#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1seb s GLN 3 N 0.00 4.25 0.40 4.33 0.74 -1.13 -4.96 119.66 123.29 1seb s GLN 3 Ca 0.00 2.07 -0.27 0.00 0.05 0.00 0.00 55.36 57.21 1seb s GLN 3 Cb 0.00 -3.62 -0.10 0.00 1.10 0.00 0.00 33.01 30.40 1seb s GLN 3 CO 0.00 -0.64 1.41 -1.25 -0.55 0.00 0.00 175.29 174.26 1seb s PRO 4 N 2.62 3.99 0.66 1.67 0.04 -1.26 -4.69 135.00 138.03 1seb s PRO 4 Ca 0.67 2.40 -0.16 0.00 0.04 0.00 0.00 61.00 63.95 1seb s PRO 4 Cb -0.33 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1seb s PRO 4 CO 0.28 -0.56 1.16 -0.51 0.04 0.00 0.00 177.00 177.41 1seb s ASP 5 N -0.41 4.86 0.00 6.66 1.11 -1.26 -4.89 116.67 122.74 1seb s ASP 5 Ca 0.55 2.19 -0.37 0.00 0.18 0.00 0.00 52.55 55.11 1seb s ASP 5 Cb -0.43 -2.57 -0.16 0.00 1.07 0.00 0.00 42.92 40.83 1seb s ASP 5 CO 0.57 -1.81 1.49 -0.81 1.18 0.00 0.00 175.17 175.80 1seb n PRO 6 N -2.30 1.34 -2.22 8.23 -0.04 -1.26 -4.94 135.00 133.81 1seb n PRO 6 Ca 0.12 0.49 -0.43 0.00 -0.04 0.00 0.00 63.50 63.64 1seb n PRO 6 Cb 0.51 -2.17 -0.02 0.00 -0.04 0.00 0.00 33.50 31.78 1seb n PRO 6 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1seb s LYS 7 N 1.44 4.21 0.25 0.54 0.00 -1.26 -4.83 119.74 120.09 1seb s LYS 7 Ca 0.87 1.93 0.21 0.00 0.00 0.00 0.00 55.97 58.98 1seb s LYS 7 Cb -0.93 -3.87 0.78 0.00 0.00 0.00 0.00 37.83 33.81 1seb s LYS 7 CO 0.50 -0.77 0.73 -0.35 0.00 0.00 0.00 175.35 175.46 1seb n PRO 8 N 6.85 -0.00 0.13 1.78 -0.04 -1.26 0.91 135.00 143.36 1seb n PRO 8 Ca 0.16 0.53 0.12 0.00 -0.04 0.00 0.00 63.50 64.27 1seb n PRO 8 Cb 0.44 -1.17 0.27 0.00 -0.04 0.00 0.00 33.50 33.00 1seb n PRO 8 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1seb h ASP 9 N 0.00 0.00 0.13 3.54 5.19 -2.03 -3.37 116.42 119.88 1seb h ASP 9 Ca 0.44 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.80 1seb h ASP 9 Cb 1.65 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 41.16 1seb h ASP 9 CO -0.07 0.02 -0.10 -0.33 -3.12 0.00 0.00 179.24 175.64 1seb h GLU 10 N 0.00 -0.22 -3.45 3.56 5.08 0.18 -3.46 114.58 116.28 1seb h GLU 10 Ca 0.00 0.01 -0.37 0.00 -1.00 0.00 0.00 59.36 58.01 1seb h GLU 10 Cb 0.83 0.05 0.08 0.00 0.50 0.00 0.00 28.75 30.21 1seb h GLU 10 CO 0.00 -0.15 -0.44 1.28 -1.00 0.00 0.00 179.01 178.70 1seb n LEU 11 N -2.87 -1.24 -4.78 1.33 7.99 -1.26 -4.91 117.00 111.26 1seb n LEU 11 Ca -0.03 0.55 -0.39 0.00 -0.01 0.00 0.00 56.01 56.13 1seb n LEU 11 Cb 0.10 -0.52 -0.06 0.00 -0.11 0.00 0.00 43.42 42.83 1seb n LEU 11 CO 0.06 -2.11 0.43 -1.00 -1.51 0.00 0.00 177.39 173.27 1seb s HIS 12 N -0.79 3.87 -0.29 -1.77 4.02 -1.26 -5.05 115.29 114.01 1seb s HIS 12 Ca 0.35 1.54 -0.09 0.00 1.02 0.00 0.00 55.06 57.88 1seb s HIS 12 Cb -0.44 -2.71 -0.01 0.00 -1.02 0.00 0.00 32.58 28.39 1seb s HIS 12 CO 0.34 0.50 0.13 0.15 1.02 0.00 0.00 174.74 176.89 1seb s LYS 13 N -1.01 3.40 0.48 1.40 -0.14 -1.26 -4.45 119.74 118.16 1seb s LYS 13 Ca 0.34 -0.67 0.18 0.00 -1.36 0.00 0.00 55.97 54.47 1seb s LYS 13 Cb -0.22 -3.50 1.18 0.00 -1.68 0.00 0.00 37.83 33.62 1seb s LYS 13 CO 0.24 -0.36 2.00 0.66 -0.76 0.00 0.00 175.35 177.13 1seb h SER 14 N 8.31 0.20 0.34 2.83 4.64 -1.63 0.10 113.55 128.35 1seb h SER 14 Ca -0.33 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 60.98 1seb h SER 14 Cb 1.15 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1seb h SER 14 CO 0.60 0.12 -0.07 -1.28 -0.87 0.00 0.00 176.83 175.33 1seb h SER 15 N 0.22 0.00 -0.14 4.97 0.87 -1.93 -1.21 113.55 116.33 1seb h SER 15 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1seb h SER 15 Cb 0.66 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 1seb h SER 15 CO -0.05 0.07 0.00 1.17 -0.53 0.00 0.00 176.83 177.50 1seb n LYS 16 N -3.52 1.60 -4.14 2.24 4.81 0.36 -4.85 118.16 114.66 1seb n LYS 16 Ca -0.02 -0.90 -0.26 0.00 -0.87 0.00 0.00 58.31 56.26 1seb n LYS 16 Cb 0.20 -1.38 -0.06 0.00 0.02 0.00 0.00 35.03 33.81 1seb n LYS 16 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1seb s PHE 17 N -1.83 3.01 -0.01 5.64 5.36 -0.46 -3.65 117.98 126.04 1seb s PHE 17 Ca 0.31 -0.07 0.00 0.00 -0.96 0.00 0.00 56.93 56.21 1seb s PHE 17 Cb 0.17 -1.45 -0.01 0.00 -0.34 0.00 0.00 43.02 41.39 1seb s PHE 17 CO 0.25 0.52 -0.01 0.25 -1.46 0.00 0.00 175.22 174.77 1seb n THR 18 N -0.25 0.07 -3.71 0.12 -2.24 -0.01 -5.00 114.28 103.26 1seb n THR 18 Ca -0.09 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.28 1seb n THR 18 Cb 0.55 -0.61 -0.12 0.00 -2.10 0.00 0.00 70.33 68.05 1seb n THR 18 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1seb s GLY 19 N -3.96 1.86 0.00 3.38 0.00 -1.05 -4.90 107.32 102.65 1seb s GLY 19 Ca -0.01 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 42.98 1seb s GLY 19 CO 0.03 0.79 0.00 1.04 0.00 0.00 0.00 173.10 174.96 1seb n LEU 20 N 4.86 -3.66 0.00 0.66 4.77 -1.26 -4.75 117.00 117.63 1seb n LEU 20 Ca -0.12 0.57 0.06 0.00 -0.03 0.00 0.00 56.01 56.49 1seb n LEU 20 Cb 0.45 -1.42 0.32 0.00 -2.33 0.00 0.00 43.42 40.44 1seb n LEU 20 CO 0.33 -1.81 0.60 0.80 -1.33 0.00 0.00 177.39 175.98 1seb n MET 21 N 1.70 0.26 -0.09 3.23 0.00 -1.26 -2.35 117.12 118.61 1seb n MET 21 Ca 0.00 0.09 -0.00 0.00 -0.00 0.00 0.00 57.70 57.79 1seb n MET 21 Cb 0.27 -1.50 0.27 0.00 0.00 0.00 0.00 33.22 32.26 1seb n MET 21 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 1seb h GLU 22 N 0.00 0.74 0.00 2.12 4.57 -1.96 -0.86 114.58 119.19 1seb h GLU 22 Ca 0.00 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 1seb h GLU 22 Cb 0.06 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.51 1seb h GLU 22 CO 0.00 0.60 0.00 0.09 -1.18 0.00 0.00 179.01 178.52 1seb n ASN 23 N -4.35 0.00 -0.11 1.04 3.02 -0.99 0.14 115.26 114.02 1seb n ASN 23 Ca 0.04 0.20 -0.24 0.00 -0.03 0.00 0.00 54.58 54.55 1seb n ASN 23 Cb 0.15 -0.36 -0.11 0.00 -0.61 0.00 0.00 39.78 38.85 1seb n ASN 23 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 1seb n MET 24 N -1.36 0.60 -0.30 3.52 0.00 -0.49 -4.24 117.12 114.85 1seb n MET 24 Ca 0.07 0.40 0.01 0.00 -0.00 0.00 0.00 57.70 58.19 1seb n MET 24 Cb 0.16 -1.64 0.15 0.00 0.00 0.00 0.00 33.22 31.89 1seb n MET 24 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1seb h LYS 25 N -0.80 0.85 -0.34 2.12 6.56 -0.55 -2.18 116.57 122.23 1seb h LYS 25 Ca -0.50 -0.05 0.10 0.00 -1.06 0.00 0.00 60.65 59.14 1seb h LYS 25 Cb 1.54 -0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 32.99 1seb h LYS 25 CO -0.24 0.56 0.34 -0.39 -2.06 0.00 0.00 179.45 177.67 1seb h VAL 26 N 0.88 0.47 -0.05 0.50 -1.51 -0.48 1.57 116.25 117.63 1seb h VAL 26 Ca 0.38 0.00 -0.12 0.00 -1.23 0.00 0.00 66.70 65.73 1seb h VAL 26 Cb 0.24 0.73 -0.01 0.00 -2.13 0.00 0.00 31.29 30.12 1seb h VAL 26 CO -0.20 0.00 -0.52 -0.07 -1.23 0.00 0.00 177.57 175.55 1seb h LEU 27 N 0.00 0.13 0.00 4.19 3.38 -1.58 -3.33 115.31 118.10 1seb h LEU 27 Ca 0.16 -0.07 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 1seb h LEU 27 Cb 0.85 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 1seb h LEU 27 CO -0.00 0.63 -1.67 -1.22 0.09 0.00 0.00 178.44 176.27 1seb n TYR 28 N -3.93 0.00 -1.78 1.13 4.01 0.53 -4.49 117.16 112.63 1seb n TYR 28 Ca -0.02 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.53 1seb n TYR 28 Cb 0.54 -0.48 -0.07 0.00 -0.31 0.00 0.00 39.34 39.03 1seb n TYR 28 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1seb s ASP 29 N -4.23 4.38 -1.26 7.72 -0.00 0.51 -3.16 116.67 120.63 1seb s ASP 29 Ca -0.05 -0.39 0.00 0.00 -0.00 0.00 0.00 52.55 52.11 1seb s ASP 29 Cb 0.03 -2.56 0.00 0.00 -0.00 0.00 0.00 42.92 40.39 1seb s ASP 29 CO 0.40 -3.48 0.00 -0.90 -0.00 0.00 0.00 175.17 171.18 1seb n ASP 30 N 16.78 -3.79 -3.91 0.27 3.85 -1.26 -4.81 116.55 123.68 1seb n ASP 30 Ca 0.44 0.25 -0.29 0.00 -0.71 0.00 0.00 54.79 54.47 1seb n ASP 30 Cb 0.45 -3.37 -0.16 0.00 -1.35 0.00 0.00 41.12 36.70 1seb n ASP 30 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1seb s ASN 31 N -2.07 3.40 0.15 -1.12 6.03 -1.19 -5.10 114.94 115.04 1seb s ASN 31 Ca 0.00 -0.96 -0.19 0.00 -1.03 0.00 0.00 52.86 50.68 1seb s ASN 31 Cb 0.00 -1.04 0.05 0.00 -3.03 0.00 0.00 41.25 37.23 1seb s ASN 31 CO 0.00 -0.22 0.49 -1.00 -2.03 0.00 0.00 177.10 174.34 1seb s HIS 32 N 1.52 -0.30 0.03 1.54 0.09 -1.26 -4.13 115.29 112.77 1seb s HIS 32 Ca -0.03 0.02 0.04 0.00 -0.00 0.00 0.00 55.06 55.09 1seb s HIS 32 Cb -0.17 0.39 -0.04 0.00 -0.00 0.00 0.00 32.58 32.76 1seb s HIS 32 CO -0.07 -0.80 -0.07 0.08 -0.00 0.00 0.00 174.74 173.88 1seb s VAL 33 N -3.80 3.62 -0.28 -0.90 1.01 0.66 -4.93 120.40 115.78 1seb s VAL 33 Ca 0.03 -0.89 -0.25 0.00 0.00 0.00 0.00 61.98 60.87 1seb s VAL 33 Cb 0.00 -2.61 0.15 0.00 0.00 0.00 0.00 36.38 33.92 1seb s VAL 33 CO -0.10 0.32 1.17 -0.94 0.00 0.00 0.00 175.10 175.54 1seb s SER 34 N -1.64 -0.31 0.00 3.32 1.04 -1.26 -1.24 113.70 113.61 1seb s SER 34 Ca 0.19 0.59 -0.07 0.00 0.48 0.00 0.00 55.95 57.14 1seb s SER 34 Cb -0.11 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.60 1seb s SER 34 CO 0.10 -0.11 0.13 0.00 0.98 0.00 0.00 173.24 174.33 1seb s ALA 35 N 0.08 -0.31 -0.18 5.32 0.00 -0.99 -4.89 121.76 120.78 1seb s ALA 35 Ca 0.04 -0.13 -0.08 0.00 0.00 0.00 0.00 51.96 51.80 1seb s ALA 35 Cb -0.05 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 1seb s ALA 35 CO -0.09 -0.20 0.07 -1.50 0.00 0.00 0.00 175.76 174.04 1seb s ILE 36 N -1.30 4.82 -0.87 0.00 2.07 -1.26 -2.95 121.20 121.70 1seb s ILE 36 Ca -0.14 -0.02 -0.04 0.00 -1.41 0.00 0.00 60.65 59.03 1seb s ILE 36 Cb -0.07 -3.17 0.01 0.00 0.13 0.00 0.00 42.46 39.35 1seb s ILE 36 CO 0.01 0.46 0.62 -3.20 -1.91 0.00 0.00 174.94 170.92 1seb n ASN 37 N 3.57 -4.96 -4.40 4.50 2.85 -1.23 -5.02 115.26 110.57 1seb n ASN 37 Ca -0.16 -0.95 -0.20 0.00 -0.11 0.00 0.00 54.58 53.15 1seb n ASN 37 Cb 0.52 -1.93 -0.10 0.00 1.24 0.00 0.00 39.78 39.51 1seb n ASN 37 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1seb s VAL 38 N -3.06 1.72 0.39 3.44 -7.23 -0.62 -4.87 120.40 110.17 1seb s VAL 38 Ca 0.06 -2.17 0.05 0.00 -1.81 0.00 0.00 61.98 58.11 1seb s VAL 38 Cb -0.03 -2.28 -0.06 0.00 0.56 0.00 0.00 36.38 34.57 1seb s VAL 38 CO 0.90 -0.43 0.04 -0.75 -0.31 0.00 0.00 175.10 174.55 1seb s LYS 39 N -3.68 1.86 0.56 4.82 2.20 -1.26 0.13 119.74 124.37 1seb s LYS 39 Ca 0.27 -2.07 -0.19 0.00 -0.36 0.00 0.00 55.97 53.61 1seb s LYS 39 Cb 0.01 -1.25 -0.05 0.00 -1.51 0.00 0.00 37.83 35.04 1seb s LYS 39 CO 0.10 -0.17 1.15 -1.54 -0.36 0.00 0.00 175.35 174.53 1seb s SER 40 N -3.63 5.54 -0.21 1.43 1.04 -1.14 -4.51 113.70 112.22 1seb s SER 40 Ca 0.32 2.22 -0.00 0.00 0.48 0.00 0.00 55.95 58.96 1seb s SER 40 Cb 0.08 -2.58 -0.13 0.00 0.10 0.00 0.00 66.02 63.49 1seb s SER 40 CO 0.15 -1.34 -0.20 -0.38 0.98 0.00 0.00 173.24 172.45 1seb n ILE 41 N -1.45 1.20 -4.00 -1.02 2.08 -0.39 -4.98 119.36 110.81 1seb n ILE 41 Ca 0.12 -0.44 0.03 0.00 0.56 0.00 0.00 62.75 63.02 1seb n ILE 41 Cb 0.51 -1.31 0.01 0.00 -0.75 0.00 0.00 39.64 38.09 1seb n ILE 41 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 1seb n ASP 42 N -3.23 -0.84 -4.36 4.38 5.68 -1.24 -5.03 116.55 111.91 1seb n ASP 42 Ca -0.38 -1.10 -0.19 0.00 -0.50 0.00 0.00 54.79 52.62 1seb n ASP 42 Cb 0.88 1.29 -0.10 0.00 -1.14 0.00 0.00 41.12 42.05 1seb n ASP 42 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1seb s GLN 43 N -2.01 1.41 -0.03 0.11 1.11 -1.26 0.02 119.66 119.00 1seb s GLN 43 Ca 0.24 -1.70 -0.03 0.00 0.01 0.00 0.00 55.36 53.87 1seb s GLN 43 Cb -0.00 -0.85 -0.01 0.00 -1.01 0.00 0.00 33.01 31.14 1seb s GLN 43 CO -0.01 -0.03 -0.06 0.34 0.01 0.00 0.00 175.29 175.54 1seb n PHE 44 N -0.47 0.05 -4.11 0.91 7.35 -1.26 -4.92 117.46 115.02 1seb n PHE 44 Ca -0.06 0.02 -0.24 0.00 -0.76 0.00 0.00 57.45 56.42 1seb n PHE 44 Cb 0.63 -0.17 -0.07 0.00 0.35 0.00 0.00 39.48 40.23 1seb n PHE 44 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1seb s LEU 45 N -5.50 3.19 0.45 -2.13 1.43 -1.26 -5.00 118.68 109.86 1seb s LEU 45 Ca -0.05 -0.89 0.31 0.00 -1.03 0.00 0.00 54.13 52.47 1seb s LEU 45 Cb 0.01 -1.62 1.60 0.00 0.03 0.00 0.00 46.19 46.21 1seb s LEU 45 CO 0.08 -0.38 1.93 0.10 0.23 0.00 0.00 176.35 178.31 1seb h TYR 46 N 1.52 0.00 -0.52 0.29 -0.00 -1.99 -2.96 116.97 113.31 1seb h TYR 46 Ca -0.43 0.00 -0.12 0.00 -0.00 0.00 0.00 58.73 58.18 1seb h TYR 46 Cb 1.25 0.00 -0.07 0.00 -0.00 0.00 0.00 36.73 37.91 1seb h TYR 46 CO 0.63 0.00 0.11 1.97 -0.00 0.00 0.00 178.16 180.87 1seb n PHE 47 N -2.59 1.77 -4.26 0.10 -1.74 -1.26 -4.56 117.46 104.92 1seb n PHE 47 Ca -0.01 -1.09 -0.17 0.00 -0.56 0.00 0.00 57.45 55.62 1seb n PHE 47 Cb 0.08 -0.53 -0.09 0.00 1.52 0.00 0.00 39.48 40.47 1seb n PHE 47 CO 0.00 0.00 0.00 0.16 -0.56 0.00 0.00 176.76 176.36 1seb s ASP 48 N -1.47 1.19 -0.07 5.98 1.47 -1.12 0.22 116.67 122.87 1seb s ASP 48 Ca 0.50 -1.64 -0.06 0.00 1.18 0.00 0.00 52.55 52.53 1seb s ASP 48 Cb 0.40 0.50 0.02 0.00 -0.34 0.00 0.00 42.92 43.50 1seb s ASP 48 CO 0.11 -0.99 0.19 -0.76 0.68 0.00 0.00 175.17 174.39 1seb s LEU 49 N -3.31 1.27 -0.27 2.11 1.43 0.16 -4.68 118.68 115.39 1seb s LEU 49 Ca 0.40 0.37 -0.08 0.00 -1.03 0.00 0.00 54.13 53.80 1seb s LEU 49 Cb 0.04 0.63 -0.02 0.00 0.03 0.00 0.00 46.19 46.87 1seb s LEU 49 CO 0.23 -0.07 0.09 -0.63 0.23 0.00 0.00 176.35 176.19 1seb s ILE 50 N 0.14 4.32 0.09 -0.59 -1.09 0.10 0.80 121.20 124.97 1seb s ILE 50 Ca -0.00 -0.28 0.02 0.00 -2.23 0.00 0.00 60.65 58.15 1seb s ILE 50 Cb -0.02 -3.08 -0.04 0.00 -1.58 0.00 0.00 42.46 37.74 1seb s ILE 50 CO -0.00 0.26 0.18 -0.31 -1.23 0.00 0.00 174.94 173.84 1seb s TYR 51 N 1.60 3.39 -0.04 3.97 2.02 -0.21 -1.26 117.35 126.82 1seb s TYR 51 Ca 0.06 0.16 0.00 0.00 -0.37 0.00 0.00 57.07 56.92 1seb s TYR 51 Cb -0.16 -1.69 0.04 0.00 -0.40 0.00 0.00 41.96 39.76 1seb s TYR 51 CO 0.04 0.55 1.56 -1.13 -1.57 0.00 0.00 175.55 175.00 1seb n SER 52 N 0.14 4.35 -4.64 2.29 3.41 -1.26 -1.26 113.62 116.65 1seb n SER 52 Ca -0.07 -2.33 -0.43 0.00 -0.26 0.00 0.00 58.87 55.79 1seb n SER 52 Cb 0.52 -0.84 -0.02 0.00 -0.26 0.00 0.00 64.21 63.61 1seb n SER 52 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1seb s ILE 53 N -0.32 3.81 -0.30 -1.33 -1.09 -1.25 -4.85 121.20 115.87 1seb s ILE 53 Ca 0.05 0.93 0.09 0.00 -2.23 0.00 0.00 60.65 59.49 1seb s ILE 53 Cb 0.04 -3.77 0.54 0.00 -1.58 0.00 0.00 42.46 37.68 1seb s ILE 53 CO 0.00 -0.27 1.52 0.29 -1.23 0.00 0.00 174.94 175.26 1seb n LYS 54 N 7.42 2.07 0.00 2.79 5.02 -1.26 -3.01 118.16 131.19 1seb n LYS 54 Ca 0.17 -3.12 0.05 0.00 -2.02 0.00 0.00 58.31 53.39 1seb n LYS 54 Cb 0.45 -1.87 0.22 0.00 -0.02 0.00 0.00 35.03 33.80 1seb n LYS 54 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1seb n ASP 55 N -1.03 0.00 -2.54 4.39 5.68 -1.26 -4.94 116.55 116.85 1seb n ASP 55 Ca 0.35 0.41 -0.05 0.00 -0.50 0.00 0.00 54.79 55.00 1seb n ASP 55 Cb 1.10 -0.45 0.01 0.00 -1.14 0.00 0.00 41.12 40.65 1seb n ASP 55 CO 0.00 0.00 0.00 1.07 -1.33 0.00 0.00 177.20 176.94 1seb n THR 56 N -1.45 -9.32 0.00 2.12 5.66 -1.26 -5.10 114.28 104.93 1seb n THR 56 Ca 0.03 0.84 0.00 0.00 -3.05 0.00 0.00 64.05 61.87 1seb n THR 56 Cb 0.10 -6.56 0.00 0.00 -1.55 0.00 0.00 70.33 62.32 1seb n THR 56 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 1seb n TYR 61 N -0.19 0.00 0.00 1.09 4.02 -1.26 -5.19 117.16 115.63 1seb n TYR 61 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 1seb n TYR 61 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.62 1seb n TYR 61 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1seb n ASP 62 N -0.97 0.00 -4.21 7.72 5.68 -1.16 -4.72 116.55 118.89 1seb n ASP 62 Ca 0.00 0.00 -0.27 0.00 -0.50 0.00 0.00 54.79 54.02 1seb n ASP 62 Cb 0.00 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 39.82 1seb n ASP 62 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 1seb s ASN 63 N -4.00 2.33 -0.14 -1.12 0.01 -1.26 -3.88 114.94 106.88 1seb s ASN 63 Ca 0.00 -0.36 0.03 0.00 -0.71 0.00 0.00 52.86 51.82 1seb s ASN 63 Cb 0.00 -0.26 0.01 0.00 0.41 0.00 0.00 41.25 41.41 1seb s ASN 63 CO 0.00 0.24 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.92 1seb s VAL 64 N -0.46 2.06 -0.40 1.60 1.01 -0.39 -3.55 120.40 120.27 1seb s VAL 64 Ca 0.08 -0.98 -0.26 0.00 0.00 0.00 0.00 61.98 60.81 1seb s VAL 64 Cb -0.08 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.51 1seb s VAL 64 CO -0.01 0.55 0.96 -0.60 0.00 0.00 0.00 175.10 176.01 1seb s ARG 65 N 0.78 3.78 -0.25 2.72 3.52 -0.52 -1.05 118.95 127.93 1seb s ARG 65 Ca -0.08 0.52 -0.13 0.00 -0.13 0.00 0.00 55.73 55.91 1seb s ARG 65 Cb -0.16 -3.84 -0.04 0.00 -1.56 0.00 0.00 34.95 29.35 1seb s ARG 65 CO -0.01 -1.06 0.28 0.08 -0.81 0.00 0.00 175.30 173.78 1seb s VAL 66 N 3.68 5.25 -0.11 7.11 1.01 0.24 -0.95 120.40 136.64 1seb s VAL 66 Ca 0.40 0.41 -0.00 0.00 0.00 0.00 0.00 61.98 62.78 1seb s VAL 66 Cb -0.11 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1seb s VAL 66 CO 0.22 0.24 -0.09 -0.70 0.00 0.00 0.00 175.10 174.77 1seb s GLU 67 N 1.62 3.17 0.49 2.72 2.12 -0.18 0.36 118.70 129.00 1seb s GLU 67 Ca 0.12 -0.60 0.05 0.00 0.36 0.00 0.00 54.97 54.90 1seb s GLU 67 Cb -0.15 -2.67 -0.01 0.00 0.26 0.00 0.00 34.13 31.57 1seb s GLU 67 CO 0.09 0.40 0.24 -0.06 -0.54 0.00 0.00 175.26 175.39 1seb s PHE 68 N -0.11 2.05 0.03 5.30 0.08 0.13 -4.01 117.98 121.45 1seb s PHE 68 Ca 0.00 -0.77 -0.10 0.00 0.12 0.00 0.00 56.93 56.19 1seb s PHE 68 Cb -0.13 -1.88 -0.32 0.00 -0.57 0.00 0.00 43.02 40.12 1seb s PHE 68 CO 0.03 -0.09 0.98 -0.22 -0.10 0.00 0.00 175.22 175.82 1seb h LYS 69 N 1.11 0.40 -5.51 0.44 3.64 -1.57 -3.44 116.57 111.64 1seb h LYS 69 Ca -0.40 -0.69 -0.51 0.00 -1.27 0.00 0.00 60.65 57.78 1seb h LYS 69 Cb 1.29 0.26 -0.14 0.00 -0.41 0.00 0.00 32.23 33.22 1seb h LYS 69 CO 0.65 1.31 -0.66 -0.80 -2.27 0.00 0.00 179.45 177.69 1seb s ASN 70 N -7.33 2.88 0.26 4.20 0.01 -1.26 -5.02 114.94 108.67 1seb s ASN 70 Ca -0.08 -1.23 0.00 0.00 -0.71 0.00 0.00 52.86 50.84 1seb s ASN 70 Cb 0.06 -0.19 0.33 0.00 0.41 0.00 0.00 41.25 41.85 1seb s ASN 70 CO 0.90 -0.38 1.68 0.50 -1.51 0.00 0.00 177.10 178.30 1seb h LYS 71 N 2.19 0.56 -0.47 -0.60 3.64 -1.90 -3.14 116.57 116.85 1seb h LYS 71 Ca -0.41 -0.22 0.07 0.00 -1.27 0.00 0.00 60.65 58.82 1seb h LYS 71 Cb 1.24 -0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.94 1seb h LYS 71 CO 0.69 0.78 -0.47 -0.44 -2.27 0.00 0.00 179.45 177.74 1seb h ASP 72 N 0.49 -1.58 -0.73 4.20 5.19 -1.95 -1.79 116.42 120.26 1seb h ASP 72 Ca 0.07 0.24 0.13 0.00 -0.62 0.00 0.00 57.03 56.85 1seb h ASP 72 Cb 0.71 0.68 -0.05 0.00 0.18 0.00 0.00 39.33 40.86 1seb h ASP 72 CO 0.05 -0.37 0.48 -0.07 -3.12 0.00 0.00 179.24 176.22 1seb h LEU 73 N -0.31 0.42 -0.16 1.55 3.38 -1.94 -0.55 115.31 117.70 1seb h LEU 73 Ca 0.13 0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.91 1seb h LEU 73 Cb 0.58 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1seb h LEU 73 CO -0.62 0.23 -0.96 0.00 0.09 0.00 0.00 178.44 177.18 1seb h ALA 74 N 1.65 0.42 -0.40 1.53 0.00 -1.46 -3.21 119.26 117.79 1seb h ALA 74 Ca 0.35 -0.79 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1seb h ALA 74 Cb 0.74 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1seb h ALA 74 CO -0.11 1.01 -0.28 -0.44 0.00 0.00 0.00 179.25 179.42 1seb h ASP 75 N 0.07 0.93 0.12 0.00 3.32 -0.49 -1.22 116.42 119.16 1seb h ASP 75 Ca -0.05 -0.43 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 1seb h ASP 75 Cb 1.64 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.92 1seb h ASP 75 CO 0.14 1.17 -0.08 0.50 -1.72 0.00 0.00 179.24 179.25 1seb h LYS 76 N 0.71 0.00 -0.00 3.56 3.64 -1.17 -3.11 116.57 120.19 1seb h LYS 76 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1seb h LYS 76 Cb 0.86 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 1seb h LYS 76 CO 0.08 0.08 -0.05 0.66 -2.27 0.00 0.00 179.45 177.95 1seb n TYR 77 N -4.15 0.00 0.00 1.91 4.01 -1.21 -4.75 117.16 112.98 1seb n TYR 77 Ca -0.03 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.69 1seb n TYR 77 Cb 0.17 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.18 1seb n TYR 77 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1seb h LYS 78 N 0.60 -0.08 0.00 -0.72 3.64 -1.14 -2.49 116.57 116.39 1seb h LYS 78 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1seb h LYS 78 Cb 0.15 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1seb h LYS 78 CO 0.00 -0.05 0.00 -0.25 -2.27 0.00 0.00 179.45 176.88 1seb n ASP 79 N -2.94 0.00 -4.90 4.20 9.92 -1.26 -2.88 116.55 118.69 1seb n ASP 79 Ca -0.01 -0.47 -0.33 0.00 -0.53 0.00 0.00 54.79 53.45 1seb n ASP 79 Cb 0.05 -0.14 -0.05 0.00 -0.64 0.00 0.00 41.12 40.35 1seb n ASP 79 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1seb s LYS 80 N -2.27 3.54 -0.07 -1.24 1.02 -0.94 -4.89 119.74 114.89 1seb s LYS 80 Ca 0.32 -0.18 -0.30 0.00 0.02 0.00 0.00 55.97 55.83 1seb s LYS 80 Cb 0.18 -3.03 -0.02 0.00 -0.52 0.00 0.00 37.83 34.44 1seb s LYS 80 CO 0.35 0.61 1.01 0.71 -0.92 0.00 0.00 175.35 177.10 1seb s TYR 81 N -1.42 3.55 0.32 3.18 2.02 -1.26 -4.15 117.35 119.58 1seb s TYR 81 Ca 0.32 1.61 0.03 0.00 -0.37 0.00 0.00 57.07 58.66 1seb s TYR 81 Cb -0.13 -3.18 -0.05 0.00 -0.40 0.00 0.00 41.96 38.21 1seb s TYR 81 CO 0.21 -0.20 0.10 0.08 -1.57 0.00 0.00 175.55 174.16 1seb s VAL 82 N 1.71 0.76 -0.13 0.71 1.01 0.34 -4.21 120.40 120.59 1seb s VAL 82 Ca 0.50 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 60.49 1seb s VAL 82 Cb -0.19 -2.62 0.02 0.00 0.00 0.00 0.00 36.38 33.58 1seb s VAL 82 CO 0.21 0.00 -0.17 -1.81 0.00 0.00 0.00 175.10 173.33 1seb s ASP 83 N -3.45 2.73 0.16 3.32 1.01 0.20 -1.58 116.67 119.06 1seb s ASP 83 Ca 0.34 -0.51 0.04 0.00 0.71 0.00 0.00 52.55 53.13 1seb s ASP 83 Cb 0.07 -1.24 -0.04 0.00 1.01 0.00 0.00 42.92 42.72 1seb s ASP 83 CO 0.15 0.02 0.22 -0.69 0.21 0.00 0.00 175.17 175.08 1seb s VAL 84 N 1.06 4.96 -0.29 -1.27 1.01 -1.15 -1.32 120.40 123.39 1seb s VAL 84 Ca -0.04 -0.88 -0.19 0.00 0.00 0.00 0.00 61.98 60.87 1seb s VAL 84 Cb -0.15 -3.55 0.13 0.00 0.00 0.00 0.00 36.38 32.81 1seb s VAL 84 CO -0.04 -0.11 0.97 0.12 0.00 0.00 0.00 175.10 176.03 1seb s PHE 85 N -1.77 -0.59 0.00 5.22 2.19 -1.10 -2.36 117.98 119.58 1seb s PHE 85 Ca 0.33 1.25 0.00 0.00 0.33 0.00 0.00 56.93 58.84 1seb s PHE 85 Cb -0.10 0.38 0.00 0.00 -1.31 0.00 0.00 43.02 41.98 1seb s PHE 85 CO 0.26 -0.29 0.00 0.41 1.83 0.00 0.00 175.22 177.43 1seb n GLY 86 N 3.24 1.92 3.63 13.12 0.00 -0.37 -3.62 105.19 123.11 1seb n GLY 86 Ca -0.17 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.48 1seb n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1seb s ALA 87 N -2.00 3.49 0.31 4.61 0.00 -1.26 -0.24 121.76 126.66 1seb s ALA 87 Ca 0.00 -0.17 0.06 0.00 0.00 0.00 0.00 51.96 51.84 1seb s ALA 87 Cb 0.00 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1seb s ALA 87 CO 0.00 -1.47 0.44 0.54 0.00 0.00 0.00 175.76 175.28 1seb s ASN 88 N 1.69 6.10 0.31 0.00 4.22 -1.26 -4.72 114.94 121.28 1seb s ASN 88 Ca 0.42 -0.05 0.05 0.00 -2.14 0.00 0.00 52.86 51.14 1seb s ASN 88 Cb -0.12 -1.49 -0.06 0.00 1.28 0.00 0.00 41.25 40.85 1seb s ASN 88 CO 0.15 -0.31 0.02 -0.72 -2.04 0.00 0.00 177.10 174.20 1seb s TYR 89 N -2.13 1.98 0.00 1.54 1.13 -0.57 -4.83 117.35 114.47 1seb s TYR 89 Ca 0.41 -0.85 0.00 0.00 -1.41 0.00 0.00 57.07 55.22 1seb s TYR 89 Cb -0.09 -1.25 0.00 0.00 -1.10 0.00 0.00 41.96 39.52 1seb s TYR 89 CO 0.31 0.12 0.00 0.66 -2.51 0.00 0.00 175.55 174.13 1seb n TYR 90 N -0.66 0.00 -2.08 -3.49 4.01 -1.26 -2.51 117.16 111.17 1seb n TYR 90 Ca -0.04 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.29 1seb n TYR 90 Cb 0.65 0.04 -0.02 0.00 -0.31 0.00 0.00 39.34 39.70 1seb n TYR 90 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1seb s TYR 91 N -1.98 3.06 -1.34 -0.72 5.04 -1.26 -2.88 117.35 117.27 1seb s TYR 91 Ca 0.00 1.18 -0.06 0.00 -2.44 0.00 0.00 57.07 55.76 1seb s TYR 91 Cb 0.00 -3.74 0.02 0.00 0.35 0.00 0.00 41.96 38.59 1seb s TYR 91 CO 0.00 -2.28 1.00 1.04 -1.34 0.00 0.00 175.55 173.97 1seb n GLN 92 N 1.88 -6.50 -3.86 4.97 6.02 -1.26 -4.74 117.38 113.90 1seb n GLN 92 Ca 0.04 0.75 -0.35 0.00 -0.01 0.00 0.00 57.00 57.43 1seb n GLN 92 Cb 0.41 -5.66 -0.13 0.00 1.02 0.00 0.00 30.24 25.88 1seb n GLN 92 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1seb s TYR 94 N 1.20 2.03 -0.15 0.00 2.02 -1.26 -4.94 117.35 116.25 1seb s TYR 94 Ca 0.01 -0.39 -0.34 0.00 -0.37 0.00 0.00 57.07 55.98 1seb s TYR 94 Cb -0.21 -1.23 0.13 0.00 -0.40 0.00 0.00 41.96 40.26 1seb s TYR 94 CO -0.02 0.08 1.20 -0.59 -1.57 0.00 0.00 175.55 174.65 1seb s PHE 95 N -0.75 -0.13 -0.10 2.71 -0.71 -1.26 -5.08 117.98 112.66 1seb s PHE 95 Ca 0.09 0.06 0.03 0.00 -1.04 0.00 0.00 56.93 56.08 1seb s PHE 95 Cb -0.09 0.52 0.00 0.00 -1.21 0.00 0.00 43.02 42.24 1seb s PHE 95 CO 0.01 -0.24 -0.22 0.45 -1.34 0.00 0.00 175.22 173.89 1seb s SER 96 N -2.31 2.91 -0.17 1.98 0.15 -1.26 -5.11 113.70 109.88 1seb s SER 96 Ca 0.10 -0.53 -0.10 0.00 0.70 0.00 0.00 55.95 56.12 1seb s SER 96 Cb -0.00 -1.33 -0.05 0.00 -1.71 0.00 0.00 66.02 62.93 1seb s SER 96 CO -0.05 0.12 0.16 -1.59 1.20 0.00 0.00 173.24 173.08 1seb s LYS 97 N 0.51 4.03 0.00 5.44 0.00 -1.26 -4.62 119.74 123.84 1seb s LYS 97 Ca -0.15 -0.15 0.00 0.00 0.00 0.00 0.00 55.97 55.67 1seb s LYS 97 Cb -0.17 -3.37 0.00 0.00 0.00 0.00 0.00 37.83 34.29 1seb s LYS 97 CO 0.06 0.40 0.44 1.63 0.00 0.00 0.00 175.35 177.88 1seb n LYS 98 N 3.16 0.57 -3.64 1.78 4.01 -1.26 -5.21 118.16 117.57 1seb n LYS 98 Ca -0.16 0.00 -0.06 0.00 -0.51 0.00 0.00 58.31 57.58 1seb n LYS 98 Cb 0.53 -1.13 -0.07 0.00 -0.51 0.00 0.00 35.03 33.85 1seb n LYS 98 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1seb s LYS 111 N -1.55 0.26 0.01 1.97 -0.14 -1.26 -5.24 119.74 113.78 1seb s LYS 111 Ca 0.00 0.31 0.00 0.00 -1.36 0.00 0.00 55.97 54.92 1seb s LYS 111 Cb 0.00 0.12 -0.01 0.00 -1.68 0.00 0.00 37.83 36.27 1seb s LYS 111 CO 0.00 -0.03 -0.02 -0.08 -0.76 0.00 0.00 175.35 174.46 1seb s THR 112 N 0.14 0.14 0.09 2.17 -1.32 -1.23 -4.76 115.64 110.86 1seb s THR 112 Ca 0.05 -0.29 0.10 0.00 -1.21 0.00 0.00 61.69 60.35 1seb s THR 112 Cb -0.05 -0.16 -0.03 0.00 -1.51 0.00 0.00 72.50 70.74 1seb s THR 112 CO -0.12 -0.10 -0.26 0.00 -2.21 0.00 0.00 174.62 171.94 1seb s MET 114 N -1.66 0.47 -0.53 0.00 0.23 -0.12 -1.51 119.30 116.18 1seb s MET 114 Ca 0.13 0.59 -0.05 0.00 -1.03 0.00 0.00 55.69 55.33 1seb s MET 114 Cb -0.10 0.21 -0.02 0.00 -1.53 0.00 0.00 34.83 33.38 1seb s MET 114 CO 0.04 -0.07 2.95 0.66 -2.03 0.00 0.00 175.02 176.58 1seb n TYR 115 N 2.99 1.38 -1.52 3.16 4.02 -1.26 -1.01 117.16 124.91 1seb n TYR 115 Ca -0.14 -2.02 -0.33 0.00 -0.01 0.00 0.00 57.90 55.40 1seb n TYR 115 Cb 0.57 -1.57 0.07 0.00 -0.02 0.00 0.00 39.34 38.39 1seb n TYR 115 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1seb s GLY 116 N 0.89 2.11 -0.27 2.72 0.00 -1.26 -3.19 107.32 108.33 1seb s GLY 116 Ca 0.61 0.61 -0.15 0.00 0.00 0.00 0.00 44.72 45.79 1seb s GLY 116 CO -0.14 0.98 0.39 -0.32 0.00 0.00 0.00 173.10 174.01 1seb s GLY 117 N -2.54 1.88 -0.12 0.20 0.00 -1.24 -4.74 107.32 100.77 1seb s GLY 117 Ca 0.68 -0.79 0.01 0.00 0.00 0.00 0.00 44.72 44.62 1seb s GLY 117 CO 0.46 1.00 -0.16 -1.34 0.00 0.00 0.00 173.10 173.06 1seb s VAL 118 N 2.08 2.74 -0.08 1.40 -7.23 -1.26 -2.71 120.40 115.34 1seb s VAL 118 Ca 0.16 -0.77 0.03 0.00 -1.81 0.00 0.00 61.98 59.59 1seb s VAL 118 Cb -0.16 -2.13 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 1seb s VAL 118 CO 0.10 0.54 -0.18 0.42 -0.31 0.00 0.00 175.10 175.66 1seb s THR 119 N 0.34 2.69 0.00 5.32 -4.23 -0.44 -4.92 115.64 114.41 1seb s THR 119 Ca -0.13 -0.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 1seb s THR 119 Cb -0.17 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.62 1seb s THR 119 CO 0.07 0.56 0.00 1.21 -0.54 0.00 0.00 174.62 175.92 1seb n GLU 120 N 2.90 2.11 -4.34 3.99 2.13 -1.26 0.59 120.64 126.76 1seb n GLU 120 Ca -0.18 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.43 1seb n GLU 120 Cb 0.52 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 32.12 1seb n GLU 120 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1seb s HIS 121 N 0.00 1.85 0.04 4.31 3.76 -1.26 -4.44 115.29 119.55 1seb s HIS 121 Ca 0.00 -0.47 -0.27 0.00 -0.15 0.00 0.00 55.06 54.17 1seb s HIS 121 Cb 0.00 -0.91 0.07 0.00 1.11 0.00 0.00 32.58 32.85 1seb s HIS 121 CO 0.00 0.35 0.66 -0.51 -0.85 0.00 0.00 174.74 174.39 1seb s ASP 127 N -2.73 -0.61 0.00 1.40 1.01 -1.26 -4.93 116.67 109.55 1seb s ASP 127 Ca 0.17 0.37 0.00 0.00 0.71 0.00 0.00 52.55 53.80 1seb s ASP 127 Cb -0.05 0.56 0.00 0.00 1.01 0.00 0.00 42.92 44.43 1seb s ASP 127 CO 0.07 -0.76 0.00 2.29 0.21 0.00 0.00 175.17 176.98 1seb n LYS 128 N 0.30 0.00 -2.20 8.23 -0.00 -1.26 -5.14 118.16 118.09 1seb n LYS 128 Ca -0.18 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 57.85 1seb n LYS 128 Cb 0.61 0.00 0.02 0.00 -0.00 0.00 0.00 35.03 35.66 1seb n LYS 128 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1seb s TYR 129 N -2.00 3.43 -0.17 5.58 2.02 -1.26 -4.52 117.35 120.42 1seb s TYR 129 Ca 0.00 0.93 -0.12 0.00 -0.37 0.00 0.00 57.07 57.51 1seb s TYR 129 Cb 0.00 -2.71 0.05 0.00 -0.40 0.00 0.00 41.96 38.90 1seb s TYR 129 CO 0.00 -0.75 0.44 0.50 -1.57 0.00 0.00 175.55 174.16 1seb s ARG 130 N -5.07 0.46 0.39 -0.62 3.52 -1.22 -4.94 118.95 111.47 1seb s ARG 130 Ca 0.54 0.74 -0.01 0.00 -0.13 0.00 0.00 55.73 56.86 1seb s ARG 130 Cb -0.11 0.10 -0.03 0.00 -1.56 0.00 0.00 34.95 33.35 1seb s ARG 130 CO 0.49 -0.12 0.62 -1.12 -0.81 0.00 0.00 175.30 174.36 1seb s SER 131 N 0.93 6.27 0.13 -2.12 0.01 -1.26 -0.10 113.70 117.55 1seb s SER 131 Ca -0.06 0.57 -0.07 0.00 1.31 0.00 0.00 55.95 57.71 1seb s SER 131 Cb -0.06 -2.07 -0.01 0.00 0.21 0.00 0.00 66.02 64.09 1seb s SER 131 CO -0.08 -0.39 0.20 -0.63 0.41 0.00 0.00 173.24 172.75 1seb s ILE 132 N -2.44 0.10 -0.00 1.44 1.01 -0.48 -4.88 121.20 115.95 1seb s ILE 132 Ca 0.42 -1.46 -0.01 0.00 0.00 0.00 0.00 60.65 59.61 1seb s ILE 132 Cb -0.10 -1.72 -0.00 0.00 0.01 0.00 0.00 42.46 40.65 1seb s ILE 132 CO 0.38 -0.47 0.01 0.42 0.00 0.00 0.00 174.94 175.29 1seb s THR 133 N -3.95 0.02 0.00 2.92 -4.23 -1.26 -3.16 115.64 105.97 1seb s THR 133 Ca 0.14 -0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 1seb s THR 133 Cb 0.05 -0.08 0.00 0.00 1.34 0.00 0.00 72.50 73.81 1seb s THR 133 CO -0.03 -0.08 0.00 1.33 -0.54 0.00 0.00 174.62 175.30 1seb n VAL 134 N 2.82 0.00 -2.25 2.29 0.24 -1.26 -3.45 118.33 116.72 1seb n VAL 134 Ca -0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 1seb n VAL 134 Cb 0.59 -0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 1seb n VAL 134 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1seb n ARG 135 N -0.12 0.00 -1.45 7.34 1.74 -1.26 -4.33 116.66 118.58 1seb n ARG 135 Ca 0.00 0.00 0.18 0.00 -0.77 0.00 0.00 57.85 57.26 1seb n ARG 135 Cb 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.36 1seb n ARG 135 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 1seb n VAL 136 N 0.00 -0.43 0.00 1.55 3.14 -1.26 -2.92 118.33 118.41 1seb n VAL 136 Ca 0.00 0.70 0.00 0.00 -2.96 0.00 0.00 64.34 62.08 1seb n VAL 136 Cb 0.00 -1.18 0.00 0.00 -1.06 0.00 0.00 33.84 31.60 1seb n VAL 136 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 1seb n PHE 137 N -4.31 0.00 0.00 1.45 7.35 -0.93 -4.60 117.46 116.41 1seb n PHE 137 Ca -0.06 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.63 1seb n PHE 137 Cb 0.68 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.51 1seb n PHE 137 CO 0.00 0.00 0.00 -1.91 -0.76 0.00 0.00 176.76 174.09 1seb n GLU 138 N -0.02 0.00 0.00 -4.13 4.07 -0.33 -2.93 120.64 117.30 1seb n GLU 138 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1seb n GLU 138 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1seb n GLU 138 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1seb n ASP 139 N 0.00 0.00 -1.08 4.31 9.92 -1.25 -1.51 116.55 126.93 1seb n ASP 139 Ca 0.00 0.00 0.04 0.00 -0.53 0.00 0.00 54.79 54.30 1seb n ASP 139 Cb 0.00 0.00 0.07 0.00 -0.64 0.00 0.00 41.12 40.55 1seb n ASP 139 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1seb n GLY 140 N 0.00 2.17 3.76 0.44 0.00 -1.25 -4.95 105.19 105.37 1seb n GLY 140 Ca 0.00 -0.88 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 1seb n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1seb s LYS 141 N -0.95 4.15 0.03 1.61 3.01 -0.57 -4.95 119.74 122.06 1seb s LYS 141 Ca 0.31 0.27 -0.24 0.00 -1.01 0.00 0.00 55.97 55.30 1seb s LYS 141 Cb 0.33 -3.36 -0.05 0.00 -1.01 0.00 0.00 37.83 33.74 1seb s LYS 141 CO -0.11 0.37 0.73 -0.80 0.51 0.00 0.00 175.35 176.04 1seb s ASN 142 N 0.01 7.15 -0.03 2.83 0.01 -1.26 -2.20 114.94 121.46 1seb s ASN 142 Ca 0.21 1.37 0.01 0.00 -0.71 0.00 0.00 52.86 53.75 1seb s ASN 142 Cb -0.15 -2.44 0.03 0.00 0.41 0.00 0.00 41.25 39.10 1seb s ASN 142 CO 0.08 0.02 0.80 0.00 -1.51 0.00 0.00 177.10 176.49 1seb n LEU 143 N 2.88 -0.78 -3.52 0.60 -0.00 -1.26 -4.98 117.00 109.94 1seb n LEU 143 Ca -0.03 -1.60 -0.16 0.00 -0.00 0.00 0.00 56.01 54.22 1seb n LEU 143 Cb 0.50 0.03 -0.06 0.00 -0.00 0.00 0.00 43.42 43.90 1seb n LEU 143 CO 0.46 1.27 0.49 -0.76 -0.00 0.00 0.00 177.39 178.85 1seb s LEU 144 N -0.32 -0.61 0.23 1.47 1.43 -1.26 -5.05 118.68 114.57 1seb s LEU 144 Ca 0.01 0.61 0.03 0.00 -1.03 0.00 0.00 54.13 53.75 1seb s LEU 144 Cb 0.03 2.44 -0.05 0.00 0.03 0.00 0.00 46.19 48.64 1seb s LEU 144 CO -0.01 -0.60 0.00 -0.55 0.23 0.00 0.00 176.35 175.43 1seb s SER 145 N -1.31 1.73 -0.01 2.29 0.15 -1.26 -4.51 113.70 110.78 1seb s SER 145 Ca -0.09 -1.22 -0.29 0.00 0.70 0.00 0.00 55.95 55.06 1seb s SER 145 Cb -0.00 0.03 0.08 0.00 -1.71 0.00 0.00 66.02 64.42 1seb s SER 145 CO 0.07 -0.53 0.74 0.12 1.20 0.00 0.00 173.24 174.84 1seb s PHE 146 N -3.46 -0.55 -0.01 3.44 5.36 -1.26 -4.96 117.98 116.54 1seb s PHE 146 Ca 0.28 0.75 0.01 0.00 -0.96 0.00 0.00 56.93 57.01 1seb s PHE 146 Cb 0.06 0.47 -0.04 0.00 -0.34 0.00 0.00 43.02 43.17 1seb s PHE 146 CO 0.08 -0.61 0.01 0.16 -1.46 0.00 0.00 175.22 173.40 1seb s ASP 147 N -1.69 5.22 -0.29 6.13 -4.77 -1.26 -4.11 116.67 115.90 1seb s ASP 147 Ca -0.05 0.04 0.02 0.00 -3.30 0.00 0.00 52.55 49.26 1seb s ASP 147 Cb -0.00 -1.40 0.18 0.00 -1.09 0.00 0.00 42.92 40.61 1seb s ASP 147 CO 0.01 0.29 0.54 -0.69 0.70 0.00 0.00 175.17 176.02 1seb s VAL 148 N -1.07 -0.89 0.32 2.11 1.01 -1.19 -4.95 120.40 115.73 1seb s VAL 148 Ca 0.19 -0.06 0.07 0.00 0.00 0.00 0.00 61.98 62.18 1seb s VAL 148 Cb -0.12 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 1seb s VAL 148 CO 0.10 -0.06 0.42 -1.10 0.00 0.00 0.00 175.10 174.46 1seb s GLN 149 N 2.76 3.08 0.00 2.72 -0.21 -1.25 -1.39 119.66 125.37 1seb s GLN 149 Ca 0.14 -1.04 0.00 0.00 0.02 0.00 0.00 55.36 54.49 1seb s GLN 149 Cb -0.13 -2.76 0.00 0.00 1.00 0.00 0.00 33.01 31.12 1seb s GLN 149 CO -0.24 0.11 0.00 0.25 -2.12 0.00 0.00 175.29 173.30 1seb n THR 150 N -1.56 0.00 -3.83 -0.19 -2.24 0.85 -4.92 114.28 102.40 1seb n THR 150 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1seb n THR 150 Cb 0.58 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1seb n THR 150 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1seb n ASN 151 N 0.00 0.00 -4.83 3.42 3.02 -1.26 -3.37 115.26 112.24 1seb n ASN 151 Ca 0.00 -0.95 -0.30 0.00 -0.03 0.00 0.00 54.58 53.30 1seb n ASN 151 Cb 0.00 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.25 1seb n ASN 151 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1seb s LYS 152 N -1.85 2.23 0.00 3.52 -2.85 -1.26 -4.49 119.74 115.04 1seb s LYS 152 Ca 0.00 0.55 0.00 0.00 -1.00 0.00 0.00 55.97 55.52 1seb s LYS 152 Cb 0.00 -1.94 0.00 0.00 -2.06 0.00 0.00 37.83 33.83 1seb s LYS 152 CO 0.00 -1.50 0.00 0.36 0.10 0.00 0.00 175.35 174.31 1seb n LYS 153 N -3.34 0.00 0.00 1.78 0.00 -1.26 -4.93 118.16 110.41 1seb n LYS 153 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 1seb n LYS 153 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.60 1seb n LYS 153 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1seb n LYS 154 N 0.00 0.00 -4.44 -1.58 0.00 -1.26 -5.00 118.16 105.88 1seb n LYS 154 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.08 1seb n LYS 154 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 35.03 34.95 1seb n LYS 154 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1seb s VAL 155 N -2.00 0.48 0.43 0.58 1.01 -1.11 -4.88 120.40 114.92 1seb s VAL 155 Ca 0.00 -2.00 0.06 0.00 0.00 0.00 0.00 61.98 60.04 1seb s VAL 155 Cb 0.00 -2.43 -0.06 0.00 0.00 0.00 0.00 36.38 33.89 1seb s VAL 155 CO 0.00 0.00 0.01 0.42 0.00 0.00 0.00 175.10 175.53 1seb s THR 156 N -3.34 1.77 -0.88 3.92 -4.23 -1.26 0.17 115.64 111.79 1seb s THR 156 Ca 0.29 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.07 1seb s THR 156 Cb 0.03 -2.79 0.16 0.00 1.34 0.00 0.00 72.50 71.24 1seb s THR 156 CO 0.17 0.00 1.66 0.00 -0.54 0.00 0.00 174.62 175.91 1seb n ALA 157 N -1.03 2.73 -0.06 3.99 0.00 -0.51 -3.14 120.51 122.50 1seb n ALA 157 Ca -0.08 -0.17 -0.05 0.00 0.00 0.00 0.00 53.44 53.14 1seb n ALA 157 Cb 0.67 -1.33 -0.04 0.00 0.00 0.00 0.00 19.45 18.75 1seb n ALA 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 1seb h GLN 158 N 0.00 0.00 -0.71 0.00 -0.00 -1.94 -1.70 115.11 110.77 1seb h GLN 158 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 58.65 58.80 1seb h GLN 158 Cb 0.59 0.00 -0.11 0.00 -0.00 0.00 0.00 27.48 27.97 1seb h GLN 158 CO 0.00 0.26 0.15 1.49 -0.00 0.00 0.00 178.83 180.73 1seb h GLU 159 N -1.00 0.24 -0.14 0.06 4.81 -1.81 0.18 114.58 116.92 1seb h GLU 159 Ca -0.02 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1seb h GLU 159 Cb 0.35 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1seb h GLU 159 CO -0.01 0.16 -0.01 -0.07 -0.73 0.00 0.00 179.01 178.35 1seb h LEU 160 N 0.25 0.26 -2.03 1.64 3.38 -1.67 -1.59 115.31 115.53 1seb h LEU 160 Ca 0.40 -0.32 0.08 0.00 0.09 0.00 0.00 57.88 58.13 1seb h LEU 160 Cb 0.66 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1seb h LEU 160 CO -0.51 0.52 0.22 -0.78 0.09 0.00 0.00 178.44 177.98 1seb h ASP 161 N -0.01 0.00 0.20 -0.43 1.82 -0.08 -2.34 116.42 115.58 1seb h ASP 161 Ca 0.04 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.67 1seb h ASP 161 Cb 0.39 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.40 1seb h ASP 161 CO 0.01 0.00 -0.10 0.22 -1.61 0.00 0.00 179.24 177.76 1seb h TYR 162 N 0.00 -0.25 -1.09 0.28 3.20 -0.08 -3.09 116.97 115.93 1seb h TYR 162 Ca 0.14 -0.01 0.30 0.00 3.14 0.00 0.00 58.73 62.30 1seb h TYR 162 Cb 0.58 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.87 1seb h TYR 162 CO 0.00 -0.16 0.75 -0.07 -1.64 0.00 0.00 178.16 177.04 1seb h LEU 163 N -1.00 0.19 0.00 2.82 3.38 -0.97 0.77 115.31 120.51 1seb h LEU 163 Ca -0.03 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 1seb h LEU 163 Cb 0.21 0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1seb h LEU 163 CO 0.05 0.03 -0.43 0.71 0.09 0.00 0.00 178.44 178.89 1seb h THR 164 N 0.16 1.49 -0.17 0.22 1.35 -1.54 -3.28 112.91 111.14 1seb h THR 164 Ca 0.56 -2.03 -0.12 0.00 -0.55 0.00 0.00 66.41 64.27 1seb h THR 164 Cb 1.88 2.70 -0.01 0.00 -1.73 0.00 0.00 68.15 70.99 1seb h THR 164 CO -0.13 0.57 -0.41 0.03 -0.25 0.00 0.00 175.52 175.33 1seb h ARG 165 N -0.31 0.40 -1.02 4.72 3.08 -1.29 -2.62 114.38 117.34 1seb h ARG 165 Ca -0.05 -0.20 0.25 0.00 0.07 0.00 0.00 59.98 60.05 1seb h ARG 165 Cb 1.17 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.12 1seb h ARG 165 CO 0.08 0.75 0.65 1.25 -1.07 0.00 0.00 179.97 181.63 1seb h HIS 166 N 0.33 0.76 0.00 3.04 2.76 -0.94 0.20 115.15 121.30 1seb h HIS 166 Ca 0.03 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1seb h HIS 166 Cb 0.87 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 29.61 1seb h HIS 166 CO 0.03 0.08 -1.63 0.66 -1.30 0.00 0.00 177.93 175.77 1seb n TYR 167 N -4.68 0.38 0.08 5.26 4.02 -1.11 -3.73 117.16 117.38 1seb n TYR 167 Ca 0.25 0.11 -0.09 0.00 -0.01 0.00 0.00 57.90 58.16 1seb n TYR 167 Cb 0.81 -0.69 -0.02 0.00 -0.02 0.00 0.00 39.34 39.43 1seb n TYR 167 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1seb h LEU 168 N 0.00 0.24 -0.10 7.72 3.38 -0.64 0.73 115.31 126.65 1seb h LEU 168 Ca -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1seb h LEU 168 Cb 1.02 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1seb h LEU 168 CO 0.00 1.02 -0.04 0.58 0.09 0.00 0.00 178.44 180.10 1seb h VAL 169 N 0.10 1.31 -0.31 1.22 2.07 -1.39 0.81 116.25 120.05 1seb h VAL 169 Ca -0.05 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 1seb h VAL 169 Cb 1.55 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 1seb h VAL 169 CO 0.14 0.29 0.02 0.50 0.02 0.00 0.00 177.57 178.53 1seb h LYS 170 N -0.15 0.53 0.00 1.57 3.64 -1.63 0.89 116.57 121.42 1seb h LYS 170 Ca 0.02 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1seb h LYS 170 Cb 0.47 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1seb h LYS 170 CO 0.01 0.66 -1.07 0.09 -2.27 0.00 0.00 179.45 176.87 1seb n ASN 171 N -4.58 0.72 0.00 4.20 3.02 0.25 -4.54 115.26 114.34 1seb n ASN 171 Ca -0.02 -0.61 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 1seb n ASN 171 Cb 0.24 0.99 0.00 0.00 -0.61 0.00 0.00 39.78 40.41 1seb n ASN 171 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1seb n LYS 172 N -1.70 0.04 -3.84 3.52 4.76 0.25 -5.00 118.16 116.19 1seb n LYS 172 Ca 0.03 -0.41 -0.24 0.00 -2.87 0.00 0.00 58.31 54.82 1seb n LYS 172 Cb 0.38 -0.51 0.00 0.00 -1.84 0.00 0.00 35.03 33.07 1seb n LYS 172 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1seb n LYS 173 N -0.01 -3.80 -0.28 1.97 5.02 0.31 -4.85 118.16 116.52 1seb n LYS 173 Ca 0.00 0.49 0.07 0.00 -2.02 0.00 0.00 58.31 56.85 1seb n LYS 173 Cb 0.44 -4.76 0.30 0.00 -0.02 0.00 0.00 35.03 31.00 1seb n LYS 173 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1seb h LEU 174 N -1.85 0.80 -6.65 -0.35 4.07 -1.54 -3.47 115.31 106.32 1seb h LEU 174 Ca -0.63 0.02 -0.60 0.00 0.08 0.00 0.00 57.88 56.76 1seb h LEU 174 Cb 1.37 -0.14 -0.39 0.00 1.08 0.00 0.00 40.66 42.57 1seb h LEU 174 CO 0.59 0.47 -0.84 -0.31 -1.08 0.00 0.00 178.44 177.28 1seb s TYR 175 N -5.81 1.60 -0.01 1.13 2.02 -1.26 -5.00 117.35 110.02 1seb s TYR 175 Ca -0.11 -2.38 -0.03 0.00 -0.37 0.00 0.00 57.07 54.18 1seb s TYR 175 Cb 0.21 -1.40 -0.28 0.00 -0.40 0.00 0.00 41.96 40.09 1seb s TYR 175 CO 0.79 -0.77 0.80 1.49 -1.57 0.00 0.00 175.55 176.29 1seb h GLU 183 N 6.08 0.25 -3.36 -0.62 4.57 -1.89 -3.48 114.58 116.14 1seb h GLU 183 Ca 0.15 -0.43 -0.16 0.00 -1.18 0.00 0.00 59.36 57.75 1seb h GLU 183 Cb 0.90 0.16 -0.23 0.00 -0.16 0.00 0.00 28.75 29.42 1seb h GLU 183 CO 0.43 1.11 -0.47 0.95 -1.18 0.00 0.00 179.01 179.84 1seb s THR 184 N -2.61 0.04 -0.00 0.32 -4.23 -1.26 -1.64 115.64 106.27 1seb s THR 184 Ca -0.10 -0.36 -0.11 0.00 -1.18 0.00 0.00 61.69 59.93 1seb s THR 184 Cb 0.07 -0.38 0.01 0.00 1.34 0.00 0.00 72.50 73.54 1seb s THR 184 CO 0.85 -0.20 0.23 -0.83 -0.54 0.00 0.00 174.62 174.13 1seb s GLY 185 N -0.71 -0.06 -0.28 3.99 0.00 -1.26 0.26 107.32 109.26 1seb s GLY 185 Ca -0.08 0.10 -0.19 0.00 0.00 0.00 0.00 44.72 44.55 1seb s GLY 185 CO 0.01 -0.08 0.87 -2.52 0.00 0.00 0.00 173.10 171.39 1seb s TYR 186 N -1.40 -0.72 -0.23 1.90 -0.85 -0.11 -1.93 117.35 114.01 1seb s TYR 186 Ca -0.14 1.53 -0.18 0.00 -0.52 0.00 0.00 57.07 57.77 1seb s TYR 186 Cb -0.06 0.43 -0.03 0.00 0.38 0.00 0.00 41.96 42.67 1seb s TYR 186 CO 0.03 -0.36 0.49 -1.50 -1.52 0.00 0.00 175.55 172.69 1seb s ILE 187 N 1.08 5.11 -0.23 -3.49 2.07 -1.11 -0.32 121.20 124.31 1seb s ILE 187 Ca -0.06 0.86 -0.09 0.00 -1.41 0.00 0.00 60.65 59.96 1seb s ILE 187 Cb -0.04 -3.81 -0.04 0.00 0.13 0.00 0.00 42.46 38.69 1seb s ILE 187 CO -0.13 0.15 0.12 -1.59 -1.91 0.00 0.00 174.94 171.58 1seb s LYS 188 N 1.87 3.97 -0.27 3.50 0.00 0.48 -1.38 119.74 127.92 1seb s LYS 188 Ca 0.22 -0.33 -0.10 0.00 0.00 0.00 0.00 55.97 55.76 1seb s LYS 188 Cb -0.15 -3.41 -0.04 0.00 0.00 0.00 0.00 37.83 34.22 1seb s LYS 188 CO 0.09 0.07 0.15 -0.06 0.00 0.00 0.00 175.35 175.60 1seb s PHE 189 N 0.97 3.18 -0.27 1.78 0.08 0.14 -1.71 117.98 122.15 1seb s PHE 189 Ca 0.06 -0.05 -0.06 0.00 0.12 0.00 0.00 56.93 57.00 1seb s PHE 189 Cb -0.14 -2.32 -0.00 0.00 -0.57 0.00 0.00 43.02 39.99 1seb s PHE 189 CO 0.03 -0.21 0.05 0.42 -0.10 0.00 0.00 175.22 175.42 1seb s ILE 190 N 1.66 3.92 0.00 0.64 -1.09 0.19 -2.09 121.20 124.43 1seb s ILE 190 Ca 0.07 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 57.93 1seb s ILE 190 Cb -0.16 -2.94 0.00 0.00 -1.58 0.00 0.00 42.46 37.78 1seb s ILE 190 CO 0.08 0.19 0.00 -0.62 -1.23 0.00 0.00 174.94 173.37 1seb n GLU 191 N 4.86 3.22 0.00 2.79 1.02 0.14 -0.48 120.64 132.20 1seb n GLU 191 Ca -0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 1seb n GLU 191 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.91 1seb n GLU 191 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1seb n ASN 192 N -0.37 0.00 -0.84 1.62 3.02 -1.26 -3.73 115.26 113.70 1seb n ASN 192 Ca 0.00 0.32 0.07 0.00 -0.03 0.00 0.00 54.58 54.94 1seb n ASN 192 Cb 0.00 0.00 0.22 0.00 -0.61 0.00 0.00 39.78 39.39 1seb n ASN 192 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1seb n GLU 193 N -0.50 2.99 -4.42 3.52 4.71 -1.26 -4.99 120.64 120.69 1seb n GLU 193 Ca 0.00 -2.45 -0.35 0.00 -0.01 0.00 0.00 57.16 54.35 1seb n GLU 193 Cb 0.00 -1.56 -0.10 0.00 -1.01 0.00 0.00 31.44 28.77 1seb n GLU 193 CO 0.00 0.00 0.00 -0.80 0.09 0.00 0.00 177.13 176.42 1seb s ASN 194 N -1.35 5.09 -0.24 1.62 0.01 -1.24 -4.29 114.94 114.53 1seb s ASN 194 Ca 0.34 0.09 -0.03 0.00 -0.71 0.00 0.00 52.86 52.54 1seb s ASN 194 Cb 0.23 -1.44 0.13 0.00 0.41 0.00 0.00 41.25 40.58 1seb s ASN 194 CO 0.14 0.36 0.40 -0.94 -1.51 0.00 0.00 177.10 175.55 1seb s SER 195 N -0.77 0.06 0.14 -1.22 1.04 -1.25 0.28 113.70 111.99 1seb s SER 195 Ca 0.12 0.39 0.10 0.00 0.48 0.00 0.00 55.95 57.03 1seb s SER 195 Cb -0.11 1.22 -0.04 0.00 0.10 0.00 0.00 66.02 67.18 1seb s SER 195 CO 0.02 -0.29 -0.23 0.72 0.98 0.00 0.00 173.24 174.45 1seb s PHE 196 N 2.58 2.04 0.01 5.02 -0.71 -0.89 -2.85 117.98 123.18 1seb s PHE 196 Ca 0.11 -0.41 0.04 0.00 -1.04 0.00 0.00 56.93 55.63 1seb s PHE 196 Cb -0.15 -1.07 -0.01 0.00 -1.21 0.00 0.00 43.02 40.58 1seb s PHE 196 CO -0.16 0.33 -0.11 1.67 -1.34 0.00 0.00 175.22 175.61 1seb s TRP 197 N -1.44 1.02 -0.22 3.49 1.48 -1.26 0.27 118.94 122.27 1seb s TRP 197 Ca 0.13 -0.26 0.02 0.00 -1.06 0.00 0.00 56.10 54.94 1seb s TRP 197 Cb -0.09 -0.63 0.04 0.00 -1.16 0.00 0.00 33.47 31.63 1seb s TRP 197 CO 0.06 -0.00 -0.15 0.71 -4.06 0.00 0.00 176.95 173.51 1seb s TYR 198 N -0.52 3.01 0.89 1.66 2.02 -0.48 -4.97 117.35 118.96 1seb s TYR 198 Ca 0.02 -2.00 -0.17 0.00 -0.37 0.00 0.00 57.07 54.56 1seb s TYR 198 Cb -0.06 -1.91 -0.12 0.00 -0.40 0.00 0.00 41.96 39.47 1seb s TYR 198 CO 0.00 -0.84 -0.48 -3.47 -1.57 0.00 0.00 175.55 169.19 1seb n ASP 199 N 4.53 -4.92 0.00 2.29 -0.08 -1.26 -2.76 116.55 114.34 1seb n ASP 199 Ca -0.17 0.31 0.00 0.00 -1.51 0.00 0.00 54.79 53.42 1seb n ASP 199 Cb 0.46 -0.85 0.00 0.00 2.34 0.00 0.00 41.12 43.07 1seb n ASP 199 CO 0.00 0.00 0.00 0.23 0.12 0.00 0.00 177.20 177.55 1seb n MET 200 N 1.68 5.53 -4.46 -0.67 2.81 -0.81 -4.76 117.12 116.44 1seb n MET 200 Ca 0.01 -0.04 -0.33 0.00 -1.81 0.00 0.00 57.70 55.54 1seb n MET 200 Cb 0.54 -0.49 -0.10 0.00 -0.71 0.00 0.00 33.22 32.46 1seb n MET 200 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1seb s MET 201 N -0.80 2.62 1.18 0.03 -1.94 -1.26 -4.93 119.30 114.20 1seb s MET 201 Ca 0.00 -0.67 -0.17 0.00 -1.71 0.00 0.00 55.69 53.13 1seb s MET 201 Cb 0.00 -2.54 0.21 0.00 2.01 0.00 0.00 34.83 34.51 1seb s MET 201 CO 0.00 0.62 0.44 -0.35 -0.01 0.00 0.00 175.02 175.72 1seb n PRO 202 N 1.65 -2.47 -1.40 2.03 -0.04 -1.26 -4.77 135.00 128.74 1seb n PRO 202 Ca -0.16 -0.71 -0.30 0.00 -0.04 0.00 0.00 63.50 62.29 1seb n PRO 202 Cb 0.53 -1.82 0.23 0.00 -0.04 0.00 0.00 33.50 32.39 1seb n PRO 202 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1seb s ALA 203 N -2.23 1.19 0.00 0.55 0.00 -1.26 -4.55 121.76 115.45 1seb s ALA 203 Ca 0.58 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 51.43 1seb s ALA 203 Cb -0.15 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.16 1seb s ALA 203 CO 0.60 -3.24 1.14 -0.35 0.00 0.00 0.00 175.76 173.91 1seb n PRO 204 N -4.45 0.95 0.00 0.00 -0.04 -1.26 -4.41 135.00 125.79 1seb n PRO 204 Ca 0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1seb n PRO 204 Cb 0.60 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 33.03 1seb n PRO 204 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1seb n GLY 205 N 0.73 6.04 0.11 0.55 0.00 -1.24 -4.79 105.19 106.60 1seb n GLY 205 Ca 0.00 -1.71 -0.23 0.00 0.00 0.00 0.00 46.02 44.07 1seb n GLY 205 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1seb n ASP 206 N 0.00 1.89 -4.79 1.61 8.00 -1.26 -0.83 116.55 121.17 1seb n ASP 206 Ca 0.00 0.40 -0.38 0.00 0.71 0.00 0.00 54.79 55.52 1seb n ASP 206 Cb 0.00 -0.91 -0.06 0.00 -0.02 0.00 0.00 41.12 40.14 1seb n ASP 206 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1seb s LYS 207 N -2.42 4.15 -0.37 -1.24 1.02 -1.26 -2.54 119.74 117.08 1seb s LYS 207 Ca -0.31 0.56 -0.11 0.00 0.02 0.00 0.00 55.97 56.12 1seb s LYS 207 Cb 0.09 -3.29 0.02 0.00 -0.52 0.00 0.00 37.83 34.13 1seb s LYS 207 CO 0.53 0.51 0.22 0.12 -0.92 0.00 0.00 175.35 175.81 1seb s PHE 208 N -0.57 3.24 -0.90 3.18 5.36 -1.26 -4.88 117.98 122.14 1seb s PHE 208 Ca 0.27 -0.88 -0.22 0.00 -0.96 0.00 0.00 56.93 55.13 1seb s PHE 208 Cb -0.17 -2.45 0.08 0.00 -0.34 0.00 0.00 43.02 40.13 1seb s PHE 208 CO 0.15 -0.63 1.26 0.34 -1.46 0.00 0.00 175.22 174.88 1seb s ASP 209 N 1.58 6.45 0.25 6.13 -1.08 -1.26 -4.90 116.67 123.84 1seb s ASP 209 Ca 0.03 -1.44 -0.06 0.00 -0.52 0.00 0.00 52.55 50.56 1seb s ASP 209 Cb -0.19 -2.49 0.46 0.00 -1.46 0.00 0.00 42.92 39.23 1seb s ASP 209 CO 0.07 -1.41 1.63 1.56 0.52 0.00 0.00 175.17 177.55 1seb h GLN 210 N 9.50 0.10 -0.60 4.34 4.20 -1.93 0.89 115.11 131.61 1seb h GLN 210 Ca 0.05 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1seb h GLN 210 Cb 1.03 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.76 1seb h GLN 210 CO 1.27 0.07 0.36 0.66 -0.67 0.00 0.00 178.83 180.52 1seb h SER 211 N 0.10 0.71 0.49 1.46 4.64 -1.90 -2.02 113.55 117.02 1seb h SER 211 Ca 0.42 -0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.68 1seb h SER 211 Cb 0.75 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1seb h SER 211 CO -0.68 0.55 -0.23 0.11 -0.87 0.00 0.00 176.83 175.71 1seb h LYS 212 N 0.82 -0.63 -0.09 4.77 1.57 -1.25 -2.90 116.57 118.87 1seb h LYS 212 Ca 0.22 0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.06 1seb h LYS 212 Cb -0.03 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 1seb h LYS 212 CO -0.04 -0.37 -0.50 -0.92 -0.57 0.00 0.00 179.45 177.05 1seb h TYR 213 N -0.77 -1.49 0.00 -1.35 3.20 -1.02 -0.39 116.97 115.14 1seb h TYR 213 Ca -0.07 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1seb h TYR 213 Cb 0.55 0.66 0.00 0.00 1.54 0.00 0.00 36.73 39.49 1seb h TYR 213 CO -0.02 -0.51 0.00 1.28 -1.64 0.00 0.00 178.16 177.27 1seb n LEU 214 N -5.22 0.00 0.26 2.82 4.77 -0.80 -2.15 117.00 116.68 1seb n LEU 214 Ca -0.06 0.22 0.14 0.00 -0.03 0.00 0.00 56.01 56.29 1seb n LEU 214 Cb 0.35 -0.22 0.63 0.00 -2.33 0.00 0.00 43.42 41.85 1seb n LEU 214 CO 0.09 -0.19 0.93 -0.03 -1.33 0.00 0.00 177.39 176.86 1seb h MET 215 N 0.00 0.00 0.00 3.23 4.05 -0.84 -3.02 114.93 118.35 1seb h MET 215 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1seb h MET 215 Cb 0.04 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 1seb h MET 215 CO 0.00 0.10 0.00 0.00 0.23 0.00 0.00 176.91 177.24 1seb h MET 216 N 0.00 0.00 -0.02 0.39 -0.00 -1.59 0.19 114.93 113.90 1seb h MET 216 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1seb h MET 216 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.16 1seb h MET 216 CO 0.01 0.00 -0.09 0.66 -0.00 0.00 0.00 176.91 177.49 1seb n TYR 217 N -2.71 0.00 0.34 -0.10 4.01 -1.14 -4.39 117.16 113.16 1seb n TYR 217 Ca -0.02 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.91 1seb n TYR 217 Cb 0.06 -0.02 1.05 0.00 -0.31 0.00 0.00 39.34 40.12 1seb n TYR 217 CO 0.00 0.00 0.00 -2.95 -0.46 0.00 0.00 176.86 173.45 1seb h ASN 218 N 2.93 0.00 -3.05 7.72 7.08 -0.57 -3.31 115.58 126.37 1seb h ASN 218 Ca 0.00 0.00 -0.66 0.00 -3.08 0.00 0.00 56.30 52.56 1seb h ASN 218 Cb 0.69 0.00 -0.16 0.00 -2.08 0.00 0.00 38.32 36.76 1seb h ASN 218 CO 0.00 0.00 0.28 1.51 -2.08 0.00 0.00 177.43 177.14 1seb s ASP 219 N -4.86 6.23 -0.84 6.14 -4.77 -1.26 -1.76 116.67 115.54 1seb s ASP 219 Ca -0.04 -0.90 -0.24 0.00 -3.30 0.00 0.00 52.55 48.07 1seb s ASP 219 Cb 0.11 -2.35 -0.17 0.00 -1.09 0.00 0.00 42.92 39.42 1seb s ASP 219 CO 0.36 -1.12 2.32 -3.20 0.70 0.00 0.00 175.17 174.22 1seb n ASN 220 N 6.80 1.35 -4.55 2.11 5.15 -1.25 -4.85 115.26 120.02 1seb n ASN 220 Ca -0.05 -1.57 -0.43 0.00 -0.60 0.00 0.00 54.58 51.93 1seb n ASN 220 Cb 0.45 -1.55 -0.04 0.00 -0.53 0.00 0.00 39.78 38.11 1seb n ASN 220 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1seb s LYS 221 N 8.62 3.47 -0.05 1.20 2.47 -1.26 -5.03 119.74 129.16 1seb s LYS 221 Ca 0.93 0.03 -0.04 0.00 -1.56 0.00 0.00 55.97 55.33 1seb s LYS 221 Cb -0.18 -3.95 -0.04 0.00 -1.46 0.00 0.00 37.83 32.20 1seb s LYS 221 CO 0.14 -1.24 0.14 -1.64 0.16 0.00 0.00 175.35 172.91 1seb s MET 222 N 3.69 3.37 0.05 4.03 -1.94 -1.26 -1.42 119.30 125.82 1seb s MET 222 Ca 0.34 -0.28 0.03 0.00 -1.71 0.00 0.00 55.69 54.07 1seb s MET 222 Cb -0.11 -3.08 -0.03 0.00 2.01 0.00 0.00 34.83 33.62 1seb s MET 222 CO 0.24 0.71 -0.09 0.08 -0.01 0.00 0.00 175.02 175.95 1seb s VAL 223 N -1.18 0.67 -0.41 -6.03 1.01 0.13 -4.89 120.40 109.70 1seb s VAL 223 Ca 0.22 -1.19 -0.27 0.00 0.00 0.00 0.00 61.98 60.74 1seb s VAL 223 Cb -0.12 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.50 1seb s VAL 223 CO 0.12 -0.38 1.02 -1.81 0.00 0.00 0.00 175.10 174.04 1seb s ASP 224 N -1.71 6.67 0.42 3.32 1.01 -1.26 -2.74 116.67 122.37 1seb s ASP 224 Ca -0.07 0.52 0.18 0.00 0.71 0.00 0.00 52.55 53.89 1seb s ASP 224 Cb -0.09 -2.50 1.10 0.00 1.01 0.00 0.00 42.92 42.43 1seb s ASP 224 CO 0.00 -1.03 1.85 0.77 0.21 0.00 0.00 175.17 176.98 1seb h SER 225 N 8.78 0.40 0.06 0.27 4.64 -1.95 -2.30 113.55 123.44 1seb h SER 225 Ca -0.23 0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.05 1seb h SER 225 Cb 1.07 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1seb h SER 225 CO 1.05 0.16 -0.28 0.11 -0.87 0.00 0.00 176.83 177.00 1seb h LYS 226 N 0.39 0.34 0.00 4.77 1.57 -1.92 -3.31 116.57 118.41 1seb h LYS 226 Ca 0.47 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1seb h LYS 226 Cb 1.19 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1seb h LYS 226 CO -0.17 0.59 -0.01 -0.25 -0.57 0.00 0.00 179.45 179.04 1seb n ASP 227 N -4.12 1.69 -4.78 0.86 9.92 -0.95 -5.04 116.55 114.12 1seb n ASP 227 Ca -0.01 -1.92 -0.38 0.00 -0.53 0.00 0.00 54.79 51.95 1seb n ASP 227 Cb 0.40 -0.03 -0.06 0.00 -0.64 0.00 0.00 41.12 40.78 1seb n ASP 227 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1seb s VAL 228 N -0.96 4.27 -0.17 2.53 -7.23 -0.91 -4.71 120.40 113.22 1seb s VAL 228 Ca 0.02 1.75 0.00 0.00 -1.81 0.00 0.00 61.98 61.94 1seb s VAL 228 Cb 0.02 -4.05 0.04 0.00 0.56 0.00 0.00 36.38 32.94 1seb s VAL 228 CO 0.00 0.26 -0.08 -0.54 -0.31 0.00 0.00 175.10 174.43 1seb s LYS 229 N -1.78 1.77 0.33 4.82 1.02 0.37 -4.68 119.74 121.61 1seb s LYS 229 Ca 0.45 -0.62 0.07 0.00 0.02 0.00 0.00 55.97 55.89 1seb s LYS 229 Cb -0.20 -2.14 -0.01 0.00 -0.52 0.00 0.00 37.83 34.96 1seb s LYS 229 CO 0.25 -0.39 0.44 -1.50 -0.92 0.00 0.00 175.35 173.22 1seb s ILE 230 N 1.53 3.99 -0.28 2.17 2.07 -1.22 0.54 121.20 130.00 1seb s ILE 230 Ca 0.01 -1.06 -0.18 0.00 -1.41 0.00 0.00 60.65 58.00 1seb s ILE 230 Cb -0.15 -3.37 0.08 0.00 0.13 0.00 0.00 42.46 39.15 1seb s ILE 230 CO -0.08 -0.16 0.73 -1.83 -1.91 0.00 0.00 174.94 171.68 1seb s GLU 231 N -4.14 0.71 -0.64 3.50 4.04 -0.69 -4.28 118.70 117.20 1seb s GLU 231 Ca 0.44 1.12 -0.06 0.00 0.04 0.00 0.00 54.97 56.51 1seb s GLU 231 Cb -0.09 0.20 0.17 0.00 0.02 0.00 0.00 34.13 34.43 1seb s GLU 231 CO 0.30 -0.13 0.49 0.08 -1.84 0.00 0.00 175.26 174.16 1seb s VAL 232 N 1.29 4.18 -0.84 1.83 1.01 -1.15 -0.39 120.40 126.35 1seb s VAL 232 Ca -0.07 -2.64 -0.23 0.00 0.00 0.00 0.00 61.98 59.03 1seb s VAL 232 Cb -0.05 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.70 1seb s VAL 232 CO -0.14 -0.89 1.23 -0.31 0.00 0.00 0.00 175.10 174.99 1seb s TYR 233 N 0.25 2.58 0.08 5.22 1.51 0.57 -4.31 117.35 123.25 1seb s TYR 233 Ca 0.15 -0.62 -0.02 0.00 -1.01 0.00 0.00 57.07 55.56 1seb s TYR 233 Cb -0.19 -4.52 -0.05 0.00 -0.11 0.00 0.00 41.96 37.10 1seb s TYR 233 CO -0.04 -1.84 0.28 -0.51 -1.11 0.00 0.00 175.55 172.32 1seb s LEU 234 N 4.62 4.33 0.00 -1.29 1.43 -1.26 -0.93 118.68 125.58 1seb s LEU 234 Ca 0.35 0.42 0.04 0.00 -1.03 0.00 0.00 54.13 53.90 1seb s LEU 234 Cb -0.07 -3.05 0.03 0.00 0.03 0.00 0.00 46.19 43.13 1seb s LEU 234 CO 0.02 0.14 0.62 0.41 0.23 0.00 0.00 176.35 177.77