#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t0g n GLY 2 N 0.00 0.95 2.48 3.03 0.00 -1.26 -5.08 105.19 105.31 1t0g n GLY 2 Ca 0.00 -1.25 0.07 0.00 0.00 0.00 0.00 46.02 44.85 1t0g n GLY 2 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1t0g n HIS 3 N 1.42 -2.48 -0.75 1.61 8.25 -1.26 -4.92 115.22 117.09 1t0g n HIS 3 Ca 0.00 0.67 0.00 0.00 -0.26 0.00 0.00 57.72 58.13 1t0g n HIS 3 Cb 0.00 -1.21 0.00 0.00 1.12 0.00 0.00 29.99 29.90 1t0g n HIS 3 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1t0g n HIS 4 N -2.22 0.00 -3.05 4.41 -0.00 -1.26 -4.81 115.22 108.29 1t0g n HIS 4 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.33 1t0g n HIS 4 Cb 0.25 -0.47 -0.05 0.00 -0.00 0.00 0.00 29.99 29.72 1t0g n HIS 4 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 1t0g s HIS 5 N -2.95 3.61 0.42 4.41 -0.00 -1.25 -1.47 115.29 118.06 1t0g s HIS 5 Ca 0.00 1.27 0.04 0.00 -0.00 0.00 0.00 55.06 56.38 1t0g s HIS 5 Cb 0.00 -2.79 -0.05 0.00 -0.00 0.00 0.00 32.58 29.74 1t0g s HIS 5 CO 0.00 0.13 0.03 -1.01 -0.00 0.00 0.00 174.74 173.90 1t0g s HIS 6 N 0.60 2.12 -0.08 0.38 3.76 -1.20 -4.92 115.29 115.95 1t0g s HIS 6 Ca 0.37 -0.89 0.13 0.00 -0.15 0.00 0.00 55.06 54.52 1t0g s HIS 6 Cb -0.18 -1.54 -0.06 0.00 1.11 0.00 0.00 32.58 31.91 1t0g s HIS 6 CO 0.19 0.19 1.22 1.25 -0.85 0.00 0.00 174.74 176.73 1t0g h HIS 7 N 1.74 0.00 0.27 1.40 2.76 -2.02 -3.35 115.15 115.95 1t0g h HIS 7 Ca -0.42 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 57.74 1t0g h HIS 7 Cb 1.27 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.23 1t0g h HIS 7 CO 1.02 0.66 -0.13 0.45 -1.30 0.00 0.00 177.93 178.63 1t0g h HIS 8 N 0.00 -0.34 -2.94 5.26 -0.00 -1.98 -3.47 115.15 111.68 1t0g h HIS 8 Ca -0.06 -0.01 -0.12 0.00 -0.00 0.00 0.00 60.37 60.18 1t0g h HIS 8 Cb 1.56 0.11 -0.22 0.00 -0.00 0.00 0.00 27.41 28.86 1t0g h HIS 8 CO 0.00 -0.21 -0.27 -0.48 -0.00 0.00 0.00 177.93 176.97 1t0g s LEU 9 N -6.92 0.72 -0.16 2.43 -0.00 -1.26 -5.03 118.68 108.46 1t0g s LEU 9 Ca -0.05 0.35 -0.17 0.00 -0.00 0.00 0.00 54.13 54.26 1t0g s LEU 9 Cb 0.01 1.29 -0.04 0.00 -0.00 0.00 0.00 46.19 47.45 1t0g s LEU 9 CO 0.16 -0.33 0.42 -1.83 -0.00 0.00 0.00 176.35 174.77 1t0g s GLU 10 N -0.75 4.26 -0.08 1.48 1.03 -1.25 -3.23 118.70 120.16 1t0g s GLU 10 Ca -0.08 0.30 -0.14 0.00 0.03 0.00 0.00 54.97 55.08 1t0g s GLU 10 Cb -0.04 -3.48 -0.05 0.00 -0.80 0.00 0.00 34.13 29.76 1t0g s GLU 10 CO 0.03 0.08 0.34 -2.00 -1.33 0.00 0.00 175.26 172.38 1t0g s GLU 11 N 0.91 3.98 0.00 -4.83 2.12 -0.54 -1.03 118.70 119.31 1t0g s GLU 11 Ca 0.22 0.24 0.07 0.00 0.36 0.00 0.00 54.97 55.86 1t0g s GLU 11 Cb -0.15 -3.30 -0.02 0.00 0.26 0.00 0.00 34.13 30.93 1t0g s GLU 11 CO 0.08 0.52 -0.22 -0.06 -0.54 0.00 0.00 175.26 175.04 1t0g s PHE 12 N -0.45 1.97 -0.02 5.30 0.08 0.11 -3.79 117.98 121.17 1t0g s PHE 12 Ca 0.21 -0.38 -0.03 0.00 0.12 0.00 0.00 56.93 56.85 1t0g s PHE 12 Cb -0.15 -1.24 -0.04 0.00 -0.57 0.00 0.00 43.02 41.03 1t0g s PHE 12 CO 0.09 0.01 0.16 0.99 -0.10 0.00 0.00 175.22 176.38 1t0g s THR 13 N -0.61 5.36 0.19 0.64 2.01 -1.26 0.10 115.64 122.07 1t0g s THR 13 Ca 0.09 -0.14 -0.12 0.00 0.31 0.00 0.00 61.69 61.83 1t0g s THR 13 Cb -0.09 -3.47 0.10 0.00 0.01 0.00 0.00 72.50 69.05 1t0g s THR 13 CO 0.00 0.37 1.76 0.00 -0.69 0.00 0.00 174.62 176.06 1t0g h ALA 14 N 4.02 0.66 -0.16 7.40 0.00 -1.22 0.47 119.26 130.43 1t0g h ALA 14 Ca -0.50 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1t0g h ALA 14 Cb 1.19 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1t0g h ALA 14 CO 0.67 -0.18 -0.23 0.93 0.00 0.00 0.00 179.25 180.44 1t0g h GLU 15 N 0.40 0.28 0.01 0.00 5.08 -1.95 -2.25 114.58 116.15 1t0g h GLU 15 Ca 0.25 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.31 1t0g h GLU 15 Cb 0.26 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1t0g h GLU 15 CO -0.24 0.50 -0.92 1.96 -1.00 0.00 0.00 179.01 179.31 1t0g h GLN 16 N 0.26 0.28 0.00 2.33 4.20 -1.54 -3.14 115.11 117.50 1t0g h GLN 16 Ca 0.04 -0.32 -0.04 0.00 0.06 0.00 0.00 58.65 58.39 1t0g h GLN 16 Cb 0.55 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1t0g h GLN 16 CO 0.04 1.03 -0.20 1.25 -0.67 0.00 0.00 178.83 180.27 1t0g h LEU 17 N 0.15 0.00 0.00 1.46 5.85 0.42 -3.01 115.31 120.18 1t0g h LEU 17 Ca -0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1t0g h LEU 17 Cb 1.56 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.59 1t0g h LEU 17 CO 0.15 0.20 0.00 -0.24 -0.34 0.00 0.00 178.44 178.21 1t0g n SER 18 N -3.94 0.00 -0.29 1.25 2.88 -0.91 -0.72 113.62 111.89 1t0g n SER 18 Ca -0.02 -0.37 0.05 0.00 -1.33 0.00 0.00 58.87 57.20 1t0g n SER 18 Cb 0.29 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.77 1t0g n SER 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1t0g n GLN 19 N -0.87 1.42 -1.13 -1.46 6.02 -1.14 -4.53 117.38 115.69 1t0g n GLN 19 Ca 0.05 -0.80 -0.26 0.00 -0.01 0.00 0.00 57.00 55.98 1t0g n GLN 19 Cb 0.02 -1.12 0.07 0.00 1.02 0.00 0.00 30.24 30.24 1t0g n GLN 19 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1t0g n TYR 20 N 0.07 2.53 1.63 1.08 4.02 0.10 -4.30 117.16 122.30 1t0g n TYR 20 Ca 0.05 -2.48 0.14 0.00 -0.01 0.00 0.00 57.90 55.60 1t0g n TYR 20 Cb 0.22 -1.20 0.64 0.00 -0.02 0.00 0.00 39.34 38.98 1t0g n TYR 20 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1t0g n ASN 21 N -0.44 1.08 -3.14 7.72 6.94 -1.26 -2.80 115.26 123.36 1t0g n ASN 21 Ca 0.49 -1.37 -0.23 0.00 -0.02 0.00 0.00 54.58 53.45 1t0g n ASN 21 Cb 0.72 -0.00 0.04 0.00 -2.36 0.00 0.00 39.78 38.18 1t0g n ASN 21 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1t0g n GLY 22 N 1.12 -0.53 0.05 4.83 0.00 -1.26 -4.46 105.19 104.94 1t0g n GLY 22 Ca 0.20 0.15 -0.03 0.00 0.00 0.00 0.00 46.02 46.34 1t0g n GLY 22 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1t0g n THR 23 N -4.56 0.70 -3.94 2.61 5.66 -1.26 -4.59 114.28 108.91 1t0g n THR 23 Ca -0.09 -0.51 -0.35 0.00 -3.05 0.00 0.00 64.05 60.04 1t0g n THR 23 Cb 0.61 -0.45 -0.08 0.00 -1.55 0.00 0.00 70.33 68.86 1t0g n THR 23 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1t0g s ASP 24 N -4.42 5.94 0.00 1.09 1.01 -1.26 -4.45 116.67 114.58 1t0g s ASP 24 Ca -0.06 0.23 0.00 0.00 0.71 0.00 0.00 52.55 53.43 1t0g s ASP 24 Cb 0.05 -1.97 0.00 0.00 1.01 0.00 0.00 42.92 42.01 1t0g s ASP 24 CO 0.56 0.26 0.00 -0.62 0.21 0.00 0.00 175.17 175.59 1t0g n GLU 25 N 2.95 -0.98 -3.46 8.23 -0.58 -1.26 -2.00 120.64 123.54 1t0g n GLU 25 Ca -0.18 0.24 -0.21 0.00 -0.42 0.00 0.00 57.16 56.60 1t0g n GLU 25 Cb 0.53 -4.48 0.07 0.00 -0.57 0.00 0.00 31.44 27.00 1t0g n GLU 25 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1t0g n SER 26 N -0.49 -5.41 -4.62 1.62 2.88 -1.26 -4.99 113.62 101.34 1t0g n SER 26 Ca 0.00 -0.50 -0.31 0.00 -1.33 0.00 0.00 58.87 56.73 1t0g n SER 26 Cb 0.24 -4.61 0.17 0.00 -0.75 0.00 0.00 64.21 59.26 1t0g n SER 26 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1t0g n LYS 27 N -4.47 -0.52 -2.04 -1.46 5.02 -0.85 -4.98 118.16 108.86 1t0g n LYS 27 Ca -0.03 -0.09 -0.36 0.00 -2.02 0.00 0.00 58.31 55.81 1t0g n LYS 27 Cb 0.57 -2.29 0.03 0.00 -0.02 0.00 0.00 35.03 33.32 1t0g n LYS 27 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1t0g s PRO 28 N -4.48 3.02 -0.15 1.97 0.04 -1.26 -4.41 135.00 129.73 1t0g s PRO 28 Ca 0.65 1.80 -0.02 0.00 0.04 0.00 0.00 61.00 63.48 1t0g s PRO 28 Cb -0.23 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 1t0g s PRO 28 CO 0.60 -1.16 -0.09 0.42 0.04 0.00 0.00 177.00 176.80 1t0g s ILE 29 N -1.62 3.32 0.01 0.56 1.01 -1.26 -4.37 121.20 118.86 1t0g s ILE 29 Ca 0.77 -0.55 0.04 0.00 0.00 0.00 0.00 60.65 60.91 1t0g s ILE 29 Cb -0.30 -2.43 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 1t0g s ILE 29 CO 0.32 0.50 -0.13 -0.31 0.00 0.00 0.00 174.94 175.32 1t0g s TYR 30 N 0.55 1.13 0.28 3.97 2.02 -1.12 -0.89 117.35 123.29 1t0g s TYR 30 Ca -0.06 -0.27 0.10 0.00 -0.37 0.00 0.00 57.07 56.47 1t0g s TYR 30 Cb -0.15 -0.70 -0.05 0.00 -0.40 0.00 0.00 41.96 40.65 1t0g s TYR 30 CO 0.03 0.00 -0.15 0.14 -1.57 0.00 0.00 175.55 174.00 1t0g s VAL 31 N -0.54 2.21 0.04 0.71 -7.23 -0.03 -0.24 120.40 115.33 1t0g s VAL 31 Ca 0.03 -2.30 0.01 0.00 -1.81 0.00 0.00 61.98 57.91 1t0g s VAL 31 Cb -0.06 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.51 1t0g s VAL 31 CO 0.00 -0.38 -0.06 0.00 -0.31 0.00 0.00 175.10 174.36 1t0g s ALA 32 N -2.66 0.41 -0.15 1.32 0.00 -0.97 0.11 121.76 119.81 1t0g s ALA 32 Ca 0.29 -0.75 -0.04 0.00 0.00 0.00 0.00 51.96 51.47 1t0g s ALA 32 Cb -0.02 0.10 0.05 0.00 0.00 0.00 0.00 23.12 23.26 1t0g s ALA 32 CO 0.14 -0.10 0.07 0.42 0.00 0.00 0.00 175.76 176.28 1t0g s ILE 33 N -1.63 0.08 -0.85 0.00 1.01 -0.36 -0.37 121.20 119.08 1t0g s ILE 33 Ca -0.11 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.39 1t0g s ILE 33 Cb -0.08 -0.61 0.00 0.00 0.01 0.00 0.00 42.46 41.77 1t0g s ILE 33 CO -0.01 -0.17 0.00 0.29 0.00 0.00 0.00 174.94 175.06 1t0g n LYS 34 N 5.22 -1.16 0.00 2.79 5.02 -1.26 -2.24 118.16 126.54 1t0g n LYS 34 Ca -0.07 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 56.93 1t0g n LYS 34 Cb 0.49 -4.78 0.00 0.00 -0.02 0.00 0.00 35.03 30.72 1t0g n LYS 34 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1t0g n GLY 35 N -0.80 2.88 3.66 0.72 0.00 -1.26 -5.01 105.19 105.37 1t0g n GLY 35 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1t0g n GLY 35 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1t0g s ARG 36 N -0.50 4.26 -0.14 1.61 1.70 -0.95 0.47 118.95 125.40 1t0g s ARG 36 Ca 0.00 1.43 -0.21 0.00 -0.47 0.00 0.00 55.73 56.47 1t0g s ARG 36 Cb 0.00 -3.66 -0.03 0.00 -0.57 0.00 0.00 34.95 30.69 1t0g s ARG 36 CO 0.00 -0.63 0.62 0.08 -1.08 0.00 0.00 175.30 174.29 1t0g s VAL 37 N 3.21 5.06 -0.06 4.99 1.01 -0.33 -1.22 120.40 133.06 1t0g s VAL 37 Ca 0.46 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.69 1t0g s VAL 37 Cb -0.17 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 1t0g s VAL 37 CO 0.08 0.20 -0.10 -0.36 0.00 0.00 0.00 175.10 174.93 1t0g s PHE 38 N 1.28 2.85 -0.05 5.22 0.40 0.12 -0.31 117.98 127.49 1t0g s PHE 38 Ca 0.31 -0.04 -0.25 0.00 -0.60 0.00 0.00 56.93 56.35 1t0g s PHE 38 Cb -0.16 -1.68 -0.04 0.00 0.51 0.00 0.00 43.02 41.65 1t0g s PHE 38 CO 0.13 0.28 0.76 0.34 0.70 0.00 0.00 175.22 177.43 1t0g s ASP 39 N -0.77 7.08 -0.12 1.36 -1.08 -1.10 -0.85 116.67 121.18 1t0g s ASP 39 Ca 0.12 1.30 0.15 0.00 -0.52 0.00 0.00 52.55 53.59 1t0g s ASP 39 Cb -0.11 -2.45 0.29 0.00 -1.46 0.00 0.00 42.92 39.20 1t0g s ASP 39 CO 0.01 -0.14 1.15 1.33 0.52 0.00 0.00 175.17 178.04 1t0g n VAL 40 N 3.78 1.55 0.25 1.11 0.24 -0.07 -4.51 118.33 120.68 1t0g n VAL 40 Ca 0.00 -2.10 0.13 0.00 -2.04 0.00 0.00 64.34 60.33 1t0g n VAL 40 Cb 0.51 -0.04 0.65 0.00 -1.47 0.00 0.00 33.84 33.49 1t0g n VAL 40 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1t0g h THR 41 N 1.83 0.48 -0.25 3.34 2.02 -1.88 -1.38 112.91 117.07 1t0g h THR 41 Ca -0.02 -0.72 -0.14 0.00 0.77 0.00 0.00 66.41 66.30 1t0g h THR 41 Cb 1.13 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 69.03 1t0g h THR 41 CO 0.01 0.14 -0.41 0.71 0.37 0.00 0.00 175.52 176.34 1t0g h THR 42 N 0.00 1.30 -1.08 3.16 1.35 -1.90 -3.07 112.91 112.66 1t0g h THR 42 Ca -0.00 -1.59 -0.67 0.00 -0.55 0.00 0.00 66.41 63.60 1t0g h THR 42 Cb 0.49 1.55 -0.31 0.00 -1.73 0.00 0.00 68.15 68.15 1t0g h THR 42 CO 0.02 0.50 0.63 0.61 -0.25 0.00 0.00 175.52 177.03 1t0g n GLY 43 N 0.02 5.92 0.35 5.82 0.00 -0.53 -4.70 105.19 112.07 1t0g n GLY 43 Ca -0.02 -2.39 0.10 0.00 0.00 0.00 0.00 46.02 43.72 1t0g n GLY 43 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1t0g h LYS 44 N 2.14 0.46 -0.29 1.61 3.64 -1.42 -0.96 116.57 121.76 1t0g h LYS 44 Ca 0.57 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 60.00 1t0g h LYS 44 Cb 0.83 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1t0g h LYS 44 CO 1.45 0.31 0.25 1.03 -2.27 0.00 0.00 179.45 180.22 1t0g h SER 45 N 0.48 0.00 0.01 4.20 0.87 -1.86 0.45 113.55 117.69 1t0g h SER 45 Ca 0.28 0.00 -0.40 0.00 -1.23 0.00 0.00 61.79 60.43 1t0g h SER 45 Cb 0.46 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.36 1t0g h SER 45 CO -0.08 0.00 -2.23 0.49 -0.53 0.00 0.00 176.83 174.48 1t0g n PHE 46 N -4.08 0.29 -0.05 2.24 3.72 -0.41 -4.54 117.46 114.63 1t0g n PHE 46 Ca 0.04 0.11 -0.02 0.00 -0.05 0.00 0.00 57.45 57.53 1t0g n PHE 46 Cb 0.41 -1.03 -0.01 0.00 -0.94 0.00 0.00 39.48 37.91 1t0g n PHE 46 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 176.76 178.59 1t0g h TYR 47 N -0.84 0.00 -1.54 1.38 -1.99 -1.24 -3.15 116.97 109.59 1t0g h TYR 47 Ca -0.60 0.00 -0.67 0.00 2.00 0.00 0.00 58.73 59.46 1t0g h TYR 47 Cb 1.60 0.00 -0.25 0.00 2.00 0.00 0.00 36.73 40.08 1t0g h TYR 47 CO -0.03 0.00 0.85 0.41 -0.00 0.00 0.00 178.16 179.40 1t0g n GLY 48 N 1.72 5.25 0.00 3.88 0.00 0.11 -3.71 105.19 112.45 1t0g n GLY 48 Ca -0.03 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.75 1t0g n GLY 48 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1t0g n SER 49 N -0.25 0.82 -1.02 1.61 2.88 -0.95 -4.78 113.62 111.92 1t0g n SER 49 Ca 0.53 -1.31 -0.09 0.00 -1.33 0.00 0.00 58.87 56.67 1t0g n SER 49 Cb 0.39 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.85 1t0g n SER 49 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1t0g n GLY 50 N -0.15 0.06 0.00 0.46 0.00 -1.24 -5.03 105.19 99.28 1t0g n GLY 50 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1t0g n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t0g n GLY 51 N -1.06 1.41 0.24 -0.02 0.00 -1.25 -4.87 105.19 99.63 1t0g n GLY 51 Ca -0.11 -1.69 -0.14 0.00 0.00 0.00 0.00 46.02 44.08 1t0g n GLY 51 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1t0g h ASP 52 N 0.00 0.88 -0.32 1.61 3.58 -1.93 -2.99 116.42 117.26 1t0g h ASP 52 Ca 0.00 -0.48 0.00 0.00 0.42 0.00 0.00 57.03 56.97 1t0g h ASP 52 Cb 0.00 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 40.80 1t0g h ASP 52 CO 0.00 1.19 0.00 -1.22 -2.88 0.00 0.00 179.24 176.33 1t0g n TYR 53 N -4.15 1.08 0.24 0.28 4.01 -1.19 -4.14 117.16 113.29 1t0g n TYR 53 Ca -0.03 -0.38 0.13 0.00 -0.16 0.00 0.00 57.90 57.45 1t0g n TYR 53 Cb 0.53 -0.29 0.44 0.00 -0.31 0.00 0.00 39.34 39.70 1t0g n TYR 53 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1t0g h SER 54 N 2.18 0.00 1.08 7.72 0.87 -1.58 -2.72 113.55 121.11 1t0g h SER 54 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 1t0g h SER 54 Cb 1.23 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 1t0g h SER 54 CO 0.24 0.10 -0.18 0.24 -0.53 0.00 0.00 176.83 176.70 1t0g h MET 55 N 0.00 0.00 0.00 2.24 2.86 -1.82 -2.40 114.93 115.81 1t0g h MET 55 Ca -0.00 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.47 1t0g h MET 55 Cb 0.77 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 1t0g h MET 55 CO 0.01 0.18 -0.84 0.74 1.06 0.00 0.00 176.91 178.06 1t0g h PHE 56 N 0.00 0.00 -2.45 -0.22 -1.00 -1.80 -3.42 116.94 108.05 1t0g h PHE 56 Ca -0.00 0.00 -0.56 0.00 2.81 0.00 0.00 57.97 60.22 1t0g h PHE 56 Cb 0.77 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.32 1t0g h PHE 56 CO 0.00 0.80 1.25 0.00 -1.61 0.00 0.00 178.31 178.75 1t0g s ALA 57 N -2.81 3.26 0.00 2.45 0.00 -0.90 -1.65 121.76 122.11 1t0g s ALA 57 Ca 0.02 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1t0g s ALA 57 Cb 0.09 -3.90 0.00 0.00 0.00 0.00 0.00 23.12 19.31 1t0g s ALA 57 CO 0.79 -2.00 0.00 0.41 0.00 0.00 0.00 175.76 174.96 1t0g n GLY 58 N 4.85 0.43 3.15 0.00 0.00 0.67 -4.17 105.19 110.13 1t0g n GLY 58 Ca 0.22 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 1t0g n GLY 58 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1t0g s LYS 59 N -1.79 0.46 0.20 1.61 2.47 -0.66 -2.62 119.74 119.41 1t0g s LYS 59 Ca 0.00 -0.06 -0.30 0.00 -1.56 0.00 0.00 55.97 54.05 1t0g s LYS 59 Cb 0.00 0.20 -0.08 0.00 -1.46 0.00 0.00 37.83 36.49 1t0g s LYS 59 CO 0.00 -0.10 1.06 0.34 0.16 0.00 0.00 175.35 176.81 1t0g s ASP 60 N -0.79 7.35 -0.12 1.43 -1.08 -1.26 -2.30 116.67 119.90 1t0g s ASP 60 Ca -0.09 2.08 0.18 0.00 -0.52 0.00 0.00 52.55 54.20 1t0g s ASP 60 Cb -0.05 -2.61 0.27 0.00 -1.46 0.00 0.00 42.92 39.07 1t0g s ASP 60 CO 0.02 -0.13 1.14 0.00 0.52 0.00 0.00 175.17 176.72 1t0g n ALA 61 N 2.01 2.24 -0.31 3.66 0.00 0.51 -1.11 120.51 127.51 1t0g n ALA 61 Ca 0.01 -2.52 0.04 0.00 0.00 0.00 0.00 53.44 50.97 1t0g n ALA 61 Cb 0.46 -0.36 0.19 0.00 0.00 0.00 0.00 19.45 19.73 1t0g n ALA 61 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1t0g h SER 62 N 0.00 0.75 0.20 0.00 4.64 -1.41 0.21 113.55 117.94 1t0g h SER 62 Ca 0.00 0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.24 1t0g h SER 62 Cb 0.99 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.96 1t0g h SER 62 CO 0.00 0.42 -0.47 -0.09 -0.87 0.00 0.00 176.83 175.82 1t0g h ARG 63 N 0.86 0.33 -0.22 4.77 2.43 -0.98 -2.80 114.38 118.76 1t0g h ARG 63 Ca 0.42 -0.18 -0.13 0.00 -0.81 0.00 0.00 59.98 59.28 1t0g h ARG 63 Cb 0.39 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1t0g h ARG 63 CO -0.25 0.74 -0.39 0.00 -1.51 0.00 0.00 179.97 178.56 1t0g h ALA 64 N 1.24 0.34 -0.85 2.80 0.00 -0.19 -2.91 119.26 119.69 1t0g h ALA 64 Ca 0.02 -0.45 0.10 0.00 0.00 0.00 0.00 54.91 54.58 1t0g h ALA 64 Cb 0.94 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 1t0g h ALA 64 CO 0.08 0.44 0.55 -0.07 0.00 0.00 0.00 179.25 180.24 1t0g h LEU 65 N 0.35 0.73 -0.06 0.00 3.38 -0.61 0.24 115.31 119.34 1t0g h LEU 65 Ca 0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1t0g h LEU 65 Cb 0.98 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1t0g h LEU 65 CO 0.09 0.43 0.00 0.61 0.09 0.00 0.00 178.44 179.66 1t0g n GLY 66 N -1.42 -1.57 0.22 0.83 0.00 -1.06 -3.19 105.19 98.99 1t0g n GLY 66 Ca 0.14 -0.04 0.02 0.00 0.00 0.00 0.00 46.02 46.15 1t0g n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1t0g n LYS 67 N -1.97 1.17 -1.64 1.61 5.02 -0.40 -4.52 118.16 117.43 1t0g n LYS 67 Ca 0.06 -1.21 -0.15 0.00 -2.02 0.00 0.00 58.31 54.98 1t0g n LYS 67 Cb 0.37 -1.10 -0.05 0.00 -0.02 0.00 0.00 35.03 34.23 1t0g n LYS 67 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1t0g n MET 68 N 0.10 -1.08 -2.80 1.97 2.81 -0.18 -4.96 117.12 112.98 1t0g n MET 68 Ca 0.04 0.96 -0.31 0.00 -1.81 0.00 0.00 57.70 56.57 1t0g n MET 68 Cb 0.21 -5.14 -0.04 0.00 -0.71 0.00 0.00 33.22 27.54 1t0g n MET 68 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1t0g s SER 69 N -2.72 6.64 0.00 7.83 0.15 0.68 -4.93 113.70 121.35 1t0g s SER 69 Ca 0.00 1.33 0.01 0.00 0.70 0.00 0.00 55.95 57.99 1t0g s SER 69 Cb 0.00 -2.40 0.02 0.00 -1.71 0.00 0.00 66.02 61.92 1t0g s SER 69 CO 0.00 -0.40 0.74 2.29 1.20 0.00 0.00 173.24 177.07 1t0g n LYS 70 N -1.10 0.00 -3.99 5.44 2.85 -1.26 -4.19 118.16 115.90 1t0g n LYS 70 Ca 0.04 -0.51 -0.32 0.00 -1.05 0.00 0.00 58.31 56.47 1t0g n LYS 70 Cb 0.54 -0.17 -0.05 0.00 -0.65 0.00 0.00 35.03 34.70 1t0g n LYS 70 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1t0g s ASN 71 N -0.51 5.97 0.40 -5.58 4.22 -1.26 -4.71 114.94 113.46 1t0g s ASN 71 Ca 0.01 0.17 0.10 0.00 -2.14 0.00 0.00 52.86 51.00 1t0g s ASN 71 Cb 0.02 -1.75 0.89 0.00 1.28 0.00 0.00 41.25 41.69 1t0g s ASN 71 CO -0.01 0.20 1.97 1.05 -2.04 0.00 0.00 177.10 178.28 1t0g h GLU 72 N 3.45 0.56 0.00 3.55 4.11 -1.93 -1.06 114.58 123.25 1t0g h GLU 72 Ca -0.47 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 58.91 1t0g h GLU 72 Cb 1.17 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 1t0g h GLU 72 CO 0.69 0.37 -0.07 0.93 0.07 0.00 0.00 179.01 181.00 1t0g h GLU 73 N 0.57 0.00 0.00 1.06 5.08 -2.01 -3.19 114.58 116.10 1t0g h GLU 73 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1t0g h GLU 73 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1t0g h GLU 73 CO -0.09 0.07 -1.20 -0.25 -1.00 0.00 0.00 179.01 176.54 1t0g n ASP 74 N -3.16 0.88 -4.65 1.42 8.00 -0.46 -4.86 116.55 113.73 1t0g n ASP 74 Ca 0.01 -0.54 -0.43 0.00 0.71 0.00 0.00 54.79 54.55 1t0g n ASP 74 Cb 0.41 1.32 -0.02 0.00 -0.02 0.00 0.00 41.12 42.81 1t0g n ASP 74 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1t0g s VAL 75 N -2.85 4.04 -0.10 2.53 1.01 -0.86 -1.66 120.40 122.51 1t0g s VAL 75 Ca 0.01 1.22 -0.30 0.00 0.00 0.00 0.00 61.98 62.91 1t0g s VAL 75 Cb 0.12 -3.92 0.11 0.00 0.00 0.00 0.00 36.38 32.70 1t0g s VAL 75 CO 0.71 -0.25 0.91 -0.44 0.00 0.00 0.00 175.10 176.02 1t0g s SER 76 N 2.83 -0.43 -0.13 3.32 0.01 -0.27 -4.92 113.70 114.11 1t0g s SER 76 Ca 0.61 0.38 0.01 0.00 1.31 0.00 0.00 55.95 58.25 1t0g s SER 76 Cb -0.22 0.37 0.16 0.00 0.21 0.00 0.00 66.02 66.54 1t0g s SER 76 CO 0.22 -0.46 1.43 -0.81 0.41 0.00 0.00 173.24 174.03 1t0g n PRO 77 N 0.56 1.36 -3.76 12.44 -0.04 -1.24 -1.47 135.00 142.84 1t0g n PRO 77 Ca -0.12 -0.82 -0.10 0.00 -0.04 0.00 0.00 63.50 62.42 1t0g n PRO 77 Cb 0.59 -1.32 -0.05 0.00 -0.04 0.00 0.00 33.50 32.68 1t0g n PRO 77 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1t0g s SER 78 N 0.53 -0.18 -0.43 3.54 1.04 -1.26 -4.74 113.70 112.19 1t0g s SER 78 Ca 0.16 -0.53 0.05 0.00 0.48 0.00 0.00 55.95 56.10 1t0g s SER 78 Cb 0.13 0.52 0.63 0.00 0.10 0.00 0.00 66.02 67.40 1t0g s SER 78 CO 0.02 -0.97 1.84 0.18 0.98 0.00 0.00 173.24 175.29 1t0g n LEU 79 N -0.28 6.34 -4.71 2.42 4.77 -1.26 -1.79 117.00 122.49 1t0g n LEU 79 Ca -0.11 -3.68 -0.42 0.00 -0.03 0.00 0.00 56.01 51.77 1t0g n LEU 79 Cb 0.63 -0.81 -0.03 0.00 -2.33 0.00 0.00 43.42 40.88 1t0g n LEU 79 CO 0.19 1.12 1.11 -0.70 -1.33 0.00 0.00 177.39 177.77 1t0g s GLU 80 N -3.32 4.29 0.00 3.23 2.56 -1.26 -2.95 118.70 121.26 1t0g s GLU 80 Ca 0.55 2.10 0.00 0.00 0.00 0.00 0.00 54.97 57.62 1t0g s GLU 80 Cb 0.47 -3.34 0.00 0.00 2.00 0.00 0.00 34.13 33.26 1t0g s GLU 80 CO 0.08 -0.51 0.00 0.41 -0.56 0.00 0.00 175.26 174.69 1t0g n GLY 81 N 3.59 1.02 2.86 -1.50 0.00 -1.26 -4.96 105.19 104.95 1t0g n GLY 81 Ca 0.12 -0.49 -0.17 0.00 0.00 0.00 0.00 46.02 45.48 1t0g n GLY 81 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t0g s LEU 82 N 0.00 1.40 0.67 0.99 1.43 -1.15 -5.09 118.68 116.93 1t0g s LEU 82 Ca 0.00 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.03 1t0g s LEU 82 Cb 0.00 -0.27 0.09 0.00 0.03 0.00 0.00 46.19 46.04 1t0g s LEU 82 CO 0.00 -0.06 0.93 0.42 0.23 0.00 0.00 176.35 177.88 1t0g s THR 83 N 0.74 2.32 0.37 5.49 -4.23 -1.26 -4.80 115.64 114.26 1t0g s THR 83 Ca -0.08 -0.56 0.09 0.00 -1.18 0.00 0.00 61.69 59.95 1t0g s THR 83 Cb -0.11 -2.76 0.32 0.00 1.34 0.00 0.00 72.50 71.29 1t0g s THR 83 CO -0.01 0.00 1.91 -0.08 -0.54 0.00 0.00 174.62 175.90 1t0g h GLU 84 N -0.37 0.66 -0.59 3.99 4.57 -1.99 0.33 114.58 121.17 1t0g h GLU 84 Ca -0.39 -0.04 0.09 0.00 -1.18 0.00 0.00 59.36 57.84 1t0g h GLU 84 Cb 1.28 -0.15 -0.07 0.00 -0.16 0.00 0.00 28.75 29.65 1t0g h GLU 84 CO 0.46 0.44 0.21 -0.22 -1.18 0.00 0.00 179.01 178.72 1t0g h LYS 85 N 0.68 0.37 0.04 1.92 3.64 -2.00 0.31 116.57 121.53 1t0g h LYS 85 Ca 0.38 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.61 1t0g h LYS 85 Cb 0.55 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1t0g h LYS 85 CO -0.15 0.24 -0.54 0.93 -2.27 0.00 0.00 179.45 177.67 1t0g h GLU 86 N 0.38 0.29 -0.96 1.90 5.08 -1.33 -3.22 114.58 116.72 1t0g h GLU 86 Ca 0.30 -0.37 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1t0g h GLU 86 Cb 0.38 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.69 1t0g h GLU 86 CO -0.31 1.09 0.63 0.82 -1.00 0.00 0.00 179.01 180.24 1t0g h ILE 87 N -0.35 1.14 -0.98 3.13 2.04 -0.15 -1.40 117.51 120.95 1t0g h ILE 87 Ca -0.08 -0.41 0.24 0.00 1.00 0.00 0.00 64.86 65.62 1t0g h ILE 87 Cb 1.32 -0.14 -0.08 0.00 -0.74 0.00 0.00 36.82 37.18 1t0g h ILE 87 CO 0.10 0.22 0.65 0.78 0.00 0.00 0.00 178.15 179.90 1t0g h ASN 88 N 1.18 0.40 -0.65 1.72 2.35 -0.40 0.28 115.58 120.45 1t0g h ASN 88 Ca 0.39 0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 56.13 1t0g h ASN 88 Cb 0.05 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 1t0g h ASN 88 CO -0.13 0.12 0.15 0.74 -1.65 0.00 0.00 177.43 176.66 1t0g h THR 89 N 0.37 1.26 -0.10 2.81 2.02 -1.32 -1.52 112.91 116.43 1t0g h THR 89 Ca 0.53 -0.96 -0.21 0.00 0.77 0.00 0.00 66.41 66.54 1t0g h THR 89 Cb 1.39 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 1t0g h THR 89 CO -0.22 0.36 -0.79 0.25 0.37 0.00 0.00 175.52 175.50 1t0g h LEU 90 N 1.01 0.69 -1.55 2.58 5.85 -0.84 -2.62 115.31 120.43 1t0g h LEU 90 Ca 0.21 -0.47 0.16 0.00 0.84 0.00 0.00 57.88 58.63 1t0g h LEU 90 Cb 0.37 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.14 1t0g h LEU 90 CO 0.00 1.24 0.54 0.78 -0.34 0.00 0.00 178.44 180.66 1t0g h ASN 91 N 0.38 0.40 -0.49 1.25 -0.26 -0.24 0.39 115.58 117.01 1t0g h ASN 91 Ca -0.05 0.03 -0.08 0.00 -0.56 0.00 0.00 56.30 55.64 1t0g h ASN 91 Cb 1.39 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 38.59 1t0g h ASN 91 CO 0.15 0.20 -0.00 -0.78 -1.06 0.00 0.00 177.43 175.93 1t0g h ASP 92 N 0.42 0.85 0.18 5.81 3.58 -0.91 -2.84 116.42 123.51 1t0g h ASP 92 Ca 0.40 -0.31 -0.07 0.00 0.42 0.00 0.00 57.03 57.48 1t0g h ASP 92 Cb 0.94 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.75 1t0g h ASP 92 CO -0.14 0.95 -0.26 -0.50 -2.88 0.00 0.00 179.24 176.42 1t0g h TRP 93 N 0.73 0.16 0.00 0.28 4.06 -0.56 -0.55 115.95 120.07 1t0g h TRP 93 Ca 0.14 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.06 1t0g h TRP 93 Cb 0.52 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 28.64 1t0g h TRP 93 CO 0.04 0.40 0.00 0.39 -3.56 0.00 0.00 178.44 175.71 1t0g n GLU 94 N -4.18 0.79 0.00 0.49 1.02 0.11 -1.20 120.64 117.66 1t0g n GLU 94 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1t0g n GLU 94 Cb 0.34 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 1t0g n GLU 94 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1t0g n THR 95 N -0.22 0.00 0.00 2.62 -1.04 -0.31 -4.34 114.28 110.99 1t0g n THR 95 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.84 1t0g n THR 95 Cb 0.09 -0.57 -0.11 0.00 -1.82 0.00 0.00 70.33 67.92 1t0g n THR 95 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1t0g h LYS 96 N 0.00 0.43 -0.02 -2.82 1.79 -0.62 -2.28 116.57 113.04 1t0g h LYS 96 Ca 0.00 -0.45 -0.26 0.00 -2.18 0.00 0.00 60.65 57.76 1t0g h LYS 96 Cb 0.87 0.13 0.02 0.00 -1.58 0.00 0.00 32.23 31.67 1t0g h LYS 96 CO 0.00 1.11 -1.00 0.74 -1.08 0.00 0.00 179.45 179.22 1t0g h PHE 97 N -0.08 1.00 0.00 -1.35 -1.00 -1.43 -3.24 116.94 110.84 1t0g h PHE 97 Ca -0.07 -0.53 -0.03 0.00 2.81 0.00 0.00 57.97 60.14 1t0g h PHE 97 Cb 1.32 -0.12 -0.00 0.00 3.61 0.00 0.00 35.95 40.76 1t0g h PHE 97 CO 0.14 1.37 -0.16 1.49 -1.61 0.00 0.00 178.31 179.54 1t0g h GLU 98 N 0.40 0.00 -0.32 1.51 4.22 -1.70 0.44 114.58 119.13 1t0g h GLU 98 Ca -0.11 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.33 1t0g h GLU 98 Cb 1.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.90 1t0g h GLU 98 CO 0.20 0.16 0.00 0.00 -2.18 0.00 0.00 179.01 177.19 1t0g n ALA 99 N -2.32 2.42 0.00 2.92 0.00 -0.86 -4.46 120.51 118.21 1t0g n ALA 99 Ca -0.02 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.48 1t0g n ALA 99 Cb 0.27 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1t0g n ALA 99 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1t0g n LYS 100 N 1.43 1.14 -4.76 0.00 3.00 -0.51 -5.05 118.16 113.41 1t0g n LYS 100 Ca 0.18 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 58.21 1t0g n LYS 100 Cb 0.59 -0.83 -0.14 0.00 0.00 0.00 0.00 35.03 34.65 1t0g n LYS 100 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1t0g s TYR 101 N -1.65 2.14 0.24 5.64 2.02 0.14 -5.08 117.35 120.81 1t0g s TYR 101 Ca 0.00 -0.40 -0.25 0.00 -0.37 0.00 0.00 57.07 56.05 1t0g s TYR 101 Cb 0.00 -1.27 -0.09 0.00 -0.40 0.00 0.00 41.96 40.21 1t0g s TYR 101 CO 0.00 0.14 0.84 -1.25 -1.57 0.00 0.00 175.55 173.70 1t0g s PRO 102 N -1.31 4.54 -0.71 -1.71 0.04 -1.26 -4.49 135.00 130.09 1t0g s PRO 102 Ca 0.10 1.18 -0.27 0.00 0.04 0.00 0.00 61.00 62.06 1t0g s PRO 102 Cb -0.10 -3.02 0.01 0.00 0.04 0.00 0.00 34.50 31.43 1t0g s PRO 102 CO 0.02 0.43 1.50 0.08 0.04 0.00 0.00 177.00 179.07 1t0g s VAL 103 N -1.39 3.60 -0.07 -0.36 1.01 -1.26 -2.71 120.40 119.22 1t0g s VAL 103 Ca 0.43 0.27 -0.24 0.00 0.00 0.00 0.00 61.98 62.43 1t0g s VAL 103 Cb -0.20 -4.58 -0.27 0.00 0.00 0.00 0.00 36.38 31.33 1t0g s VAL 103 CO 0.25 -1.52 0.93 -0.37 0.00 0.00 0.00 175.10 174.39 1t0g h VAL 104 N 6.38 1.59 0.00 2.92 -1.51 -1.02 -3.49 116.25 121.13 1t0g h VAL 104 Ca -0.24 -2.25 0.00 0.00 -1.23 0.00 0.00 66.70 62.98 1t0g h VAL 104 Cb 1.08 3.05 0.00 0.00 -2.13 0.00 0.00 31.29 33.29 1t0g h VAL 104 CO 1.26 0.62 0.00 0.61 -1.23 0.00 0.00 177.57 178.83 1t0g n GLY 105 N 1.39 3.98 3.17 5.19 0.00 -1.14 -3.89 105.19 113.88 1t0g n GLY 105 Ca -0.11 -0.27 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 1t0g n GLY 105 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1t0g s ARG 106 N 4.79 0.83 -0.09 1.61 1.70 -0.20 -1.18 118.95 126.40 1t0g s ARG 106 Ca 0.00 -1.34 0.03 0.00 -0.47 0.00 0.00 55.73 53.95 1t0g s ARG 106 Cb 0.00 -0.17 -0.01 0.00 -0.57 0.00 0.00 34.95 34.19 1t0g s ARG 106 CO 0.00 -0.03 -0.19 0.54 -1.08 0.00 0.00 175.30 174.54 1t0g s VAL 107 N -3.65 2.57 0.06 4.99 0.11 0.18 0.04 120.40 124.70 1t0g s VAL 107 Ca 0.12 -0.86 0.09 0.00 -2.93 0.00 0.00 61.98 58.40 1t0g s VAL 107 Cb 0.06 -2.01 -0.03 0.00 -1.53 0.00 0.00 36.38 32.86 1t0g s VAL 107 CO -0.05 0.56 -0.23 0.68 -3.33 0.00 0.00 175.10 172.73 1t0g s VAL 108 N -0.00 2.43 0.00 2.04 -7.23 0.29 -4.70 120.40 113.23 1t0g s VAL 108 Ca -0.06 -1.38 0.00 0.00 -1.81 0.00 0.00 61.98 58.73 1t0g s VAL 108 Cb -0.15 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.79 1t0g s VAL 108 CO 0.05 0.30 0.00 -0.24 -0.31 0.00 0.00 175.10 174.90