 0.00 34.95 35.71 1lua s ARG 53 CO 0.67 -0.09 -0.02 0.20 0.02 0.00 0.00 175.30 176.08 1lua s GLY 54 N -2.35 1.46 0.00 -3.53 0.00 -1.26 -4.59 107.32 97.05 1lua s GLY 54 Ca -0.02 -1.71 0.00 0.00 0.00 0.00 0.00 44.72 42.99 1lua s GLY 54 CO -0.06 -1.65 0.00 0.61 0.00 0.00 0.00 173.10 172.00 1lua n GLY 55 N -0.37 2.92 0.20 0.20 0.00 -1.26 -0.99 105.19 105.88 1lua n GLY 55 Ca -0.06 -0.12 0.15 0.00 0.00 0.00 0.00 46.02 45.99 1lua n GLY 55 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1lua h LYS 56 N 0.00 0.00 -0.61 1.61 3.64 -2.03 -2.14 116.57 117.03 1lua h LYS 56 Ca 0.00 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1lua h LYS 56 Cb 0.00 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1lua h LYS 56 CO 0.00 0.00 0.06 0.93 -2.27 0.00 0.00 179.45 178.17 1lua h GLU 57 N 0.00 1.03 -0.99 1.90 5.08 -1.45 -3.10 114.58 117.05 1lua h GLU 57 Ca 0.00 -0.29 0.21 0.00 -1.00 0.00 0.00 59.36 58.28 1lua h GLU 57 Cb 0.27 -0.11 -0.10 0.00 0.50 0.00 0.00 28.75 29.32 1lua h GLU 57 CO 0.00 0.97 0.62 0.87 -1.00 0.00 0.00 179.01 180.47 1lua h LYS 58 N 0.96 0.58 0.00 2.33 1.57 -1.33 -0.13 116.57 120.55 1lua h LYS 58 Ca 0.18 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1lua h LYS 58 Cb 0.47 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1lua h LYS 58 CO 0.02 0.38 0.00 0.00 -0.57 0.00 0.00 179.45 179.28 1lua n GLN 59 N -4.68 0.10 -0.10 3.15 10.64 -1.17 -1.95 117.38 123.38 1lua n GLN 59 Ca 0.23 0.23 0.09 0.00 -1.83 0.00 0.00 57.00 55.72 1lua n GLN 59 Cb 0.67 -1.50 0.34 0.00 -0.86 0.00 0.00 30.24 28.89 1lua n GLN 59 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1lua n SER 60 N -1.36 1.64 -4.28 2.61 7.64 -0.06 -4.27 113.62 115.54 1lua n SER 60 Ca 0.04 -1.76 -0.30 0.00 1.01 0.00 0.00 58.87 57.87 1lua n SER 60 Cb 0.10 -0.13 -0.16 0.00 -1.01 0.00 0.00 64.21 63.02 1lua n SER 60 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1lua s THR 61 N -1.75 1.92 0.16 0.44 2.01 -0.82 -0.31 115.64 117.28 1lua s THR 61 Ca 0.30 -1.03 -0.11 0.00 0.31 0.00 0.00 61.69 61.16 1lua s THR 61 Cb 0.16 -1.59 0.00 0.00 0.01 0.00 0.00 72.50 71.08 1lua s THR 61 CO 0.24 0.54 0.33 0.00 -0.69 0.00 0.00 174.62 175.04 1lua s ALA 62 N -0.53 -0.26 -0.04 7.40 0.00 -0.39 -4.26 121.76 123.69 1lua s ALA 62 Ca 0.08 -0.68 0.06 0.00 0.00 0.00 0.00 51.96 51.42 1lua s ALA 62 Cb -0.10 0.81 -0.01 0.00 0.00 0.00 0.00 23.12 23.82 1lua s ALA 62 CO -0.01 -0.66 -0.23 0.42 0.00 0.00 0.00 175.76 175.28 1lua s ILE 63 N -3.93 1.86 -0.08 0.00 1.01 -0.39 -0.89 121.20 118.78 1lua s ILE 63 Ca 0.13 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.83 1lua s ILE 63 Cb 0.03 -1.57 0.01 0.00 0.01 0.00 0.00 42.46 40.94 1lua s ILE 63 CO -0.02 0.52 -0.14 0.12 0.00 0.00 0.00 174.94 175.42 1lua s PHE 64 N -0.27 1.72 -0.14 3.97 5.36 -0.29 -1.07 117.98 127.25 1lua s PHE 64 Ca 0.01 -0.69 -0.02 0.00 -0.96 0.00 0.00 56.93 55.27 1lua s PHE 64 Cb -0.12 -1.24 -0.02 0.00 -0.34 0.00 0.00 43.02 41.30 1lua s PHE 64 CO 0.02 -0.35 -0.08 0.08 -1.46 0.00 0.00 175.22 173.44 1lua s VAL 65 N 0.72 3.55 0.00 3.12 1.01 0.40 -0.89 120.40 128.30 1lua s VAL 65 Ca -0.13 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1lua s VAL 65 Cb -0.16 -2.53 -0.00 0.00 0.00 0.00 0.00 36.38 33.69 1lua s VAL 65 CO 0.03 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1lua n GLY 66 N 3.51 3.46 0.00 4.51 0.00 -0.44 -1.63 105.19 114.60 1lua n GLY 66 Ca -0.18 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1lua n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lua n GLY 67 N -0.00 2.44 0.09 -0.02 0.00 -1.26 -1.87 105.19 104.56 1lua n GLY 67 Ca 0.00 -1.92 0.12 0.00 0.00 0.00 0.00 46.02 44.22 1lua n GLY 67 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1lua h GLY 68 N 0.00 0.00 -7.35 -0.02 0.00 -1.94 -1.64 103.07 92.12 1lua h GLY 68 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 1lua h GLY 68 CO 0.00 0.00 -0.69 -0.35 0.00 0.00 0.00 176.54 175.50 1lua s ASP 69 N -4.44 4.72 0.13 0.19 -1.08 -1.26 -4.87 116.67 110.05 1lua s ASP 69 Ca 0.08 -0.91 -0.19 0.00 -0.52 0.00 0.00 52.55 51.01 1lua s ASP 69 Cb 0.13 -1.75 -0.04 0.00 -1.46 0.00 0.00 42.92 39.79 1lua s ASP 69 CO 0.66 -0.18 1.76 -0.03 0.52 0.00 0.00 175.17 177.90 1lua h MET 70 N 8.09 0.22 -1.01 4.34 1.85 -1.89 -2.10 114.93 124.43 1lua h MET 70 Ca -0.30 -0.01 0.10 0.00 -0.61 0.00 0.00 59.70 58.88 1lua h MET 70 Cb 1.10 -0.05 -0.08 0.00 0.43 0.00 0.00 31.60 33.00 1lua h MET 70 CO 0.58 0.15 0.64 0.00 -0.40 0.00 0.00 176.91 177.87 1lua h ALA 71 N 1.11 1.48 -0.42 0.39 0.00 -1.99 0.18 119.26 120.01 1lua h ALA 71 Ca 0.09 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1lua h ALA 71 Cb 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1lua h ALA 71 CO -0.06 0.29 -0.03 0.00 0.00 0.00 0.00 179.25 179.45 1lua h ALA 72 N 1.51 0.57 -0.59 0.00 0.00 -1.93 -1.88 119.26 116.94 1lua h ALA 72 Ca 0.48 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1lua h ALA 72 Cb 0.39 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1lua h ALA 72 CO -0.24 0.39 0.16 0.78 0.00 0.00 0.00 179.25 180.34 1lua h GLY 73 N 0.59 0.97 1.19 0.00 0.00 -0.59 -2.19 103.07 103.04 1lua h GLY 73 Ca 0.11 -0.56 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 1lua h GLY 73 CO 0.03 0.52 0.19 0.83 0.00 0.00 0.00 176.54 178.11 1lua h GLU 74 N 0.87 1.02 -0.34 4.80 5.08 -0.45 0.22 114.58 125.78 1lua h GLU 74 Ca 0.19 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 1lua h GLU 74 Cb 0.28 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1lua h GLU 74 CO -0.00 0.88 -0.16 0.00 -1.00 0.00 0.00 179.01 178.72 1lua h ARG 75 N 0.98 0.63 -0.15 2.33 3.08 -0.96 -1.34 114.38 118.94 1lua h ARG 75 Ca 0.21 -0.21 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 1lua h ARG 75 Cb 0.30 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.31 1lua h ARG 75 CO -0.01 0.76 -0.57 0.28 -1.07 0.00 0.00 179.97 179.37 1lua h VAL 76 N 0.56 1.32 -0.80 2.04 2.07 -0.78 -2.59 116.25 118.08 1lua h VAL 76 Ca 0.09 -1.82 0.04 0.00 0.82 0.00 0.00 66.70 65.82 1lua h VAL 76 Cb 0.60 2.03 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 1lua h VAL 76 CO 0.04 0.56 0.51 0.15 0.02 0.00 0.00 177.57 178.85 1lua h PHE 77 N 0.32 0.95 -0.56 1.57 3.57 -0.39 -0.02 116.94 122.38 1lua h PHE 77 Ca -0.03 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 1lua h PHE 77 Cb 1.20 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1lua h PHE 77 CO 0.10 0.53 -0.00 0.93 -2.23 0.00 0.00 178.31 177.64 1lua h GLU 78 N 0.98 0.96 0.00 1.11 4.39 -1.24 -2.08 114.58 118.70 1lua h GLU 78 Ca 0.33 -0.29 -0.08 0.00 0.34 0.00 0.00 59.36 59.66 1lua h GLU 78 Cb 0.04 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1lua h GLU 78 CO -0.12 0.95 -0.36 0.00 -1.16 0.00 0.00 179.01 178.31 1lua h ALA 79 N 1.11 1.37 0.11 3.43 0.00 -0.93 -1.12 119.26 123.24 1lua h ALA 79 Ca 0.16 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1lua h ALA 79 Cb 0.52 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1lua h ALA 79 CO 0.03 0.45 -0.06 0.28 0.00 0.00 0.00 179.25 179.95 1lua h VAL 80 N 0.00 1.06 -0.24 0.00 2.07 -0.59 -2.83 116.25 115.72 1lua h VAL 80 Ca -0.00 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 1lua h VAL 80 Cb 0.65 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1lua h VAL 80 CO 0.05 0.18 0.07 0.11 0.02 0.00 0.00 177.57 178.00 1lua h LYS 81 N -0.52 0.34 0.00 1.57 1.57 -1.19 -1.54 116.57 116.80 1lua h LYS 81 Ca -0.02 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 1lua h LYS 81 Cb 0.42 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1lua h LYS 81 CO 0.03 0.31 -0.20 0.87 -0.57 0.00 0.00 179.45 179.88 1lua h LYS 82 N 0.34 0.00 0.00 3.15 1.57 -1.16 -2.99 116.57 117.48 1lua h LYS 82 Ca 0.09 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.74 1lua h LYS 82 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1lua h LYS 82 CO -0.01 0.20 -0.61 -0.09 -0.57 0.00 0.00 179.45 178.38 1lua h ARG 83 N 0.00 0.00 -7.20 3.15 9.65 -1.02 -3.45 114.38 115.50 1lua h ARG 83 Ca -0.00 0.00 -0.52 0.00 -1.10 0.00 0.00 59.98 58.36 1lua h ARG 83 Cb 0.62 0.00 0.13 0.00 -1.39 0.00 0.00 29.97 29.32 1lua h ARG 83 CO 0.03 0.61 0.37 -0.06 2.80 0.00 0.00 179.97 183.71 1lua s PHE 84 N -3.06 2.39 -0.28 2.20 0.08 -1.13 -5.02 117.98 113.17 1lua s PHE 84 Ca 0.02 1.58 -0.22 0.00 0.12 0.00 0.00 56.93 58.43 1lua s PHE 84 Cb 0.09 -3.26 0.10 0.00 -0.57 0.00 0.00 43.02 39.38 1lua s PHE 84 CO 0.75 -2.03 0.86 -0.59 -0.10 0.00 0.00 175.22 174.11 1lua s PHE 85 N -2.28 -0.70 0.00 0.36 -0.12 -1.09 -5.04 117.98 109.11 1lua s PHE 85 Ca 0.69 1.60 0.00 0.00 -0.05 0.00 0.00 56.93 59.17 1lua s PHE 85 Cb -0.23 0.37 0.00 0.00 -0.63 0.00 0.00 43.02 42.53 1lua s PHE 85 CO 0.44 -0.34 0.00 0.41 -0.05 0.00 0.00 175.22 175.68 1lua n GLY 86 N 2.92 2.90 0.00 1.99 0.00 -1.26 -1.37 105.19 110.37 1lua n GLY 86 Ca -0.15 -0.27 0.15 0.00 0.00 0.00 0.00 46.02 45.75 1lua n GLY 86 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1lua n PRO 87 N 14.00 0.48 -2.78 1.61 -0.04 -1.26 -4.62 135.00 142.39 1lua n PRO 87 Ca 0.00 0.01 -0.43 0.00 -0.04 0.00 0.00 63.50 63.04 1lua n PRO 87 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 1lua n PRO 87 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1lua s PHE 88 N -2.51 2.98 0.23 0.54 0.40 -0.47 -4.92 117.98 114.23 1lua s PHE 88 Ca 0.30 -1.40 -0.20 0.00 -0.60 0.00 0.00 56.93 55.03 1lua s PHE 88 Cb 0.20 -4.46 0.03 0.00 0.51 0.00 0.00 43.02 39.30 1lua s PHE 88 CO 0.44 -1.64 0.62 -0.98 0.70 0.00 0.00 175.22 174.36 1lua s ARG 89 N 3.32 1.56 0.18 0.44 1.70 -1.26 -2.65 118.95 122.23 1lua s ARG 89 Ca 0.41 -0.88 -0.03 0.00 -0.47 0.00 0.00 55.73 54.76 1lua s ARG 89 Cb -0.02 0.57 -0.03 0.00 -0.57 0.00 0.00 34.95 34.89 1lua s ARG 89 CO -0.06 -0.69 0.14 0.14 -1.08 0.00 0.00 175.30 173.75 1lua s VAL 90 N -3.88 0.04 0.55 4.99 -7.23 -1.17 -4.85 120.40 108.85 1lua s VAL 90 Ca 0.10 -1.87 -0.19 0.00 -1.81 0.00 0.00 61.98 58.21 1lua s VAL 90 Cb -0.03 -2.26 -0.06 0.00 0.56 0.00 0.00 36.38 34.59 1lua s VAL 90 CO 0.01 -0.19 1.10 -0.44 -0.31 0.00 0.00 175.10 175.26 1lua s SER 91 N -3.09 5.80 0.05 4.85 0.01 -1.17 -4.61 113.70 115.53 1lua s SER 91 Ca 0.31 2.06 -0.03 0.00 1.31 0.00 0.00 55.95 59.60 1lua s SER 91 Cb 0.06 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1lua s SER 91 CO 0.07 -1.16 0.03 0.00 0.41 0.00 0.00 173.24 172.59 1lua s MET 93 N -3.16 0.35 -0.11 0.00 1.75 -0.23 -1.26 119.30 116.64 1lua s MET 93 Ca -0.00 -0.32 0.03 0.00 -1.25 0.00 0.00 55.69 54.15 1lua s MET 93 Cb 0.02 0.14 0.01 0.00 2.84 0.00 0.00 34.83 37.84 1lua s MET 93 CO -0.07 -0.07 -0.21 -1.17 -0.65 0.00 0.00 175.02 172.85 1lua s LEU 94 N -1.05 1.99 -0.36 4.11 2.96 -0.51 -0.45 118.68 125.36 1lua s LEU 94 Ca -0.11 -0.53 0.12 0.00 -0.22 0.00 0.00 54.13 53.39 1lua s LEU 94 Cb -0.07 -1.31 0.41 0.00 0.50 0.00 0.00 46.19 45.73 1lua s LEU 94 CO 0.01 0.09 1.35 -0.67 -1.32 0.00 0.00 176.35 175.80 1lua n ASP 95 N 3.88 -1.14 -4.72 3.68 2.03 -0.64 -4.72 116.55 114.92 1lua n ASP 95 Ca -0.20 -2.39 -0.61 0.00 0.52 0.00 0.00 54.79 52.12 1lua n ASP 95 Cb 0.52 0.63 -0.08 0.00 -0.72 0.00 0.00 41.12 41.47 1lua n ASP 95 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1lua n SER 96 N -0.81 2.04 -1.30 1.67 7.64 -1.25 -0.24 113.62 121.37 1lua n SER 96 Ca -0.05 1.11 -0.16 0.00 1.01 0.00 0.00 58.87 60.77 1lua n SER 96 Cb 0.85 -1.07 -0.07 0.00 -1.01 0.00 0.00 64.21 62.92 1lua n SER 96 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1lua n ASN 97 N 4.97 -5.28 -0.84 6.43 5.15 -0.62 -2.21 115.26 122.86 1lua n ASN 97 Ca 0.28 0.41 -0.11 0.00 -0.60 0.00 0.00 54.58 54.55 1lua n ASN 97 Cb 0.07 -4.40 -0.05 0.00 -0.53 0.00 0.00 39.78 34.88 1lua n ASN 97 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1lua n GLY 98 N -0.14 1.18 0.20 8.20 0.00 0.67 -4.93 105.19 110.37 1lua n GLY 98 Ca -0.16 -0.53 -0.07 0.00 0.00 0.00 0.00 46.02 45.26 1lua n GLY 98 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1lua h SER 99 N 0.00 0.48 -0.10 1.61 0.02 -1.61 -1.26 113.55 112.70 1lua h SER 99 Ca -0.22 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 60.41 1lua h SER 99 Cb 0.72 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1lua h SER 99 CO 0.32 0.92 -0.20 0.78 -1.14 0.00 0.00 176.83 177.51 1lua h ASN 100 N 0.34 0.35 0.14 3.07 2.35 -1.86 -1.19 115.58 118.78 1lua h ASN 100 Ca 0.01 -0.56 -0.10 0.00 -0.55 0.00 0.00 56.30 55.09 1lua h ASN 100 Cb 1.04 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.29 1lua h ASN 100 CO 0.09 0.84 -0.36 0.71 -1.65 0.00 0.00 177.43 177.06 1lua h THR 101 N -0.14 1.29 -0.01 2.81 1.35 -1.90 -0.54 112.91 115.78 1lua h THR 101 Ca 0.00 -1.43 -0.01 0.00 -0.55 0.00 0.00 66.41 64.42 1lua h THR 101 Cb 0.79 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 1lua h THR 101 CO 0.04 0.43 -0.04 0.74 -0.25 0.00 0.00 175.52 176.45 1lua h THR 102 N 0.27 1.51 -0.84 6.82 2.02 -1.26 -2.09 112.91 119.33 1lua h THR 102 Ca 0.03 -1.56 -0.01 0.00 0.77 0.00 0.00 66.41 65.63 1lua h THR 102 Cb 0.77 2.53 -0.04 0.00 -1.74 0.00 0.00 68.15 69.67 1lua h THR 102 CO 0.06 0.41 0.47 0.00 0.37 0.00 0.00 175.52 176.83 1lua h ALA 103 N 0.36 1.24 -0.61 6.16 0.00 -1.19 -1.60 119.26 123.62 1lua h ALA 103 Ca -0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1lua h ALA 103 Cb 0.70 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1lua h ALA 103 CO 0.01 0.62 -0.01 0.00 0.00 0.00 0.00 179.25 179.87 1lua h ALA 104 N 1.34 0.84 -0.30 0.00 0.00 -1.13 -1.66 119.26 118.34 1lua h ALA 104 Ca 0.30 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1lua h ALA 104 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1lua h ALA 104 CO -0.05 0.67 -0.02 0.00 0.00 0.00 0.00 179.25 179.85 1lua h ALA 105 N 1.00 0.41 -0.15 0.00 0.00 -1.02 -1.73 119.26 117.77 1lua h ALA 105 Ca 0.17 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1lua h ALA 105 Cb 0.57 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1lua h ALA 105 CO 0.03 0.19 0.09 0.78 0.00 0.00 0.00 179.25 180.34 1lua h GLY 106 N 0.33 0.21 1.42 0.00 0.00 -1.22 -1.72 103.07 102.10 1lua h GLY 106 Ca 0.08 -0.09 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1lua h GLY 106 CO 0.02 0.08 -0.27 -2.08 0.00 0.00 0.00 176.54 174.29 1lua h VAL 107 N 0.17 1.28 -0.56 4.60 2.07 -1.33 -2.52 116.25 119.95 1lua h VAL 107 Ca 0.05 -1.38 -0.08 0.00 0.82 0.00 0.00 66.70 66.11 1lua h VAL 107 Cb 0.02 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1lua h VAL 107 CO -0.01 0.45 0.02 0.00 0.02 0.00 0.00 177.57 178.05 1lua h ALA 108 N 1.12 0.98 -0.49 1.67 0.00 -1.17 -0.70 119.26 120.67 1lua h ALA 108 Ca 0.07 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 1lua h ALA 108 Cb 0.76 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1lua h ALA 108 CO 0.06 0.63 -0.12 -0.07 0.00 0.00 0.00 179.25 179.75 1lua h LEU 109 N 0.88 0.96 -0.22 0.00 3.38 -1.23 -1.61 115.31 117.46 1lua h LEU 109 Ca 0.17 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.71 1lua h LEU 109 Cb 0.49 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1lua h LEU 109 CO 0.02 1.10 -0.12 0.58 0.09 0.00 0.00 178.44 180.11 1lua h VAL 110 N 0.81 1.31 -0.57 1.22 2.07 -1.25 -1.03 116.25 118.80 1lua h VAL 110 Ca 0.13 -1.20 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 1lua h VAL 110 Cb 0.67 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1lua h VAL 110 CO 0.05 0.37 0.22 0.58 0.02 0.00 0.00 177.57 178.80 1lua h VAL 111 N 0.18 1.21 0.01 2.57 2.07 -1.13 0.73 116.25 121.89 1lua h VAL 111 Ca 0.05 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1lua h VAL 111 Cb 0.62 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1lua h VAL 111 CO 0.03 0.27 -0.00 0.50 0.02 0.00 0.00 177.57 178.39 1lua h LYS 112 N 0.83 -0.01 0.00 1.57 3.64 -1.16 -0.67 116.57 120.77 1lua h LYS 112 Ca 0.19 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 1lua h LYS 112 Cb 0.18 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1lua h LYS 112 CO -0.02 0.35 -0.03 0.00 -2.27 0.00 0.00 179.45 177.48 1lua h ALA 113 N 0.61 1.34 0.00 5.00 0.00 -0.89 -0.58 119.26 124.75 1lua h ALA 113 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1lua h ALA 113 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1lua h ALA 113 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1lua n ALA 114 N -2.26 2.40 0.00 0.00 0.00 0.22 -4.87 120.51 116.00 1lua n ALA 114 Ca -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1lua n ALA 114 Cb 0.13 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1lua n ALA 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lua n GLY 115 N 1.10 1.14 0.00 0.00 0.00 -0.23 -4.51 105.19 102.69 1lua n GLY 115 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1lua n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lua n GLY 116 N -1.01 1.63 3.17 -0.02 0.00 -0.28 -5.00 105.19 103.68 1lua n GLY 116 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1lua n GLY 116 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lua s SER 117 N -1.98 -0.07 -0.00 1.61 0.15 -1.26 -4.92 113.70 107.23 1lua s SER 117 Ca 0.00 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.57 1lua s SER 117 Cb 0.00 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 64.57 1lua s SER 117 CO 0.00 -0.42 0.65 1.33 1.20 0.00 0.00 173.24 176.01 1lua n VAL 118 N 1.33 0.22 -1.69 4.45 0.24 -1.26 -4.89 118.33 116.73 1lua n VAL 118 Ca -0.22 -0.23 -0.41 0.00 -2.04 0.00 0.00 64.34 61.44 1lua n VAL 118 Cb 0.56 0.83 0.01 0.00 -1.47 0.00 0.00 33.84 33.77 1lua n VAL 118 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1lua n LYS 119 N -0.12 1.92 0.00 7.34 4.81 -1.24 -1.92 118.16 128.95 1lua n LYS 119 Ca 0.00 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 1lua n LYS 119 Cb 0.48 -2.35 0.00 0.00 0.02 0.00 0.00 35.03 33.18 1lua n LYS 119 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lua n GLY 120 N 0.83 1.78 3.87 3.14 0.00 -1.00 -4.87 105.19 108.94 1lua n GLY 120 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1lua n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lua s LYS 121 N 0.00 3.75 -0.06 1.61 -0.14 -0.81 -4.71 119.74 119.39 1lua s LYS 121 Ca 0.00 0.63 -0.19 0.00 -1.36 0.00 0.00 55.97 55.05 1lua s LYS 121 Cb 0.00 -2.24 -0.05 0.00 -1.68 0.00 0.00 37.83 33.86 1lua s LYS 121 CO 0.00 -0.25 0.54 0.21 -0.76 0.00 0.00 175.35 175.09 1lua s LYS 122 N -4.35 4.30 -0.03 1.68 2.20 -1.26 -0.11 119.74 122.17 1lua s LYS 122 Ca 0.54 0.59 0.04 0.00 -0.36 0.00 0.00 55.97 56.78 1lua s LYS 122 Cb -0.10 -3.38 -0.00 0.00 -1.51 0.00 0.00 37.83 32.83 1lua s LYS 122 CO 0.38 0.28 -0.14 0.00 -0.36 0.00 0.00 175.35 175.52 1lua s ALA 123 N 0.17 1.20 -0.14 3.13 0.00 0.13 -1.39 121.76 124.85 1lua s ALA 123 Ca 0.29 -0.56 0.01 0.00 0.00 0.00 0.00 51.96 51.70 1lua s ALA 123 Cb -0.17 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.60 1lua s ALA 123 CO 0.14 0.24 -0.18 0.08 0.00 0.00 0.00 175.76 176.05 1lua s VAL 124 N -0.07 1.76 -0.33 0.00 1.01 -0.41 -1.59 120.40 120.78 1lua s VAL 124 Ca 0.00 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.13 1lua s VAL 124 Cb -0.08 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.72 1lua s VAL 124 CO 0.01 0.49 0.11 -0.69 0.00 0.00 0.00 175.10 175.02 1lua s VAL 125 N 1.12 4.00 0.17 2.92 1.01 -0.86 -0.91 120.40 127.84 1lua s VAL 125 Ca -0.02 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 1lua s VAL 125 Cb -0.14 -3.17 -0.08 0.00 0.00 0.00 0.00 36.38 32.99 1lua s VAL 125 CO -0.06 -0.08 0.72 -0.76 0.00 0.00 0.00 175.10 174.92 1lua s LEU 126 N 1.47 4.50 -1.47 3.92 1.43 0.49 -1.70 118.68 127.32 1lua s LEU 126 Ca 0.01 1.49 -0.10 0.00 -1.03 0.00 0.00 54.13 54.50 1lua s LEU 126 Cb -0.18 -3.31 0.06 0.00 0.03 0.00 0.00 46.19 42.79 1lua s LEU 126 CO 0.03 0.17 0.89 0.00 0.23 0.00 0.00 176.35 177.66 1lua n ALA 127 N 1.33 -1.51 0.98 4.21 0.00 -0.98 -1.53 120.51 123.01 1lua n ALA 127 Ca -0.06 0.08 0.02 0.00 0.00 0.00 0.00 53.44 53.48 1lua n ALA 127 Cb 0.50 -3.68 0.08 0.00 0.00 0.00 0.00 19.45 16.34 1lua n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lua n GLY 128 N -1.67 0.94 0.05 0.00 0.00 -0.43 -4.10 105.19 99.98 1lua n GLY 128 Ca -0.06 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 45.91 1lua n GLY 128 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1lua n THR 129 N 0.06 0.00 -2.36 2.61 -2.24 -1.26 -2.57 114.28 108.52 1lua n THR 129 Ca 0.06 -0.03 -0.25 0.00 -2.27 0.00 0.00 64.05 61.56 1lua n THR 129 Cb 0.32 -0.06 0.10 0.00 -2.10 0.00 0.00 70.33 68.58 1lua n THR 129 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1lua s GLY 130 N -2.81 1.75 0.26 3.38 0.00 -1.26 -4.83 107.32 103.81 1lua s GLY 130 Ca 0.18 -1.32 -0.03 0.00 0.00 0.00 0.00 44.72 43.55 1lua s GLY 130 CO 0.57 -0.81 1.88 -0.56 0.00 0.00 0.00 173.10 174.18 1lua h PRO 131 N -0.65 1.11 -0.39 2.90 0.13 -1.95 -0.30 132.00 132.85 1lua h PRO 131 Ca -0.41 -0.07 -0.14 0.00 -0.87 0.00 0.00 66.00 64.51 1lua h PRO 131 Cb 1.28 -0.25 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 1lua h PRO 131 CO 0.48 0.73 -0.30 0.28 -0.23 0.00 0.00 178.00 178.96 1lua h VAL 132 N 1.14 1.28 -0.44 1.56 2.07 -1.92 -1.41 116.25 118.52 1lua h VAL 132 Ca 0.41 -1.47 -0.07 0.00 0.82 0.00 0.00 66.70 66.39 1lua h VAL 132 Cb 0.14 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1lua h VAL 132 CO -0.17 0.49 -0.00 1.23 0.02 0.00 0.00 177.57 179.14 1lua h GLY 133 N 0.70 0.85 0.86 2.17 0.00 -1.70 0.67 103.07 106.62 1lua h GLY 133 Ca 0.07 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 46.74 1lua h GLY 133 CO 0.08 0.58 0.04 -0.33 0.00 0.00 0.00 176.54 176.91 1lua h MET 134 N 0.63 0.39 -0.37 4.80 2.86 -0.78 0.15 114.93 122.60 1lua h MET 134 Ca 0.13 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.61 1lua h MET 134 Cb 0.50 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 1lua h MET 134 CO 0.02 0.53 0.01 0.00 1.06 0.00 0.00 176.91 178.53 1lua h ARG 135 N 0.20 0.59 -0.27 1.72 2.47 -1.23 -0.70 114.38 117.15 1lua h ARG 135 Ca 0.07 -0.13 -0.04 0.00 -1.26 0.00 0.00 59.98 58.62 1lua h ARG 135 Cb 0.32 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.55 1lua h ARG 135 CO 0.00 0.61 0.02 0.77 0.56 0.00 0.00 179.97 181.94 1lua h SER 136 N 0.56 0.44 -0.80 7.04 0.02 -0.43 -1.83 113.55 118.55 1lua h SER 136 Ca 0.12 -0.28 0.06 0.00 -0.84 0.00 0.00 61.79 60.85 1lua h SER 136 Cb 0.35 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.71 1lua h SER 136 CO 0.01 0.61 0.49 0.00 -1.14 0.00 0.00 176.83 176.80 1lua h ALA 137 N 0.84 1.09 -0.38 3.77 0.00 -0.42 -1.21 119.26 122.95 1lua h ALA 137 Ca 0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1lua h ALA 137 Cb 0.37 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1lua h ALA 137 CO 0.01 0.22 0.20 0.00 0.00 0.00 0.00 179.25 179.68 1lua h ALA 138 N 1.38 0.49 -0.18 0.00 0.00 -0.93 -0.59 119.26 119.44 1lua h ALA 138 Ca 0.35 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 55.00 1lua h ALA 138 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1lua h ALA 138 CO -0.17 0.03 -0.57 -0.07 0.00 0.00 0.00 179.25 178.47 1lua h LEU 139 N 0.49 0.63 -0.21 0.00 3.38 -1.00 -1.02 115.31 117.58 1lua h LEU 139 Ca 0.13 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1lua h LEU 139 Cb 0.08 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1lua h LEU 139 CO -0.02 1.07 0.04 -0.07 0.09 0.00 0.00 178.44 179.55 1lua h LEU 140 N 0.43 0.33 -1.12 1.67 3.38 -1.15 -2.12 115.31 116.73 1lua h LEU 140 Ca 0.00 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.74 1lua h LEU 140 Cb 1.12 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.74 1lua h LEU 140 CO 0.11 0.49 0.59 0.00 0.09 0.00 0.00 178.44 179.72 1lua h ALA 141 N 0.85 1.38 0.00 1.53 0.00 -1.01 0.15 119.26 122.16 1lua h ALA 141 Ca 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1lua h ALA 141 Cb 0.30 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1lua h ALA 141 CO 0.00 0.56 -0.09 0.78 0.00 0.00 0.00 179.25 180.50 1lua h GLY 142 N 1.19 0.00 0.22 0.00 0.00 -0.96 -1.08 103.07 102.44 1lua h GLY 142 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1lua h GLY 142 CO -0.08 0.00 -0.06 1.18 0.00 0.00 0.00 176.54 177.58 1lua n GLU 143 N -3.47 1.21 0.00 4.80 -0.58 0.50 -4.93 120.64 118.17 1lua n GLU 143 Ca -0.01 -0.55 0.00 0.00 -0.42 0.00 0.00 57.16 56.18 1lua n GLU 143 Cb 0.24 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.62 1lua n GLU 143 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1lua n GLY 144 N 1.18 0.12 3.77 0.62 0.00 -0.41 -3.72 105.19 106.75 1lua n GLY 144 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1lua n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lua s ALA 145 N -2.00 2.59 -0.42 4.61 0.00 -1.09 -2.37 121.76 123.08 1lua s ALA 145 Ca 0.00 0.80 -0.25 0.00 0.00 0.00 0.00 51.96 52.51 1lua s ALA 145 Cb 0.00 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.77 1lua s ALA 145 CO 0.00 -1.01 0.89 -1.21 0.00 0.00 0.00 175.76 174.43 1lua s GLU 146 N -3.50 3.63 -0.11 0.00 2.02 0.84 -4.42 118.70 117.16 1lua s GLU 146 Ca 0.72 0.26 -0.03 0.00 0.02 0.00 0.00 54.97 55.94 1lua s GLU 146 Cb -0.25 -3.88 -0.03 0.00 0.10 0.00 0.00 34.13 30.07 1lua s GLU 146 CO 0.32 -1.08 0.02 0.08 0.02 0.00 0.00 175.26 174.61 1lua s VAL 147 N 3.53 4.42 -0.21 2.63 1.01 -1.26 0.17 120.40 130.69 1lua s VAL 147 Ca 0.36 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.16 1lua s VAL 147 Cb -0.11 -2.89 0.04 0.00 0.00 0.00 0.00 36.38 33.41 1lua s VAL 147 CO 0.23 0.57 -0.13 -0.69 0.00 0.00 0.00 175.10 175.07 1lua s VAL 148 N -0.52 1.91 -0.30 2.92 1.01 -0.62 -2.01 120.40 122.79 1lua s VAL 148 Ca 0.09 -1.15 -0.15 0.00 0.00 0.00 0.00 61.98 60.77 1lua s VAL 148 Cb -0.12 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 1lua s VAL 148 CO 0.02 0.23 0.36 -0.22 0.00 0.00 0.00 175.10 175.49 1lua s LEU 149 N 1.29 4.17 0.19 3.92 0.20 0.81 -2.04 118.68 127.22 1lua s LEU 149 Ca -0.01 0.08 0.06 0.00 0.69 0.00 0.00 54.13 54.95 1lua s LEU 149 Cb -0.16 -2.38 -0.04 0.00 -0.43 0.00 0.00 46.19 43.18 1lua s LEU 149 CO -0.09 -0.24 0.13 0.00 -0.29 0.00 0.00 176.35 175.87 1lua s GLY 151 N -3.26 -0.35 0.33 0.00 0.00 -1.03 -1.31 107.32 101.70 1lua s GLY 151 Ca 0.31 0.47 0.02 0.00 0.00 0.00 0.00 44.72 45.52 1lua s GLY 151 CO 0.23 0.14 1.97 3.21 0.00 0.00 0.00 173.10 178.66 1lua h ARG 152 N 2.00 0.89 -5.26 2.90 3.08 -1.88 0.23 114.38 116.34 1lua h ARG 152 Ca -0.24 -0.05 -0.67 0.00 0.07 0.00 0.00 59.98 59.09 1lua h ARG 152 Cb 1.24 -0.20 -0.31 0.00 0.08 0.00 0.00 29.97 30.78 1lua h ARG 152 CO 0.29 0.59 -0.83 0.15 -1.07 0.00 0.00 179.97 179.10 1lua s LYS 153 N -5.79 3.17 0.30 0.04 1.02 -1.26 -3.89 119.74 113.33 1lua s LYS 153 Ca -0.11 -0.79 0.04 0.00 0.02 0.00 0.00 55.97 55.13 1lua s LYS 153 Cb 0.18 -2.50 0.64 0.00 -0.52 0.00 0.00 37.83 35.64 1lua s LYS 153 CO 0.78 0.10 1.83 1.25 -0.92 0.00 0.00 175.35 178.38 1lua h LEU 154 N 7.02 0.85 -0.37 3.17 5.85 -1.87 -2.15 115.31 127.81 1lua h LEU 154 Ca -0.27 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1lua h LEU 154 Cb 1.21 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 1lua h LEU 154 CO 0.54 0.42 0.19 -2.24 -0.34 0.00 0.00 178.44 177.01 1lua h ASP 155 N 0.90 0.47 -0.49 1.25 3.04 -1.97 0.18 116.42 119.80 1lua h ASP 155 Ca 0.51 -0.10 -0.10 0.00 -3.24 0.00 0.00 57.03 54.10 1lua h ASP 155 Cb 0.63 -0.12 -0.02 0.00 -1.04 0.00 0.00 39.33 38.78 1lua h ASP 155 CO -0.28 0.44 -0.06 0.50 -2.04 0.00 0.00 179.24 177.80 1lua h LYS 156 N 0.47 0.95 -0.56 4.15 3.64 -1.94 -0.40 116.57 122.88 1lua h LYS 156 Ca 0.13 -0.31 -0.07 0.00 -1.27 0.00 0.00 60.65 59.13 1lua h LYS 156 Cb 0.08 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1lua h LYS 156 CO -0.02 0.97 0.09 0.00 -2.27 0.00 0.00 179.45 178.22 1lua h ALA 157 N 1.06 0.75 -0.18 5.00 0.00 -1.09 -1.72 119.26 123.08 1lua h ALA 157 Ca 0.15 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1lua h ALA 157 Cb 0.59 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1lua h ALA 157 CO 0.04 0.50 -0.49 0.37 0.00 0.00 0.00 179.25 179.66 1lua h GLN 158 N 0.83 0.49 -0.70 0.00 5.75 -0.44 -2.34 115.11 118.69 1lua h GLN 158 Ca 0.17 -0.28 -0.03 0.00 -0.15 0.00 0.00 58.65 58.36 1lua h GLN 158 Cb 0.42 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.96 1lua h GLN 158 CO 0.01 0.87 0.32 0.00 -2.65 0.00 0.00 178.83 177.38 1lua h ALA 159 N 1.08 0.90 -0.47 3.38 0.00 -0.82 -0.74 119.26 122.60 1lua h ALA 159 Ca 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1lua h ALA 159 Cb 1.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1lua h ALA 159 CO 0.09 0.49 0.20 0.00 0.00 0.00 0.00 179.25 180.03 1lua h ALA 160 N 1.15 0.61 -0.64 0.00 0.00 -1.14 -0.33 119.26 118.92 1lua h ALA 160 Ca 0.24 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1lua h ALA 160 Cb 0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1lua h ALA 160 CO -0.03 0.21 0.10 0.00 0.00 0.00 0.00 179.25 179.53 1lua h ALA 161 N 1.04 0.84 -0.66 0.00 0.00 -1.15 -1.05 119.26 118.29 1lua h ALA 161 Ca 0.16 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1lua h ALA 161 Cb 0.17 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1lua h ALA 161 CO -0.02 0.61 0.41 -0.44 0.00 0.00 0.00 179.25 179.81 1lua h ASP 162 N 0.97 0.79 -0.01 0.00 3.45 -0.85 0.25 116.42 121.02 1lua h ASP 162 Ca 0.19 -0.05 -0.00 0.00 0.43 0.00 0.00 57.03 57.60 1lua h ASP 162 Cb 0.44 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 39.01 1lua h ASP 162 CO 0.01 0.61 0.01 -1.28 -1.57 0.00 0.00 179.24 177.01 1lua h SER 163 N 0.90 0.01 -0.50 6.45 0.87 -0.74 -1.58 113.55 118.96 1lua h SER 163 Ca 0.24 -0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1lua h SER 163 Cb -0.04 -0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 1lua h SER 163 CO -0.05 0.12 0.32 0.58 -0.53 0.00 0.00 176.83 177.28 1lua h VAL 164 N -0.10 1.12 -0.51 2.23 2.07 -0.99 -2.32 116.25 117.76 1lua h VAL 164 Ca 0.00 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.32 1lua h VAL 164 Cb 0.11 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 1lua h VAL 164 CO -0.00 0.12 0.30 0.78 0.02 0.00 0.00 177.57 178.79 1lua h ASN 165 N 0.66 0.49 -0.19 0.57 2.35 -0.29 -1.12 115.58 118.05 1lua h ASN 165 Ca 0.18 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 1lua h ASN 165 Cb -0.06 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1lua h ASN 165 CO -0.05 0.35 0.00 0.50 -1.65 0.00 0.00 177.43 176.58 1lua h LYS 166 N 0.61 0.33 -0.62 0.81 3.64 -1.17 0.40 116.57 120.57 1lua h LYS 166 Ca 0.20 -0.11 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 1lua h LYS 166 Cb 0.02 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1lua h LYS 166 CO -0.09 0.54 0.09 -0.09 -2.27 0.00 0.00 179.45 177.63 1lua h ARG 167 N 0.09 1.04 -0.12 1.90 9.65 -1.32 -3.26 114.38 122.36 1lua h ARG 167 Ca 0.05 -0.29 0.00 0.00 -1.10 0.00 0.00 59.98 58.65 1lua h ARG 167 Cb 0.38 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 1lua h ARG 167 CO 0.01 0.97 0.00 1.19 2.80 0.00 0.00 179.97 184.94 1lua n PHE 168 N -4.26 0.15 -3.47 2.20 3.01 -0.44 -5.02 117.46 109.63 1lua n PHE 168 Ca 0.03 -0.12 -0.22 0.00 1.01 0.00 0.00 57.45 58.15 1lua n PHE 168 Cb 0.29 -0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.80 1lua n PHE 168 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1lua n LYS 169 N 0.82 -1.57 -3.61 -1.08 5.02 0.14 -5.01 118.16 112.86 1lua n LYS 169 Ca 0.10 0.73 -0.15 0.00 -2.02 0.00 0.00 58.31 56.98 1lua n LYS 169 Cb 0.39 -4.77 -0.05 0.00 -0.02 0.00 0.00 35.03 30.58 1lua n LYS 169 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1lua n VAL 170 N -3.49 0.00 -3.57 -0.18 0.24 -1.11 -5.06 118.33 105.17 1lua n VAL 170 Ca -0.09 -1.71 -0.28 0.00 -2.04 0.00 0.00 64.34 60.23 1lua n VAL 170 Cb 0.59 0.78 -0.11 0.00 -1.47 0.00 0.00 33.84 33.63 1lua n VAL 170 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1lua s ASN 171 N -2.68 2.70 0.19 -1.34 2.47 -1.26 -4.60 114.94 110.41 1lua s ASN 171 Ca 0.24 -3.12 -0.15 0.00 0.42 0.00 0.00 52.86 50.26 1lua s ASN 171 Cb 0.01 -0.80 -0.07 0.00 -1.45 0.00 0.00 41.25 38.93 1lua s ASN 171 CO 0.17 -0.18 0.60 -0.69 -3.72 0.00 0.00 177.10 173.28 1lua s VAL 172 N -0.17 4.79 0.29 -5.21 1.01 -1.26 -4.75 120.40 115.10 1lua s VAL 172 Ca 0.27 0.88 0.10 0.00 0.00 0.00 0.00 61.98 63.24 1lua s VAL 172 Cb -0.05 -3.73 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1lua s VAL 172 CO -0.14 0.16 -0.06 0.42 0.00 0.00 0.00 175.10 175.47 1lua s THR 173 N -1.57 2.95 0.43 3.92 -4.23 -0.85 -4.84 115.64 111.45 1lua s THR 173 Ca 0.41 -2.09 0.06 0.00 -1.18 0.00 0.00 61.69 58.90 1lua s THR 173 Cb -0.14 -2.66 -0.05 0.00 1.34 0.00 0.00 72.50 70.99 1lua s THR 173 CO 0.20 -0.34 0.14 0.00 -0.54 0.00 0.00 174.62 174.07 1lua s ALA 174 N -2.43 3.60 -0.20 3.99 0.00 -1.26 -0.14 121.76 125.33 1lua s ALA 174 Ca 0.32 -1.93 -0.27 0.00 0.00 0.00 0.00 51.96 50.08 1lua s ALA 174 Cb -0.04 -0.24 0.08 0.00 0.00 0.00 0.00 23.12 22.91 1lua s ALA 174 CO 0.18 -0.16 0.74 0.00 0.00 0.00 0.00 175.76 176.52 1lua s ALA 175 N -2.67 -1.80 -0.05 0.00 0.00 -0.63 -4.81 121.76 111.81 1lua s ALA 175 Ca 0.36 1.78 -0.17 0.00 0.00 0.00 0.00 51.96 53.94 1lua s ALA 175 Cb 0.05 -0.82 -0.05 0.00 0.00 0.00 0.00 23.12 22.30 1lua s ALA 175 CO 0.19 -0.34 0.45 -2.00 0.00 0.00 0.00 175.76 174.06 1lua s GLU 176 N -0.17 4.14 -0.34 0.00 2.12 -1.26 -2.46 118.70 120.74 1lua s GLU 176 Ca -0.03 0.45 0.00 0.00 0.36 0.00 0.00 54.97 55.75 1lua s GLU 176 Cb -0.03 -3.32 0.14 0.00 0.26 0.00 0.00 34.13 31.18 1lua s GLU 176 CO 0.03 0.45 0.25 0.95 -0.54 0.00 0.00 175.26 176.41 1lua s THR 177 N -0.33 -0.11 -0.10 -1.70 -4.23 0.80 -4.90 115.64 105.07 1lua s THR 177 Ca 0.25 -1.16 0.21 0.00 -1.18 0.00 0.00 61.69 59.81 1lua s THR 177 Cb -0.16 -0.95 0.20 0.00 1.34 0.00 0.00 72.50 72.93 1lua s THR 177 CO 0.12 -0.76 1.64 0.00 -0.54 0.00 0.00 174.62 175.09 1lua h ALA 178 N 7.46 0.88 -2.47 3.99 0.00 -1.78 -3.23 119.26 124.10 1lua h ALA 178 Ca -0.02 -0.25 -0.52 0.00 0.00 0.00 0.00 54.91 54.12 1lua h ALA 178 Cb 1.02 -0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.63 1lua h ALA 178 CO 0.29 0.34 -0.49 0.16 0.00 0.00 0.00 179.25 179.56 1lua s ASP 179 N -6.27 2.17 0.20 0.00 3.84 -1.26 -4.92 116.67 110.42 1lua s ASP 179 Ca 0.03 -1.77 -0.09 0.00 -0.00 0.00 0.00 52.55 50.72 1lua s ASP 179 Cb 0.08 0.59 0.14 0.00 -1.38 0.00 0.00 42.92 42.35 1lua s ASP 179 CO 0.68 -1.05 1.80 0.44 -0.00 0.00 0.00 175.17 177.04 1lua h ASP 180 N 1.97 0.99 0.09 2.11 3.32 -1.91 -1.77 116.42 121.21 1lua h ASP 180 Ca -0.27 -0.13 0.01 0.00 0.02 0.00 0.00 57.03 56.66 1lua h ASP 180 Cb 1.25 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 1lua h ASP 180 CO 0.41 0.84 -0.17 0.00 -1.72 0.00 0.00 179.24 178.60 1lua h ALA 181 N 1.19 -0.28 -0.88 3.45 0.00 -1.96 0.12 119.26 120.89 1lua h ALA 181 Ca 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1lua h ALA 181 Cb 0.11 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1lua h ALA 181 CO -0.03 -0.70 0.52 0.66 0.00 0.00 0.00 179.25 179.71 1lua h SER 182 N -0.33 1.06 -0.08 0.00 4.64 -1.92 -0.91 113.55 116.01 1lua h SER 182 Ca 0.03 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 1lua h SER 182 Cb 0.36 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1lua h SER 182 CO -0.11 0.82 0.02 0.03 -0.87 0.00 0.00 176.83 176.73 1lua h ARG 183 N 1.21 0.18 -0.19 4.77 3.08 -0.43 -1.10 114.38 121.90 1lua h ARG 183 Ca 0.32 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 60.17 1lua h ARG 183 Cb -0.04 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 1lua h ARG 183 CO -0.06 0.18 -0.58 0.00 -1.07 0.00 0.00 179.97 178.44 1lua h ALA 184 N 1.85 0.62 -0.19 0.04 0.00 0.58 -3.13 119.26 119.02 1lua h ALA 184 Ca 0.05 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1lua h ALA 184 Cb 0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1lua h ALA 184 CO -0.00 0.69 -0.11 0.93 0.00 0.00 0.00 179.25 180.77 1lua h GLU 185 N 0.47 0.41 -0.28 0.00 4.39 -0.65 -3.15 114.58 115.77 1lua h GLU 185 Ca 0.00 -0.19 0.08 0.00 0.34 0.00 0.00 59.36 59.59 1lua h GLU 185 Cb 1.14 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 1lua h GLU 185 CO 0.11 0.72 0.20 0.00 -1.16 0.00 0.00 179.01 178.88 1lua h ALA 186 N 0.69 2.25 0.00 3.43 0.00 -1.27 -1.05 119.26 123.30 1lua h ALA 186 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1lua h ALA 186 Cb 0.60 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1lua h ALA 186 CO 0.03 -0.32 0.00 0.28 0.00 0.00 0.00 179.25 179.24 1lua h VAL 187 N 0.02 0.00 -2.82 0.00 2.07 -1.50 -3.45 116.25 110.57 1lua h VAL 187 Ca 0.13 -0.64 -0.53 0.00 0.82 0.00 0.00 66.70 66.48 1lua h VAL 187 Cb 0.51 1.61 0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1lua h VAL 187 CO -0.00 0.00 0.89 -0.54 0.02 0.00 0.00 177.57 177.93 1lua s LYS 188 N -3.36 4.25 0.00 1.57 1.02 -0.40 -2.30 119.74 120.51 1lua s LYS 188 Ca 0.05 2.19 0.00 0.00 0.02 0.00 0.00 55.97 58.23 1lua s LYS 188 Cb 0.08 -3.47 0.00 0.00 -0.52 0.00 0.00 37.83 33.93 1lua s LYS 188 CO 0.58 -0.62 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 1lua n GLY 189 N 3.77 0.88 3.85 -3.33 0.00 -1.26 -5.05 105.19 104.05 1lua n GLY 189 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1lua n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lua s ALA 190 N -2.37 3.28 -0.08 4.61 0.00 -0.97 -4.75 121.76 121.48 1lua s ALA 190 Ca 0.00 0.03 0.18 0.00 0.00 0.00 0.00 51.96 52.17 1lua s ALA 190 Cb 0.00 -2.82 -0.27 0.00 0.00 0.00 0.00 23.12 20.04 1lua s ALA 190 CO 0.00 0.18 0.28 0.72 0.00 0.00 0.00 175.76 176.94 1lua n HIS 191 N -0.72 0.00 -4.07 0.00 8.25 -0.49 -2.22 115.22 115.97 1lua n HIS 191 Ca 0.04 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.33 1lua n HIS 191 Cb 0.53 -0.60 -0.15 0.00 1.12 0.00 0.00 29.99 30.89 1lua n HIS 191 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1lua s PHE 192 N -2.98 0.46 -0.09 4.41 0.40 -1.10 -0.13 117.98 118.96 1lua s PHE 192 Ca -0.08 -0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.17 1lua s PHE 192 Cb 0.09 -0.41 0.02 0.00 0.51 0.00 0.00 43.02 43.24 1lua s PHE 192 CO 0.77 -0.09 -0.07 0.08 0.70 0.00 0.00 175.22 176.60 1lua s VAL 193 N 0.51 0.90 -0.05 -0.44 1.01 -0.79 -1.29 120.40 120.25 1lua s VAL 193 Ca -0.06 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.71 1lua s VAL 193 Cb -0.09 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1lua s VAL 193 CO -0.01 0.33 -0.15 -0.36 0.00 0.00 0.00 175.10 174.92 1lua s PHE 194 N 1.43 2.69 -0.28 5.22 0.40 -0.09 -1.34 117.98 126.01 1lua s PHE 194 Ca -0.01 -0.18 -0.02 0.00 -0.60 0.00 0.00 56.93 56.12 1lua s PHE 194 Cb -0.13 -1.63 0.04 0.00 0.51 0.00 0.00 43.02 41.80 1lua s PHE 194 CO -0.04 0.17 -0.01 0.95 0.70 0.00 0.00 175.22 176.99 1lua s THR 195 N -0.70 3.05 -0.43 0.64 -4.23 -0.62 -0.38 115.64 112.97 1lua s THR 195 Ca 0.11 -1.21 0.04 0.00 -1.18 0.00 0.00 61.69 59.45 1lua s THR 195 Cb -0.11 -2.67 0.45 0.00 1.34 0.00 0.00 72.50 71.51 1lua s THR 195 CO 0.01 0.00 1.42 0.00 -0.54 0.00 0.00 174.62 175.51 1lua n ALA 196 N 4.66 5.41 -1.70 3.99 0.00 -0.58 -2.05 120.51 130.23 1lua n ALA 196 Ca -0.14 -3.81 -0.30 0.00 0.00 0.00 0.00 53.44 49.18 1lua n ALA 196 Cb 0.45 -0.77 0.06 0.00 0.00 0.00 0.00 19.45 19.19 1lua n ALA 196 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1lua s GLY 197 N -3.05 1.64 0.96 0.00 0.00 -1.26 -4.65 107.32 100.96 1lua s GLY 197 Ca 0.54 -0.20 -0.11 0.00 0.00 0.00 0.00 44.72 44.95 1lua s GLY 197 CO -0.03 0.18 0.90 0.00 0.00 0.00 0.00 173.10 174.15 1lua n ALA 198 N -3.17 -1.62 -1.76 3.20 0.00 -1.26 -4.65 120.51 111.25 1lua n ALA 198 Ca 0.07 -0.66 -0.42 0.00 0.00 0.00 0.00 53.44 52.43 1lua n ALA 198 Cb 0.56 -2.05 -0.02 0.00 0.00 0.00 0.00 19.45 17.94 1lua n ALA 198 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1lua s ILE 199 N -2.54 2.07 -0.36 0.00 2.07 -1.26 -3.62 121.20 117.55 1lua s ILE 199 Ca 0.64 0.05 -0.00 0.00 -1.41 0.00 0.00 60.65 59.93 1lua s ILE 199 Cb -0.22 -3.03 0.00 0.00 0.13 0.00 0.00 42.46 39.33 1lua s ILE 199 CO 0.62 0.01 0.05 0.61 -1.91 0.00 0.00 174.94 174.31 1lua n GLY 200 N 2.67 0.28 3.11 1.50 0.00 -1.21 -5.03 105.19 106.50 1lua n GLY 200 Ca 0.10 -0.66 -0.17 0.00 0.00 0.00 0.00 46.02 45.30 1lua n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lua s LEU 201 N -1.50 2.20 -0.03 0.99 1.02 -1.13 -4.28 118.68 115.95 1lua s LEU 201 Ca 0.03 -0.48 -0.03 0.00 0.02 0.00 0.00 54.13 53.67 1lua s LEU 201 Cb -0.01 -0.42 -0.04 0.00 0.02 0.00 0.00 46.19 45.74 1lua s LEU 201 CO 0.03 -0.06 0.14 -0.70 0.02 0.00 0.00 176.35 175.79 1lua s GLU 202 N -1.29 3.32 0.00 1.70 2.12 -1.25 -2.91 118.70 120.39 1lua s GLU 202 Ca -0.03 -0.34 0.00 0.00 0.36 0.00 0.00 54.97 54.97 1lua s GLU 202 Cb -0.08 -3.04 0.00 0.00 0.26 0.00 0.00 34.13 31.27 1lua s GLU 202 CO 0.01 0.69 0.00 1.28 -0.54 0.00 0.00 175.26 176.70 1lua n LEU 203 N 1.21 0.00 -3.46 2.70 4.77 -0.48 -4.96 117.00 116.77 1lua n LEU 203 Ca -0.13 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.60 1lua n LEU 203 Cb 0.53 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.50 1lua n LEU 203 CO 0.40 0.00 -0.28 -0.22 -1.33 0.00 0.00 177.39 175.96 1lua s LEU 204 N -2.13 0.47 1.01 2.23 2.96 -0.72 -4.90 118.68 117.60 1lua s LEU 204 Ca 0.00 -1.55 -0.11 0.00 -0.22 0.00 0.00 54.13 52.26 1lua s LEU 204 Cb 0.00 -0.09 0.20 0.00 0.50 0.00 0.00 46.19 46.80 1lua s LEU 204 CO 0.00 -0.36 1.11 -2.84 -1.32 0.00 0.00 176.35 172.93 1lua s PRO 205 N 1.70 0.26 0.31 0.98 0.02 -1.26 -1.88 135.00 135.13 1lua s PRO 205 Ca 0.13 1.33 0.06 0.00 0.02 0.00 0.00 61.00 62.54 1lua s PRO 205 Cb -0.18 -1.66 0.71 0.00 0.02 0.00 0.00 34.50 33.40 1lua s PRO 205 CO -0.19 -3.08 1.82 0.37 -0.33 0.00 0.00 177.00 175.59 1lua h GLN 206 N -2.18 0.79 0.53 5.54 4.15 -1.94 -2.42 115.11 119.58 1lua h GLN 206 Ca -0.50 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 58.85 1lua h GLN 206 Cb 1.29 -0.18 0.01 0.00 0.21 0.00 0.00 27.48 28.81 1lua h GLN 206 CO 0.44 0.52 -0.26 0.00 -1.93 0.00 0.00 178.83 177.61 1lua h ALA 207 N 1.60 -0.72 -1.05 3.38 0.00 -1.90 -1.14 119.26 119.42 1lua h ALA 207 Ca 0.52 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 55.57 1lua h ALA 207 Cb 0.75 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 1lua h ALA 207 CO -0.30 -0.88 1.03 0.00 0.00 0.00 0.00 179.25 179.11 1lua h ALA 208 N -0.32 2.93 0.00 0.00 0.00 -1.78 -2.24 119.26 117.86 1lua h ALA 208 Ca -0.07 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1lua h ALA 208 Cb 0.57 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1lua h ALA 208 CO 0.12 -1.57 -1.27 -2.67 0.00 0.00 0.00 179.25 173.85 1lua n TRP 209 N -3.55 0.00 0.13 0.00 4.27 -1.15 -4.73 117.44 112.41 1lua n TRP 209 Ca 0.23 0.00 -0.01 0.00 -3.89 0.00 0.00 57.50 53.83 1lua n TRP 209 Cb 1.36 -0.18 0.25 0.00 -1.36 0.00 0.00 31.31 31.38 1lua n TRP 209 CO 0.00 0.00 0.00 0.37 -2.29 0.00 0.00 177.69 175.77 1lua h GLN 210 N 0.00 0.12 -0.70 -2.67 4.15 -0.60 -3.12 115.11 112.30 1lua h GLN 210 Ca -0.09 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.21 1lua h GLN 210 Cb 0.98 -0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.64 1lua h GLN 210 CO 0.00 0.55 0.08 0.09 -1.93 0.00 0.00 178.83 177.62 1lua n ASN 211 N -4.00 4.78 -4.12 -0.69 3.02 -1.09 -4.73 115.26 108.43 1lua n ASN 211 Ca -0.02 -2.86 -0.37 0.00 -0.03 0.00 0.00 54.58 51.30 1lua n ASN 211 Cb 0.49 -0.68 -0.09 0.00 -0.61 0.00 0.00 39.78 38.89 1lua n ASN 211 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1lua s GLU 212 N -2.52 2.53 0.27 3.52 2.56 -1.18 -4.97 118.70 118.92 1lua s GLU 212 Ca 0.46 -2.36 0.11 0.00 0.00 0.00 0.00 54.97 53.18 1lua s GLU 212 Cb 0.36 -3.76 0.91 0.00 2.00 0.00 0.00 34.13 33.63 1lua s GLU 212 CO 0.13 -1.16 1.24 0.45 -0.56 0.00 0.00 175.26 175.35 1lua n SER 213 N 3.78 0.15 -0.01 -1.70 2.88 -1.26 -0.90 113.62 116.56 1lua n SER 213 Ca 0.06 1.31 0.01 0.00 -1.33 0.00 0.00 58.87 58.92 1lua n SER 213 Cb 0.39 -0.59 0.33 0.00 -0.75 0.00 0.00 64.21 63.60 1lua n SER 213 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1lua h SER 214 N 0.00 0.51 -2.36 -3.46 4.64 -1.93 -3.44 113.55 107.51 1lua h SER 214 Ca 0.60 -0.06 -0.53 0.00 -0.47 0.00 0.00 61.79 61.33 1lua h SER 214 Cb 1.50 -0.13 0.02 0.00 -0.31 0.00 0.00 62.40 63.48 1lua h SER 214 CO -0.65 0.50 1.24 -0.63 -0.87 0.00 0.00 176.83 176.42 1lua s ILE 215 N -5.20 3.03 -0.25 0.95 1.01 -0.08 -4.23 121.20 116.43 1lua s ILE 215 Ca -0.08 0.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.49 1lua s ILE 215 Cb 0.16 -3.02 -0.15 0.00 0.01 0.00 0.00 42.46 39.45 1lua s ILE 215 CO 0.76 -0.00 -0.17 -0.62 0.00 0.00 0.00 174.94 174.91 1lua n GLU 216 N 7.59 0.61 -4.04 2.79 1.02 0.81 -4.43 120.64 124.99 1lua n GLU 216 Ca 0.20 0.30 -0.13 0.00 -0.02 0.00 0.00 57.16 57.51 1lua n GLU 216 Cb 0.41 -1.56 -0.13 0.00 -0.02 0.00 0.00 31.44 30.14 1lua n GLU 216 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1lua s ILE 217 N -2.49 0.29 0.03 -3.67 1.01 -1.10 -1.63 121.20 113.64 1lua s ILE 217 Ca -0.35 -0.41 0.09 0.00 0.00 0.00 0.00 60.65 59.97 1lua s ILE 217 Cb 0.11 -0.30 -0.03 0.00 0.01 0.00 0.00 42.46 42.26 1lua s ILE 217 CO 0.55 -0.08 -0.25 0.68 0.00 0.00 0.00 174.94 175.84 1lua s VAL 218 N -0.49 2.01 -0.03 2.92 -7.23 -0.54 -1.88 120.40 115.17 1lua s VAL 218 Ca -0.03 -1.27 -0.01 0.00 -1.81 0.00 0.00 61.98 58.86 1lua s VAL 218 Cb -0.04 -1.71 0.03 0.00 0.56 0.00 0.00 36.38 35.21 1lua s VAL 218 CO -0.00 0.39 0.06 0.00 -0.31 0.00 0.00 175.10 175.23 1lua s ALA 219 N -0.75 -0.03 -0.08 1.32 0.00 -0.45 -1.61 121.76 120.16 1lua s ALA 219 Ca 0.10 0.33 0.03 0.00 0.00 0.00 0.00 51.96 52.43 1lua s ALA 219 Cb -0.10 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.78 1lua s ALA 219 CO 0.01 -0.10 -0.19 0.34 0.00 0.00 0.00 175.76 175.83 1lua s ASP 220 N 0.84 2.49 0.00 0.00 2.15 -0.58 -1.60 116.67 119.98 1lua s ASP 220 Ca -0.07 -0.44 0.24 0.00 0.43 0.00 0.00 52.55 52.71 1lua s ASP 220 Cb -0.10 -1.14 0.26 0.00 -0.30 0.00 0.00 42.92 41.64 1lua s ASP 220 CO -0.03 0.10 1.24 -1.22 -0.17 0.00 0.00 175.17 175.10 1lua n TYR 221 N 3.66 0.01 -2.96 -5.34 4.02 -0.87 -1.67 117.16 114.00 1lua n TYR 221 Ca -0.21 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.27 1lua n TYR 221 Cb 0.52 -0.18 -0.05 0.00 -0.02 0.00 0.00 39.34 39.62 1lua n TYR 221 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1lua s ASN 222 N -3.02 6.79 0.00 7.72 2.47 -1.26 -4.78 114.94 122.85 1lua s ASN 222 Ca 0.10 0.98 0.23 0.00 0.42 0.00 0.00 52.86 54.59 1lua s ASN 222 Cb 0.17 -2.41 0.12 0.00 -1.45 0.00 0.00 41.25 37.68 1lua s ASN 222 CO 0.76 -0.44 1.18 0.00 -3.72 0.00 0.00 177.10 174.88 1lua n ALA 223 N 5.70 3.26 -2.96 1.71 0.00 -1.26 -4.40 120.51 122.56 1lua n ALA 223 Ca 0.03 -0.63 -0.37 0.00 0.00 0.00 0.00 53.44 52.47 1lua n ALA 223 Cb 0.48 -0.83 -0.12 0.00 0.00 0.00 0.00 19.45 18.98 1lua n ALA 223 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1lua s GLN 224 N -2.36 3.53 0.38 0.00 0.74 -1.26 -4.99 119.66 115.69 1lua s GLN 224 Ca 0.21 -0.58 -0.28 0.00 0.05 0.00 0.00 55.36 54.77 1lua s GLN 224 Cb 0.19 -3.44 -0.11 0.00 1.10 0.00 0.00 33.01 30.74 1lua s GLN 224 CO 0.50 -0.29 1.48 -2.14 -0.55 0.00 0.00 175.29 174.30 1lua s PRO 225 N 1.62 4.10 0.15 1.67 0.02 -1.26 -3.29 135.00 138.01 1lua s PRO 225 Ca 0.06 2.56 -0.31 0.00 0.02 0.00 0.00 61.00 63.33 1lua s PRO 225 Cb -0.16 -2.96 -0.08 0.00 0.02 0.00 0.00 34.50 31.31 1lua s PRO 225 CO 0.05 -0.53 1.39 -1.25 -0.33 0.00 0.00 177.00 176.33 1lua s PRO 226 N -2.10 4.32 0.70 5.54 0.04 -1.26 -4.81 135.00 137.44 1lua s PRO 226 Ca 0.53 2.11 -0.13 0.00 0.04 0.00 0.00 61.00 63.55 1lua s PRO 226 Cb -0.46 -3.21 0.02 0.00 0.04 0.00 0.00 34.50 30.88 1lua s PRO 226 CO 0.63 -0.40 1.10 -0.51 0.04 0.00 0.00 177.00 177.86 1lua s LEU 227 N 0.67 3.25 0.48 -3.56 1.43 -1.25 -2.83 118.68 116.86 1lua s LEU 227 Ca 0.62 1.93 0.13 0.00 -1.03 0.00 0.00 54.13 55.78 1lua s LEU 227 Cb -0.38 -4.54 1.11 0.00 0.03 0.00 0.00 46.19 42.41 1lua s LEU 227 CO 0.33 -1.78 2.11 1.23 0.23 0.00 0.00 176.35 178.48 1lua h GLY 228 N -0.41 0.21 -5.75 -3.19 0.00 -1.74 -3.35 103.07 88.85 1lua h GLY 228 Ca -0.45 -0.08 -0.67 0.00 0.00 0.00 0.00 47.33 46.12 1lua h GLY 228 CO 0.53 0.08 -0.83 -0.42 0.00 0.00 0.00 176.54 175.90 1lua s ILE 229 N -5.21 2.40 0.35 2.60 1.01 -1.26 -1.38 121.20 119.70 1lua s ILE 229 Ca -0.06 -0.87 -0.21 0.00 0.00 0.00 0.00 60.65 59.51 1lua s ILE 229 Cb 0.17 -1.98 -0.10 0.00 0.01 0.00 0.00 42.46 40.56 1lua s ILE 229 CO 0.69 0.53 0.87 -0.83 0.00 0.00 0.00 174.94 176.21 1lua s GLY 230 N 0.72 2.54 0.00 6.18 0.00 -0.79 -4.11 107.32 111.86 1lua s GLY 230 Ca -0.08 0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.97 1lua s GLY 230 CO 0.01 0.66 0.00 0.61 0.00 0.00 0.00 173.10 174.38 1lua n GLY 231 N -0.02 0.77 3.33 0.20 0.00 -1.26 -3.58 105.19 104.63 1lua n GLY 231 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 1lua n GLY 231 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1lua s ILE 232 N -2.17 0.39 0.06 -0.61 -4.36 -1.26 -5.09 121.20 108.17 1lua s ILE 232 Ca 0.00 -2.00 0.09 0.00 -0.26 0.00 0.00 60.65 58.48 1lua s ILE 232 Cb 0.00 -2.55 -0.03 0.00 1.25 0.00 0.00 42.46 41.13 1lua s ILE 232 CO 0.00 0.00 -0.24 -1.81 0.24 0.00 0.00 174.94 173.13 1lua s ASP 233 N -3.35 3.38 0.39 4.36 1.01 -1.26 -5.04 116.67 116.16 1lua s ASP 233 Ca 0.36 -0.58 0.17 0.00 0.71 0.00 0.00 52.55 53.22 1lua s ASP 233 Cb 0.06 -0.37 1.07 0.00 1.01 0.00 0.00 42.92 44.69 1lua s ASP 233 CO 0.16 0.24 1.78 0.00 0.21 0.00 0.00 175.17 177.56 1lua h ALA 234 N 4.51 2.18 0.00 5.23 0.00 -1.94 0.16 119.26 129.40 1lua h ALA 234 Ca -0.48 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1lua h ALA 234 Cb 1.15 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1lua h ALA 234 CO 0.44 -0.57 0.00 0.25 0.00 0.00 0.00 179.25 179.36 1lua n THR 235 N -4.64 0.77 -1.63 0.00 -2.24 -1.26 -1.28 114.28 103.99 1lua n THR 235 Ca 0.25 0.14 -0.46 0.00 -2.27 0.00 0.00 64.05 61.70 1lua n THR 235 Cb 0.84 -0.98 -0.03 0.00 -2.10 0.00 0.00 70.33 68.06 1lua n THR 235 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1lua n ASP 236 N -1.99 2.17 -3.04 3.42 8.00 0.56 -4.30 116.55 121.38 1lua n ASP 236 Ca 0.03 1.14 -0.18 0.00 0.71 0.00 0.00 54.79 56.49 1lua n ASP 236 Cb 0.25 -1.34 -0.03 0.00 -0.02 0.00 0.00 41.12 39.98 1lua n ASP 236 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1lua n LYS 237 N 1.92 0.72 0.00 -1.24 4.81 -1.20 -0.32 118.16 122.85 1lua n LYS 237 Ca 0.13 -2.69 0.00 0.00 -0.87 0.00 0.00 58.31 54.88 1lua n LYS 237 Cb 0.29 -1.31 0.00 0.00 0.02 0.00 0.00 35.03 34.03 1lua n LYS 237 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lua n GLY 238 N 1.53 0.59 3.66 3.14 0.00 0.10 -4.98 105.19 109.23 1lua n GLY 238 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1lua n GLY 238 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1lua n LYS 239 N -1.74 1.88 -2.81 1.61 4.81 -1.15 -4.45 118.16 116.30 1lua n LYS 239 Ca 0.00 0.66 -0.41 0.00 -0.87 0.00 0.00 58.31 57.70 1lua n LYS 239 Cb 0.00 -2.23 -0.04 0.00 0.02 0.00 0.00 35.03 32.78 1lua n LYS 239 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1lua s GLU 240 N -1.13 4.61 -0.47 1.64 0.41 -1.26 -1.36 118.70 121.15 1lua s GLU 240 Ca 0.62 1.31 0.08 0.00 -0.41 0.00 0.00 54.97 56.57 1lua s GLU 240 Cb -0.65 -3.39 0.27 0.00 -1.78 0.00 0.00 34.13 28.58 1lua s GLU 240 CO 0.56 0.18 0.63 0.66 -0.49 0.00 0.00 175.26 176.80 1lua n TYR 241 N 3.03 1.04 -3.49 1.61 4.02 0.11 -4.97 117.16 118.51 1lua n TYR 241 Ca 0.01 -3.78 -0.20 0.00 -0.01 0.00 0.00 57.90 53.92 1lua n TYR 241 Cb 0.50 -0.42 0.03 0.00 -0.02 0.00 0.00 39.34 39.42 1lua n TYR 241 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1lua n GLY 242 N 1.03 -1.14 0.00 2.72 0.00 -1.26 -3.44 105.19 103.09 1lua n GLY 242 Ca 0.24 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.77 1lua n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lua n GLY 243 N -1.65 2.11 3.77 -0.02 0.00 -1.26 -5.04 105.19 103.10 1lua n GLY 243 Ca -0.11 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 1lua n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lua s LYS 244 N 0.00 3.95 -0.04 1.61 3.01 -1.22 -4.98 119.74 122.07 1lua s LYS 244 Ca 0.00 1.91 0.02 0.00 -1.01 0.00 0.00 55.97 56.89 1lua s LYS 244 Cb 0.00 -2.64 -0.03 0.00 -1.01 0.00 0.00 37.83 34.15 1lua s LYS 244 CO 0.00 -0.43 -0.08 1.03 0.51 0.00 0.00 175.35 176.39 1lua s ARG 245 N -2.37 2.65 0.05 1.68 0.52 -0.65 0.05 118.95 120.89 1lua s ARG 245 Ca 0.59 -0.62 0.09 0.00 -0.52 0.00 0.00 55.73 55.26 1lua s ARG 245 Cb -0.32 -2.54 -0.03 0.00 0.52 0.00 0.00 34.95 32.58 1lua s ARG 245 CO 0.41 0.64 -0.24 0.00 0.02 0.00 0.00 175.30 176.12 1lua s ALA 246 N -0.86 2.05 -0.20 2.13 0.00 -0.46 -1.46 121.76 122.96 1lua s ALA 246 Ca 0.14 -1.20 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1lua s ALA 246 Cb -0.11 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.64 1lua s ALA 246 CO 0.03 0.47 -0.11 -0.06 0.00 0.00 0.00 175.76 176.09 1lua s PHE 247 N -0.83 2.55 0.65 0.00 0.40 -0.63 0.00 117.98 120.12 1lua s PHE 247 Ca 0.10 -1.68 -0.04 0.00 -0.60 0.00 0.00 56.93 54.71 1lua s PHE 247 Cb -0.10 -1.70 0.05 0.00 0.51 0.00 0.00 43.02 41.79 1lua s PHE 247 CO 0.02 -0.76 0.93 0.20 0.70 0.00 0.00 175.22 176.31 1lua s GLY 248 N 1.35 1.74 0.34 4.36 0.00 0.56 -1.52 107.32 114.15 1lua s GLY 248 Ca -0.02 -1.08 0.03 0.00 0.00 0.00 0.00 44.72 43.66 1lua s GLY 248 CO -0.08 -0.71 1.95 0.00 0.00 0.00 0.00 173.10 174.26 1lua h ALA 249 N -0.38 1.61 0.00 3.20 0.00 -1.24 -1.60 119.26 120.86 1lua h ALA 249 Ca -0.43 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 1lua h ALA 249 Cb 1.31 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1lua h ALA 249 CO 0.57 0.28 -0.73 -0.07 0.00 0.00 0.00 179.25 179.31 1lua h LEU 250 N 0.87 0.00 -0.77 0.00 3.38 -1.50 0.29 115.31 117.58 1lua h LEU 250 Ca 0.33 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.17 1lua h LEU 250 Cb 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1lua h LEU 250 CO -0.11 0.73 -0.48 1.23 0.09 0.00 0.00 178.44 179.90 1lua h GLY 251 N 2.88 0.36 1.00 0.83 0.00 -0.58 -1.79 103.07 105.76 1lua h GLY 251 Ca -0.01 -0.38 -0.21 0.00 0.00 0.00 0.00 47.33 46.74 1lua h GLY 251 CO 0.09 0.34 -0.79 -2.22 0.00 0.00 0.00 176.54 173.97 1lua h ILE 252 N 0.26 1.35 -0.78 2.60 1.08 -1.19 -3.28 117.51 117.54 1lua h ILE 252 Ca 0.01 -2.11 0.08 0.00 -0.39 0.00 0.00 64.86 62.46 1lua h ILE 252 Cb 0.94 2.41 -0.05 0.00 -3.07 0.00 0.00 36.82 37.05 1lua h ILE 252 CO 0.08 0.64 0.51 1.23 -0.69 0.00 0.00 178.15 179.92 1lua h GLY 253 N 0.18 1.04 0.87 5.37 0.00 -0.18 -1.87 103.07 108.48 1lua h GLY 253 Ca -0.09 -0.31 0.03 0.00 0.00 0.00 0.00 47.33 46.96 1lua h GLY 253 CO 0.16 0.20 0.50 -1.33 0.00 0.00 0.00 176.54 176.07 1lua h GLY 254 N 0.76 1.14 1.00 4.60 0.00 -1.39 -1.35 103.07 107.84 1lua h GLY 254 Ca 0.35 -0.38 -0.16 0.00 0.00 0.00 0.00 47.33 47.14 1lua h GLY 254 CO -0.13 0.32 -0.51 -2.00 0.00 0.00 0.00 176.54 174.22 1lua h LEU 255 N 0.98 0.77 -0.72 3.11 5.85 -1.55 -2.92 115.31 120.82 1lua h LEU 255 Ca 0.32 -0.58 0.11 0.00 0.84 0.00 0.00 57.88 58.57 1lua h LEU 255 Cb 0.01 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 40.74 1lua h LEU 255 CO -0.11 1.22 0.33 0.50 -0.34 0.00 0.00 178.44 180.04 1lua h LYS 256 N 0.37 0.52 -0.27 1.25 3.11 -0.97 0.33 116.57 120.91 1lua h LYS 256 Ca -0.01 -0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 57.78 1lua h LYS 256 Cb 1.13 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 32.23 1lua h LYS 256 CO 0.11 0.35 0.10 1.25 -2.81 0.00 0.00 179.45 178.45 1lua h LEU 257 N 0.54 0.38 -0.81 5.20 7.12 -1.25 -0.02 115.31 126.47 1lua h LEU 257 Ca 0.37 -0.18 -0.07 0.00 0.13 0.00 0.00 57.88 58.14 1lua h LEU 257 Cb 0.46 -0.10 -0.03 0.00 -0.53 0.00 0.00 40.66 40.46 1lua h LEU 257 CO -0.32 0.46 0.15 0.11 -0.13 0.00 0.00 178.44 178.71 1lua h LYS 258 N 0.28 1.05 -0.19 1.25 1.57 -1.18 -2.34 116.57 117.01 1lua h LYS 258 Ca 0.09 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1lua h LYS 258 Cb 0.20 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1lua h LYS 258 CO -0.01 0.93 0.08 1.25 -0.57 0.00 0.00 179.45 181.14 1lua h LEU 259 N 0.99 0.26 -0.19 2.94 5.85 -0.11 -0.97 115.31 124.08 1lua h LEU 259 Ca 0.21 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1lua h LEU 259 Cb 0.36 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1lua h LEU 259 CO 0.00 0.34 0.05 -0.74 -0.34 0.00 0.00 178.44 177.75 1lua h HIS 260 N 0.16 0.08 -0.33 1.25 2.76 -0.94 -0.35 115.15 117.79 1lua h HIS 260 Ca 0.06 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.27 1lua h HIS 260 Cb 0.16 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 29.08 1lua h HIS 260 CO -0.02 0.03 0.17 0.00 -1.30 0.00 0.00 177.93 176.82 1lua h ARG 261 N 0.13 0.34 -0.46 5.26 3.08 -1.31 -1.97 114.38 119.44 1lua h ARG 261 Ca 0.08 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1lua h ARG 261 Cb 0.07 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1lua h ARG 261 CO -0.10 0.22 0.18 0.00 -1.07 0.00 0.00 179.97 179.20 1lua h ALA 262 N 1.17 1.45 -0.41 0.04 0.00 -0.72 -2.31 119.26 118.48 1lua h ALA 262 Ca 0.14 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1lua h ALA 262 Cb 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1lua h ALA 262 CO -0.09 0.42 0.04 0.00 0.00 0.00 0.00 179.25 179.62 1lua h ILE 264 N 0.53 0.86 -0.74 0.00 1.08 -0.93 -1.96 117.51 116.35 1lua h ILE 264 Ca 0.12 -0.06 0.02 0.00 -0.39 0.00 0.00 64.86 64.56 1lua h ILE 264 Cb 0.41 0.68 -0.04 0.00 -3.07 0.00 0.00 36.82 34.80 1lua h ILE 264 CO 0.01 0.03 0.49 0.00 -0.69 0.00 0.00 178.15 177.99 1lua h ALA 265 N 1.21 1.53 -0.05 1.87 0.00 -1.23 -1.64 119.26 120.94 1lua h ALA 265 Ca 0.13 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1lua h ALA 265 Cb 0.14 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1lua h ALA 265 CO -0.18 0.41 -0.27 -0.22 0.00 0.00 0.00 179.25 179.00 1lua h LYS 266 N 0.94 0.09 -0.25 0.00 3.64 -0.64 -2.34 116.57 118.01 1lua h LYS 266 Ca 0.28 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.71 1lua h LYS 266 Cb -0.01 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1lua h LYS 266 CO -0.07 0.35 0.19 -0.07 -2.27 0.00 0.00 179.45 177.58 1lua h LEU 267 N 0.08 0.00 -1.66 5.20 3.38 -0.58 -1.74 115.31 119.99 1lua h LEU 267 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1lua h LEU 267 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1lua h LEU 267 CO 0.04 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.06 1lua n PHE 268 N -4.30 0.29 1.06 1.13 3.01 -0.88 -4.03 117.46 113.73 1lua n PHE 268 Ca 0.03 -0.15 0.11 0.00 1.01 0.00 0.00 57.45 58.46 1lua n PHE 268 Cb 0.34 0.00 0.09 0.00 -0.01 0.00 0.00 39.48 39.90 1lua n PHE 268 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1lua n GLU 269 N 0.88 0.70 -3.47 -1.08 1.02 -0.65 -4.59 120.64 113.44 1lua n GLU 269 Ca 0.17 -0.53 -0.12 0.00 -0.02 0.00 0.00 57.16 56.67 1lua n GLU 269 Cb 0.47 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 1lua n GLU 269 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1lua s SER 270 N -2.67 -0.49 -0.02 1.62 0.15 -1.25 -5.05 113.70 105.99 1lua s SER 270 Ca 0.16 -0.07 0.17 0.00 0.70 0.00 0.00 55.95 56.91 1lua s SER 270 Cb 0.18 0.57 0.50 0.00 -1.71 0.00 0.00 66.02 65.56 1lua s SER 270 CO 0.65 -0.94 1.42 -1.54 1.20 0.00 0.00 173.24 174.03 1lua n SER 271 N -0.34 3.61 -0.94 5.45 3.41 -1.26 -4.24 113.62 119.31 1lua n SER 271 Ca -0.17 -2.10 0.04 0.00 -0.26 0.00 0.00 58.87 56.38 1lua n SER 271 Cb 0.65 -0.39 0.07 0.00 -0.26 0.00 0.00 64.21 64.28 1lua n SER 271 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1lua n GLU 272 N 1.00 0.51 -2.71 4.33 0.28 -1.26 -3.05 120.64 119.74 1lua n GLU 272 Ca 0.19 -2.17 -0.37 0.00 -0.16 0.00 0.00 57.16 54.65 1lua n GLU 272 Cb 0.58 -0.64 -0.06 0.00 1.43 0.00 0.00 31.44 32.76 1lua n GLU 272 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1lua s GLY 273 N -2.19 2.78 -0.25 -1.84 0.00 -1.26 -4.93 107.32 99.64 1lua s GLY 273 Ca 0.28 0.58 -0.02 0.00 0.00 0.00 0.00 44.72 45.57 1lua s GLY 273 CO -0.09 1.02 0.05 0.14 0.00 0.00 0.00 173.10 174.22 1lua s VAL 274 N -1.63 0.81 -0.54 1.40 1.01 -1.26 -1.53 120.40 118.66 1lua s VAL 274 Ca 0.52 -0.99 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 1lua s VAL 274 Cb -0.20 -1.40 0.14 0.00 0.00 0.00 0.00 36.38 34.93 1lua s VAL 274 CO 0.25 -0.39 0.42 -0.36 0.00 0.00 0.00 175.10 175.03 1lua s PHE 275 N 1.70 3.46 0.00 5.22 0.40 -0.39 -4.72 117.98 123.66 1lua s PHE 275 Ca 0.03 -1.99 0.00 0.00 -0.60 0.00 0.00 56.93 54.37 1lua s PHE 275 Cb -0.17 -3.51 0.00 0.00 0.51 0.00 0.00 43.02 39.84 1lua s PHE 275 CO -0.15 -0.97 0.00 -3.47 0.70 0.00 0.00 175.22 171.33 1lua n ASP 276 N 4.59 1.97 -0.22 1.36 -0.08 -1.26 -1.42 116.55 121.49 1lua n ASP 276 Ca -0.03 -0.72 0.01 0.00 -1.51 0.00 0.00 54.79 52.54 1lua n ASP 276 Cb 0.41 0.00 0.09 0.00 2.34 0.00 0.00 41.12 43.96 1lua n ASP 276 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1lua h ALA 277 N 1.00 0.52 -0.12 -1.67 0.00 -1.93 -1.84 119.26 115.22 1lua h ALA 277 Ca 0.00 0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1lua h ALA 277 Cb 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1lua h ALA 277 CO 0.00 -0.42 0.03 0.93 0.00 0.00 0.00 179.25 179.79 1lua h GLU 278 N 0.04 0.08 -0.23 0.00 3.07 -1.96 -1.57 114.58 114.00 1lua h GLU 278 Ca 0.33 -0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 59.02 1lua h GLU 278 Cb 0.52 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1lua h GLU 278 CO -0.63 0.05 -0.53 0.93 -1.40 0.00 0.00 179.01 177.43 1lua h GLU 279 N 0.08 0.67 -0.70 2.33 4.39 -1.77 -2.22 114.58 117.37 1lua h GLU 279 Ca 0.05 -0.41 -0.07 0.00 0.34 0.00 0.00 59.36 59.28 1lua h GLU 279 Cb 0.04 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 1lua h GLU 279 CO -0.07 1.03 0.18 0.82 -1.16 0.00 0.00 179.01 179.81 1lua h ILE 280 N 0.52 1.26 -0.28 3.13 2.04 -1.30 -2.55 117.51 120.34 1lua h ILE 280 Ca 0.02 -0.95 -0.11 0.00 1.00 0.00 0.00 64.86 64.82 1lua h ILE 280 Cb 1.09 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1lua h ILE 280 CO 0.11 0.37 -0.29 0.22 0.00 0.00 0.00 178.15 178.55 1lua h TYR 281 N 1.06 0.65 -0.91 1.37 3.20 -1.23 -0.33 116.97 120.78 1lua h TYR 281 Ca 0.22 -0.15 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1lua h TYR 281 Cb 0.35 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 1lua h TYR 281 CO 0.03 0.80 0.52 -0.22 -1.64 0.00 0.00 178.16 177.64 1lua h LYS 282 N 0.49 1.25 -0.06 1.82 3.64 -1.13 -1.54 116.57 121.05 1lua h LYS 282 Ca 0.06 -0.13 -0.18 0.00 -1.27 0.00 0.00 60.65 59.13 1lua h LYS 282 Cb 0.75 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1lua h LYS 282 CO 0.06 0.90 -0.73 1.25 -2.27 0.00 0.00 179.45 178.66 1lua h LEU 283 N 1.26 0.39 -0.96 5.20 5.85 -1.15 -3.15 115.31 122.74 1lua h LEU 283 Ca 0.32 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1lua h LEU 283 Cb -0.01 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 40.86 1lua h LEU 283 CO -0.06 0.99 0.60 0.00 -0.34 0.00 0.00 178.44 179.63 1lua h ALA 284 N 1.01 1.22 0.00 1.25 0.00 -0.43 -1.87 119.26 120.44 1lua h ALA 284 Ca -0.03 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1lua h ALA 284 Cb 1.29 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1lua h ALA 284 CO 0.12 0.66 -0.25 0.87 0.00 0.00 0.00 179.25 180.64 1lua h LYS 285 N 1.32 0.00 0.00 0.00 1.57 -1.27 0.28 116.57 118.47 1lua h LYS 285 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1lua h LYS 285 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1lua h LYS 285 CO -0.07 0.25 0.00 0.93 -0.57 0.00 0.00 179.45 179.99 1lua h GLU 286 N 0.00 0.00 0.00 3.15 5.08 -1.34 -3.33 114.58 118.13 1lua h GLU 286 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1lua h GLU 286 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1lua h GLU 286 CO 0.03 0.00 -1.60 -1.33 -1.00 0.00 0.00 179.01 175.11 1lua n MET 287 N -2.68 0.44 0.00 2.33 2.81 -0.84 -5.12 117.12 114.05 1lua n MET 287 Ca 0.05 -0.12 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 1lua n MET 287 Cb 0.48 -1.32 0.00 0.00 -0.71 0.00 0.00 33.22 31.67 1lua n MET 287 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48