#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 5.82 3.51 3.03 0.00 -1.26 -4.85 105.19 111.44 1t0g n GLY 2 Ca 0.00 -2.26 -0.43 0.00 0.00 0.00 0.00 46.02 43.34 1t0g n GLY 2 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1t0g s HIS 3 N -3.81 2.86 -0.44 1.61 3.76 -1.26 -4.73 115.29 113.29 1t0g s HIS 3 Ca 0.65 -1.22 0.08 0.00 -0.15 0.00 0.00 55.06 54.41 1t0g s HIS 3 Cb 0.51 -4.50 0.30 0.00 1.11 0.00 0.00 32.58 30.00 1t0g s HIS 3 CO -0.00 -1.70 0.90 -2.39 -0.85 0.00 0.00 174.74 170.69 1t0g n HIS 4 N 7.65 -1.92 -3.09 1.40 -0.00 -1.26 -5.01 115.22 112.97 1t0g n HIS 4 Ca 0.31 -2.64 -0.14 0.00 -0.00 0.00 0.00 57.72 55.25 1t0g n HIS 4 Cb 0.49 0.88 -0.04 0.00 -0.00 0.00 0.00 29.99 31.32 1t0g n HIS 4 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1t0g s HIS 5 N -0.48 -0.44 0.00 -1.40 3.76 -1.26 -4.45 115.29 111.01 1t0g s HIS 5 Ca 0.30 -1.23 0.00 0.00 -0.15 0.00 0.00 55.06 53.98 1t0g s HIS 5 Cb 0.28 -0.23 0.00 0.00 1.11 0.00 0.00 32.58 33.73 1t0g s HIS 5 CO -0.11 -1.07 0.00 1.58 -0.85 0.00 0.00 174.74 174.30 1t0g n HIS 6 N 3.13 0.00 -3.62 1.40 -0.00 -1.26 -5.09 115.22 109.79 1t0g n HIS 6 Ca 0.21 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.87 1t0g n HIS 6 Cb 0.52 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.46 1t0g n HIS 6 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 1t0g s HIS 7 N -1.58 -0.21 0.15 1.57 5.65 -1.26 -5.17 115.29 114.44 1t0g s HIS 7 Ca 0.00 0.38 0.00 0.00 0.25 0.00 0.00 55.06 55.69 1t0g s HIS 7 Cb 0.00 0.47 0.00 0.00 -1.18 0.00 0.00 32.58 31.87 1t0g s HIS 7 CO 0.00 -0.17 0.00 1.58 -0.65 0.00 0.00 174.74 175.50 1t0g n HIS 8 N 0.82 -1.02 -1.39 3.88 -0.00 -1.26 -4.93 115.22 111.32 1t0g n HIS 8 Ca -0.06 0.55 -0.35 0.00 -0.00 0.00 0.00 57.72 57.87 1t0g n HIS 8 Cb 0.58 -1.15 0.10 0.00 -0.00 0.00 0.00 29.99 29.53 1t0g n HIS 8 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1t0g s LEU 9 N -3.92 3.32 -0.31 0.27 1.43 -1.26 -4.86 118.68 113.35 1t0g s LEU 9 Ca 0.00 2.45 -0.27 0.00 -1.03 0.00 0.00 54.13 55.28 1t0g s LEU 9 Cb 0.00 -4.60 0.01 0.00 0.03 0.00 0.00 46.19 41.63 1t0g s LEU 9 CO 0.00 -2.36 0.99 -1.83 0.23 0.00 0.00 176.35 173.38 1t0g s GLU 10 N -3.83 4.05 0.02 1.70 -1.05 -0.96 -4.94 118.70 113.69 1t0g s GLU 10 Ca 0.77 0.96 -0.14 0.00 -0.15 0.00 0.00 54.97 56.40 1t0g s GLU 10 Cb -0.32 -3.73 -0.06 0.00 -0.44 0.00 0.00 34.13 29.59 1t0g s GLU 10 CO 0.46 -0.82 0.42 -2.00 0.95 0.00 0.00 175.26 174.27 1t0g s GLU 11 N 3.43 3.91 0.31 -4.83 2.12 -1.26 -2.68 118.70 119.70 1t0g s GLU 11 Ca 0.42 0.40 0.11 0.00 0.36 0.00 0.00 54.97 56.26 1t0g s GLU 11 Cb -0.13 -3.17 -0.06 0.00 0.26 0.00 0.00 34.13 31.03 1t0g s GLU 11 CO 0.14 0.66 -0.14 -0.06 -0.54 0.00 0.00 175.26 175.31 1t0g s PHE 12 N -1.15 2.35 0.11 5.30 0.08 0.46 -4.96 117.98 120.18 1t0g s PHE 12 Ca 0.26 -0.41 0.10 0.00 0.12 0.00 0.00 56.93 57.00 1t0g s PHE 12 Cb -0.16 -1.18 -0.04 0.00 -0.57 0.00 0.00 43.02 41.07 1t0g s PHE 12 CO 0.15 0.65 -0.25 0.99 -0.10 0.00 0.00 175.22 176.66 1t0g s THR 13 N -2.55 2.06 0.21 0.64 2.01 -1.25 0.99 115.64 117.74 1t0g s THR 13 Ca 0.31 -1.64 -0.10 0.00 0.31 0.00 0.00 61.69 60.58 1t0g s THR 13 Cb -0.02 -1.83 0.15 0.00 0.01 0.00 0.00 72.50 70.82 1t0g s THR 13 CO 0.16 0.07 1.72 0.00 -0.69 0.00 0.00 174.62 175.88 1t0g h ALA 14 N 4.06 0.73 -0.90 7.40 0.00 -1.94 0.21 119.26 128.83 1t0g h ALA 14 Ca -0.49 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1t0g h ALA 14 Cb 1.17 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 1t0g h ALA 14 CO 0.40 -0.26 0.58 0.93 0.00 0.00 0.00 179.25 180.89 1t0g h GLU 15 N 0.31 1.20 -0.06 0.00 3.07 -1.96 -2.35 114.58 114.80 1t0g h GLU 15 Ca 0.31 -0.09 -0.13 0.00 -0.50 0.00 0.00 59.36 58.95 1t0g h GLU 15 Cb 0.43 -0.26 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1t0g h GLU 15 CO -0.36 0.81 -0.56 1.96 -1.40 0.00 0.00 179.01 179.46 1t0g h GLN 16 N 1.23 0.17 -0.01 2.33 7.50 -1.52 -3.03 115.11 121.78 1t0g h GLN 16 Ca 0.33 -0.11 -0.06 0.00 0.50 0.00 0.00 58.65 59.30 1t0g h GLN 16 Cb -0.11 0.01 -0.01 0.00 0.05 0.00 0.00 27.48 27.42 1t0g h GLN 16 CO -0.07 0.69 -0.30 1.25 -1.50 0.00 0.00 178.83 178.90 1t0g h LEU 17 N 0.13 0.02 0.00 1.46 5.85 -0.11 -2.95 115.31 119.71 1t0g h LEU 17 Ca -0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1t0g h LEU 17 Cb 1.03 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1t0g h LEU 17 CO 0.08 0.32 0.00 -1.20 -0.34 0.00 0.00 178.44 177.30 1t0g n SER 18 N -4.18 0.00 0.20 1.25 7.64 -1.11 -1.01 113.62 116.41 1t0g n SER 18 Ca -0.02 0.25 0.12 0.00 1.01 0.00 0.00 58.87 60.24 1t0g n SER 18 Cb 0.35 -0.34 0.23 0.00 -1.01 0.00 0.00 64.21 63.43 1t0g n SER 18 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1t0g h GLN 19 N 0.00 0.00 -1.12 1.43 4.20 -1.71 -3.29 115.11 114.62 1t0g h GLN 19 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 1t0g h GLN 19 Cb 0.10 0.00 -0.24 0.00 0.30 0.00 0.00 27.48 27.64 1t0g h GLN 19 CO 0.00 0.00 0.67 0.66 -0.67 0.00 0.00 178.83 179.49 1t0g n TYR 20 N -2.93 2.63 0.83 2.96 4.01 -0.18 -4.28 117.16 120.21 1t0g n TYR 20 Ca 0.04 -2.37 0.13 0.00 -0.16 0.00 0.00 57.90 55.54 1t0g n TYR 20 Cb 0.51 -1.16 0.41 0.00 -0.31 0.00 0.00 39.34 38.79 1t0g n TYR 20 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1t0g n ASN 21 N -0.60 0.42 -2.34 7.72 0.23 -1.24 -2.83 115.26 116.62 1t0g n ASN 21 Ca 0.51 0.30 -0.08 0.00 -0.53 0.00 0.00 54.58 54.78 1t0g n ASN 21 Cb 0.88 -0.30 0.04 0.00 -2.08 0.00 0.00 39.78 38.31 1t0g n ASN 21 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1t0g n GLY 22 N 1.43 -0.08 0.00 4.83 0.00 -1.26 -4.66 105.19 105.44 1t0g n GLY 22 Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1t0g n GLY 22 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1t0g n THR 23 N -2.38 0.00 -3.23 2.61 -2.24 -1.26 -4.61 114.28 103.18 1t0g n THR 23 Ca -0.05 -0.04 -0.45 0.00 -2.27 0.00 0.00 64.05 61.24 1t0g n THR 23 Cb 0.56 0.53 -0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1t0g n THR 23 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1t0g s ASP 24 N -1.94 6.19 -1.00 3.42 1.01 -1.26 -4.57 116.67 118.52 1t0g s ASP 24 Ca -0.00 -1.65 0.00 0.00 0.71 0.00 0.00 52.55 51.61 1t0g s ASP 24 Cb 0.00 -2.25 0.00 0.00 1.01 0.00 0.00 42.92 41.68 1t0g s ASP 24 CO 0.00 -0.96 0.00 -0.62 0.21 0.00 0.00 175.17 173.80 1t0g n GLU 25 N 5.69 -1.72 -2.61 8.23 -0.58 -1.26 -1.48 120.64 126.91 1t0g n GLU 25 Ca -0.12 0.79 -0.17 0.00 -0.42 0.00 0.00 57.16 57.23 1t0g n GLU 25 Cb 0.41 -5.13 0.01 0.00 -0.57 0.00 0.00 31.44 26.17 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 -0.91 -5.11 -4.72 1.62 2.88 -1.26 -4.99 113.62 101.13 1t0g n SER 26 Ca -0.09 -0.13 -0.36 0.00 -1.33 0.00 0.00 58.87 56.96 1t0g n SER 26 Cb 0.54 -4.08 0.08 0.00 -0.75 0.00 0.00 64.21 60.01 1t0g n SER 26 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1t0g s LYS 27 N -5.17 2.30 -0.17 -1.46 1.02 -0.55 -4.75 119.74 110.96 1t0g s LYS 27 Ca 0.13 2.00 -0.16 0.00 0.02 0.00 0.00 55.97 57.96 1t0g s LYS 27 Cb -0.06 -1.82 -0.07 0.00 -0.52 0.00 0.00 37.83 35.36 1t0g s LYS 27 CO 0.16 -1.77 0.57 -2.30 -0.92 0.00 0.00 175.35 171.09 1t0g n PRO 28 N -2.27 0.00 -4.32 -1.68 -0.02 -1.26 -4.49 135.00 120.95 1t0g n PRO 28 Ca 0.15 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.29 1t0g n PRO 28 Cb 0.49 -0.51 -0.11 0.00 -0.02 0.00 0.00 33.50 33.34 1t0g n PRO 28 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1t0g s ILE 29 N 1.17 4.15 0.08 4.25 1.01 -1.26 -4.61 121.20 125.99 1t0g s ILE 29 Ca 0.37 -0.27 0.03 0.00 0.00 0.00 0.00 60.65 60.78 1t0g s ILE 29 Cb -0.51 -2.81 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 1t0g s ILE 29 CO 0.27 0.51 -0.10 -0.31 0.00 0.00 0.00 174.94 175.32 1t0g s TYR 30 N 0.07 0.95 0.20 3.97 2.02 -1.13 -0.46 117.35 122.97 1t0g s TYR 30 Ca 0.01 -0.60 0.07 0.00 -0.37 0.00 0.00 57.07 56.18 1t0g s TYR 30 Cb -0.13 -0.54 -0.05 0.00 -0.40 0.00 0.00 41.96 40.84 1t0g s TYR 30 CO 0.02 -0.03 -0.13 0.14 -1.57 0.00 0.00 175.55 173.98 1t0g s VAL 31 N -2.04 1.63 -0.05 0.71 -7.23 -0.74 -0.07 120.40 112.62 1t0g s VAL 31 Ca 0.00 -2.18 0.02 0.00 -1.81 0.00 0.00 61.98 58.00 1t0g s VAL 31 Cb -0.05 -2.02 0.02 0.00 0.56 0.00 0.00 36.38 34.88 1t0g s VAL 31 CO 0.00 -0.62 -0.08 0.00 -0.31 0.00 0.00 175.10 174.09 1t0g s ALA 32 N -3.04 0.95 -0.07 1.32 0.00 -1.12 -1.42 121.76 118.38 1t0g s ALA 32 Ca 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 51.96 51.93 1t0g s ALA 32 Cb -0.00 -0.47 0.03 0.00 0.00 0.00 0.00 23.12 22.68 1t0g s ALA 32 CO 0.06 0.07 -0.02 0.42 0.00 0.00 0.00 175.76 176.29 1t0g s ILE 33 N 0.70 0.48 -1.64 0.00 1.01 -0.67 -1.70 121.20 119.38 1t0g s ILE 33 Ca -0.12 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.55 1t0g s ILE 33 Cb -0.14 -0.59 0.00 0.00 0.01 0.00 0.00 42.46 41.73 1t0g s ILE 33 CO 0.02 0.26 0.00 0.29 0.00 0.00 0.00 174.94 175.51 1t0g n LYS 34 N 4.88 -1.34 -0.19 2.79 4.76 -1.26 -0.64 118.16 127.17 1t0g n LYS 34 Ca -0.12 1.04 0.00 0.00 -2.87 0.00 0.00 58.31 56.36 1t0g n LYS 34 Cb 0.50 -5.31 0.00 0.00 -1.84 0.00 0.00 35.03 28.38 1t0g n LYS 34 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1t0g n GLY 35 N -0.56 1.84 3.66 0.72 0.00 -1.26 -5.00 105.19 104.59 1t0g n GLY 35 Ca -0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1t0g n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1t0g s ARG 36 N -0.27 4.24 -0.24 1.61 0.52 0.19 -0.05 118.95 124.94 1t0g s ARG 36 Ca 0.00 1.28 -0.17 0.00 -0.52 0.00 0.00 55.73 56.32 1t0g s ARG 36 Cb 0.00 -3.65 -0.03 0.00 0.52 0.00 0.00 34.95 31.79 1t0g s ARG 36 CO 0.00 -0.63 0.46 0.08 0.02 0.00 0.00 175.30 175.22 1t0g s VAL 37 N 3.18 5.13 0.07 3.52 1.01 -0.24 -1.67 120.40 131.40 1t0g s VAL 37 Ca 0.43 0.78 0.06 0.00 0.00 0.00 0.00 61.98 63.25 1t0g s VAL 37 Cb -0.15 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1t0g s VAL 37 CO 0.07 0.15 -0.12 -0.36 0.00 0.00 0.00 175.10 174.84 1t0g s PHE 38 N 1.94 2.70 -0.14 5.22 0.08 -0.51 -0.84 117.98 126.43 1t0g s PHE 38 Ca 0.20 -0.17 -0.24 0.00 0.12 0.00 0.00 56.93 56.83 1t0g s PHE 38 Cb -0.15 -1.47 -0.02 0.00 -0.57 0.00 0.00 43.02 40.81 1t0g s PHE 38 CO 0.09 0.36 0.78 0.34 -0.10 0.00 0.00 175.22 176.70 1t0g s ASP 39 N -1.83 6.94 -0.14 1.36 -1.08 -1.00 -1.79 116.67 119.13 1t0g s ASP 39 Ca 0.18 1.15 0.17 0.00 -0.52 0.00 0.00 52.55 53.53 1t0g s ASP 39 Cb -0.11 -2.44 0.39 0.00 -1.46 0.00 0.00 42.92 39.30 1t0g s ASP 39 CO 0.10 -0.32 1.27 1.33 0.52 0.00 0.00 175.17 178.07 1t0g n VAL 40 N 4.50 2.00 0.25 1.11 0.24 0.39 -4.44 118.33 122.39 1t0g n VAL 40 Ca 0.03 -1.99 0.11 0.00 -2.04 0.00 0.00 64.34 60.44 1t0g n VAL 40 Cb 0.49 -0.19 0.67 0.00 -1.47 0.00 0.00 33.84 33.35 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 0.90 0.71 0.00 3.34 2.02 -1.89 0.15 112.91 118.14 1t0g h THR 41 Ca 0.00 -0.56 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 1t0g h THR 41 Cb 1.17 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 68.92 1t0g h THR 41 CO 0.10 0.13 -0.16 0.00 0.37 0.00 0.00 175.52 175.97 1t0g h THR 42 N 0.00 0.38 -0.80 3.16 1.03 -1.91 -2.95 112.91 111.81 1t0g h THR 42 Ca -0.00 -0.97 -0.57 0.00 -0.01 0.00 0.00 66.41 64.86 1t0g h THR 42 Cb 0.33 1.72 -0.36 0.00 -1.07 0.00 0.00 68.15 68.78 1t0g h THR 42 CO 0.02 0.15 -0.19 0.61 -0.01 0.00 0.00 175.52 176.10 1t0g n GLY 43 N 0.20 6.11 0.27 2.99 0.00 0.03 -4.72 105.19 110.06 1t0g n GLY 43 Ca 0.01 -2.44 0.12 0.00 0.00 0.00 0.00 46.02 43.71 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 2.03 0.00 0.00 1.61 3.11 -1.35 -0.22 116.57 121.74 1t0g h LYS 44 Ca 0.44 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 58.27 1t0g h LYS 44 Cb 1.31 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.53 1t0g h LYS 44 CO 1.01 0.09 -0.06 0.77 -2.81 0.00 0.00 179.45 178.46 1t0g h SER 45 N 0.00 0.00 0.00 4.20 0.02 -1.88 0.13 113.55 116.02 1t0g h SER 45 Ca -0.00 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.49 1t0g h SER 45 Cb 0.23 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.70 1t0g h SER 45 CO 0.01 0.06 -2.55 0.49 -1.14 0.00 0.00 176.83 173.70 1t0g n PHE 46 N -3.97 0.00 -0.04 3.45 3.72 -0.19 -4.54 117.46 115.89 1t0g n PHE 46 Ca -0.03 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.35 1t0g n PHE 46 Cb 0.15 -1.00 -0.01 0.00 -0.94 0.00 0.00 39.48 37.68 1t0g n PHE 46 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1t0g n TYR 47 N -4.16 0.57 0.63 1.38 4.01 -0.64 -2.62 117.16 116.32 1t0g n TYR 47 Ca -0.54 0.25 0.08 0.00 -0.16 0.00 0.00 57.90 57.53 1t0g n TYR 47 Cb 0.90 -0.57 0.37 0.00 -0.31 0.00 0.00 39.34 39.74 1t0g n TYR 47 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1t0g n GLY 48 N 1.66 -1.03 0.70 2.72 0.00 -0.95 -2.14 105.19 106.15 1t0g n GLY 48 Ca -0.05 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.45 2.04 -2.13 1.61 2.88 0.40 -4.63 113.62 112.33 1t0g n SER 49 Ca 0.05 -2.02 -0.12 0.00 -1.33 0.00 0.00 58.87 55.45 1t0g n SER 49 Cb 0.18 -0.26 0.04 0.00 -0.75 0.00 0.00 64.21 63.43 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 1.07 0.16 0.00 0.46 0.00 -0.91 -5.02 105.19 100.94 1t0g n GLY 50 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.27 0.08 0.19 -0.02 0.00 -1.08 -4.87 105.19 98.22 1t0g n GLY 51 Ca -0.01 -1.70 0.05 0.00 0.00 0.00 0.00 46.02 44.36 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 0.00 -0.40 1.61 3.58 -1.92 -2.93 116.42 116.36 1t0g h ASP 52 Ca 0.00 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.31 1t0g h ASP 52 Cb 0.00 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 40.97 1t0g h ASP 52 CO 0.00 0.39 0.04 -1.22 -2.88 0.00 0.00 179.24 175.57 1t0g n TYR 53 N -3.64 1.29 0.47 0.28 4.01 -1.25 -4.62 117.16 113.70 1t0g n TYR 53 Ca -0.01 -1.31 0.07 0.00 -0.16 0.00 0.00 57.90 56.49 1t0g n TYR 53 Cb 0.49 -0.48 0.30 0.00 -0.31 0.00 0.00 39.34 39.35 1t0g n TYR 53 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1t0g n SER 54 N -0.82 0.03 -0.11 7.72 2.88 -1.11 -3.57 113.62 118.64 1t0g n SER 54 Ca 0.31 0.51 -0.05 0.00 -1.33 0.00 0.00 58.87 58.31 1t0g n SER 54 Cb 1.06 -0.51 0.02 0.00 -0.75 0.00 0.00 64.21 64.03 1t0g n SER 54 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1t0g h MET 55 N 0.00 0.12 -0.58 -1.46 2.86 -1.85 -2.42 114.93 111.60 1t0g h MET 55 Ca 0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1t0g h MET 55 Cb 0.24 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1t0g h MET 55 CO 0.00 0.08 0.00 1.97 1.06 0.00 0.00 176.91 180.02 1t0g n PHE 56 N -5.17 0.91 -2.16 -0.22 1.16 -1.23 -4.67 117.46 106.08 1t0g n PHE 56 Ca 0.02 -0.40 -0.42 0.00 -1.87 0.00 0.00 57.45 54.78 1t0g n PHE 56 Cb 0.20 -0.09 -0.03 0.00 -1.61 0.00 0.00 39.48 37.95 1t0g n PHE 56 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1t0g s ALA 57 N -1.51 2.75 0.00 1.98 0.00 -0.91 -1.59 121.76 122.48 1t0g s ALA 57 Ca 0.37 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.15 1t0g s ALA 57 Cb 0.22 -4.07 0.00 0.00 0.00 0.00 0.00 23.12 19.26 1t0g s ALA 57 CO 0.22 -2.89 0.00 0.41 0.00 0.00 0.00 175.76 173.49 1t0g n GLY 58 N 5.37 0.40 3.09 0.00 0.00 0.90 -4.15 105.19 110.79 1t0g n GLY 58 Ca 0.19 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.40 0.24 -0.08 1.61 2.47 -0.62 -2.78 119.74 118.17 1t0g s LYS 59 Ca 0.00 0.35 -0.30 0.00 -1.56 0.00 0.00 55.97 54.46 1t0g s LYS 59 Cb 0.00 0.07 -0.02 0.00 -1.46 0.00 0.00 37.83 36.42 1t0g s LYS 59 CO 0.00 -0.06 1.04 0.34 0.16 0.00 0.00 175.35 176.83 1t0g s ASP 60 N 0.36 7.23 -0.17 1.43 -1.08 -1.26 -2.81 116.67 120.36 1t0g s ASP 60 Ca -0.02 1.60 0.16 0.00 -0.52 0.00 0.00 52.55 53.77 1t0g s ASP 60 Cb -0.03 -2.56 0.44 0.00 -1.46 0.00 0.00 42.92 39.31 1t0g s ASP 60 CO -0.02 -0.45 1.19 0.00 0.52 0.00 0.00 175.17 176.42 1t0g n ALA 61 N 4.89 3.43 -0.28 3.66 0.00 -0.69 -3.63 120.51 127.89 1t0g n ALA 61 Ca 0.09 -3.07 0.00 0.00 0.00 0.00 0.00 53.44 50.46 1t0g n ALA 61 Cb 0.49 -0.51 0.13 0.00 0.00 0.00 0.00 19.45 19.56 1t0g n ALA 61 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1t0g h SER 62 N 1.37 0.70 0.73 0.00 0.87 -1.67 -0.16 113.55 115.39 1t0g h SER 62 Ca -0.01 0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 60.41 1t0g h SER 62 Cb 1.37 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 63.19 1t0g h SER 62 CO 0.18 0.44 -0.77 0.08 -0.53 0.00 0.00 176.83 176.23 1t0g h ARG 63 N 0.83 0.03 -0.21 2.24 0.11 -1.59 -3.24 114.38 112.56 1t0g h ARG 63 Ca 0.35 -0.03 -0.10 0.00 0.10 0.00 0.00 59.98 60.30 1t0g h ARG 63 Cb 0.21 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 1t0g h ARG 63 CO -0.19 0.79 -0.31 0.00 0.10 0.00 0.00 179.97 180.36 1t0g h ALA 64 N 1.20 1.09 -0.03 0.08 0.00 -1.25 0.10 119.26 120.45 1t0g h ALA 64 Ca -0.01 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1t0g h ALA 64 Cb 1.36 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1t0g h ALA 64 CO 0.10 0.57 -0.07 -0.07 0.00 0.00 0.00 179.25 179.79 1t0g h LEU 65 N 0.36 0.04 0.00 0.00 3.38 -1.12 0.48 115.31 118.45 1t0g h LEU 65 Ca 0.05 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1t0g h LEU 65 Cb 0.72 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1t0g h LEU 65 CO 0.06 0.11 -0.70 1.23 0.09 0.00 0.00 178.44 179.22 1t0g h GLY 66 N 0.28 0.00 0.35 0.83 0.00 -0.87 -2.93 103.07 100.73 1t0g h GLY 66 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.02 1t0g h GLY 66 CO 0.01 0.00 -2.12 0.28 0.00 0.00 0.00 176.54 174.71 1t0g n LYS 67 N -2.81 0.67 -0.96 4.80 4.76 -0.69 -4.52 118.16 119.41 1t0g n LYS 67 Ca 0.01 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 1t0g n LYS 67 Cb 0.55 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 1t0g n LYS 67 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1t0g n MET 68 N -2.82 0.00 -3.18 1.97 2.81 0.16 -5.03 117.12 111.04 1t0g n MET 68 Ca -0.26 0.42 -0.39 0.00 -1.81 0.00 0.00 57.70 55.67 1t0g n MET 68 Cb 1.09 -3.72 -0.06 0.00 -0.71 0.00 0.00 33.22 29.82 1t0g n MET 68 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1t0g s SER 69 N -2.84 7.17 -0.00 7.83 0.01 -0.94 -4.95 113.70 119.97 1t0g s SER 69 Ca 0.00 1.38 0.10 0.00 1.31 0.00 0.00 55.95 58.74 1t0g s SER 69 Cb 0.00 -2.41 -0.11 0.00 0.21 0.00 0.00 66.02 63.71 1t0g s SER 69 CO 0.00 0.25 0.43 0.29 0.41 0.00 0.00 173.24 174.61 1t0g n LYS 70 N 1.73 3.59 -2.40 12.44 5.02 -1.26 -4.61 118.16 132.66 1t0g n LYS 70 Ca -0.09 -0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.80 1t0g n LYS 70 Cb 0.50 -0.98 -0.04 0.00 -0.02 0.00 0.00 35.03 34.49 1t0g n LYS 70 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1t0g s ASN 71 N -1.98 7.16 0.44 4.39 4.22 -1.26 -4.90 114.94 123.02 1t0g s ASN 71 Ca 0.04 2.33 0.13 0.00 -2.14 0.00 0.00 52.86 53.22 1t0g s ASN 71 Cb 0.08 -2.63 1.03 0.00 1.28 0.00 0.00 41.25 41.01 1t0g s ASN 71 CO 0.42 -0.24 2.01 1.05 -2.04 0.00 0.00 177.10 178.30 1t0g h GLU 72 N 3.98 0.37 0.00 3.55 9.09 -1.94 0.09 114.58 129.73 1t0g h GLU 72 Ca -0.47 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 58.92 1t0g h GLU 72 Cb 1.21 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 28.23 1t0g h GLU 72 CO 0.68 0.25 0.00 0.93 0.05 0.00 0.00 179.01 180.91 1t0g h GLU 73 N 0.38 0.00 -0.06 1.06 4.39 -2.01 -1.41 114.58 116.94 1t0g h GLU 73 Ca 0.22 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.92 1t0g h GLU 73 Cb 0.39 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1t0g h GLU 73 CO -0.06 0.00 0.00 -3.47 -1.16 0.00 0.00 179.01 174.32 1t0g n ASP 74 N -2.67 1.78 -4.66 1.42 2.03 -0.01 -4.96 116.55 109.49 1t0g n ASP 74 Ca -0.02 -1.57 -0.38 0.00 0.52 0.00 0.00 54.79 53.34 1t0g n ASP 74 Cb 0.09 -0.04 -0.08 0.00 -0.72 0.00 0.00 41.12 40.37 1t0g n ASP 74 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1t0g s VAL 75 N -0.64 5.19 -0.00 5.18 1.01 -0.53 -3.74 120.40 126.87 1t0g s VAL 75 Ca 0.06 0.68 -0.16 0.00 0.00 0.00 0.00 61.98 62.56 1t0g s VAL 75 Cb 0.03 -3.72 0.03 0.00 0.00 0.00 0.00 36.38 32.72 1t0g s VAL 75 CO 0.05 0.23 0.34 -0.55 0.00 0.00 0.00 175.10 175.18 1t0g s SER 76 N 1.14 -0.22 0.00 3.32 0.15 -1.24 -4.95 113.70 111.90 1t0g s SER 76 Ca 0.18 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.91 1t0g s SER 76 Cb -0.15 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 1t0g s SER 76 CO 0.08 -0.51 0.44 -0.81 1.20 0.00 0.00 173.24 173.64 1t0g n PRO 77 N 1.06 0.59 -3.86 5.44 -0.04 -1.25 -3.32 135.00 133.62 1t0g n PRO 77 Ca -0.21 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.16 1t0g n PRO 77 Cb 0.57 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 1t0g n PRO 77 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1t0g s SER 78 N -0.88 0.03 -0.12 3.54 0.01 -1.26 -4.72 113.70 110.31 1t0g s SER 78 Ca 0.00 -1.05 -0.11 0.00 1.31 0.00 0.00 55.95 56.11 1t0g s SER 78 Cb 0.00 0.79 -0.26 0.00 0.21 0.00 0.00 66.02 66.76 1t0g s SER 78 CO 0.00 -1.54 0.42 -0.07 0.41 0.00 0.00 173.24 172.46 1t0g h LEU 79 N 2.02 0.39 0.00 2.44 4.07 -1.87 -2.88 115.31 119.48 1t0g h LEU 79 Ca -0.28 -0.88 0.00 0.00 0.08 0.00 0.00 57.88 56.79 1t0g h LEU 79 Cb 1.25 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.86 1t0g h LEU 79 CO 0.36 1.77 0.00 -1.84 -1.08 0.00 0.00 178.44 177.65 1t0g n GLU 80 N -3.68 0.00 -3.16 1.13 0.28 -1.26 -3.91 120.64 110.04 1t0g n GLU 80 Ca -0.30 0.00 -0.21 0.00 -0.16 0.00 0.00 57.16 56.49 1t0g n GLU 80 Cb 0.99 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.81 1t0g n GLU 80 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1t0g n GLY 81 N 0.00 3.82 2.90 -1.84 0.00 -1.26 -5.05 105.19 103.76 1t0g n GLY 81 Ca 0.00 -1.88 -0.20 0.00 0.00 0.00 0.00 46.02 43.94 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 -2.35 1.34 0.76 0.99 1.43 -1.25 -5.09 118.68 114.52 1t0g s LEU 82 Ca 0.40 -0.13 -0.07 0.00 -1.03 0.00 0.00 54.13 53.30 1t0g s LEU 82 Cb 0.30 -0.46 0.11 0.00 0.03 0.00 0.00 46.19 46.17 1t0g s LEU 82 CO -0.09 -0.05 1.07 0.28 0.23 0.00 0.00 176.35 177.78 1t0g s THR 83 N 0.90 2.19 0.29 5.49 -1.32 -1.26 -4.78 115.64 117.15 1t0g s THR 83 Ca -0.11 -0.33 0.03 0.00 -1.21 0.00 0.00 61.69 60.07 1t0g s THR 83 Cb -0.14 -2.87 0.28 0.00 -1.51 0.00 0.00 72.50 68.26 1t0g s THR 83 CO 0.00 0.00 1.80 -0.08 -2.21 0.00 0.00 174.62 174.13 1t0g h GLU 84 N -0.78 0.83 -0.20 7.08 4.81 -2.01 0.87 114.58 125.18 1t0g h GLU 84 Ca -0.42 -0.05 0.06 0.00 -0.13 0.00 0.00 59.36 58.82 1t0g h GLU 84 Cb 1.28 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 1t0g h GLU 84 CO 0.49 0.55 -0.24 -0.22 -0.73 0.00 0.00 179.01 178.86 1t0g h LYS 85 N 0.85 -0.26 -0.36 1.92 3.64 -2.00 0.31 116.57 120.68 1t0g h LYS 85 Ca 0.52 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.88 1t0g h LYS 85 Cb 0.67 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1t0g h LYS 85 CO -0.32 -0.17 0.08 0.93 -2.27 0.00 0.00 179.45 177.70 1t0g h GLU 86 N -0.27 0.57 -0.26 1.90 4.39 -1.58 -2.69 114.58 116.64 1t0g h GLU 86 Ca 0.12 -0.14 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 1t0g h GLU 86 Cb 0.45 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1t0g h GLU 86 CO -0.35 0.62 -0.02 0.82 -1.16 0.00 0.00 179.01 178.92 1t0g h ILE 87 N 0.43 1.17 -1.03 3.13 2.04 -0.12 -3.02 117.51 120.12 1t0g h ILE 87 Ca 0.11 -0.70 0.26 0.00 1.00 0.00 0.00 64.86 65.53 1t0g h ILE 87 Cb 0.31 1.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.30 1t0g h ILE 87 CO 0.00 0.23 0.67 0.78 0.00 0.00 0.00 178.15 179.83 1t0g h ASN 88 N 0.39 0.41 -0.11 1.72 2.35 -0.05 0.61 115.58 120.90 1t0g h ASN 88 Ca 0.09 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1t0g h ASN 88 Cb 0.30 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.66 1t0g h ASN 88 CO 0.01 0.09 0.03 0.74 -1.65 0.00 0.00 177.43 176.65 1t0g h THR 89 N 0.37 1.19 -0.14 2.81 2.02 -1.66 -1.34 112.91 116.17 1t0g h THR 89 Ca 0.57 -0.60 -0.13 0.00 0.77 0.00 0.00 66.41 67.03 1t0g h THR 89 Cb 1.49 1.39 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1t0g h THR 89 CO -0.26 0.17 -0.42 0.25 0.37 0.00 0.00 175.52 175.64 1t0g h LEU 90 N -0.03 0.61 -1.55 2.58 5.85 -0.75 -2.59 115.31 119.43 1t0g h LEU 90 Ca 0.03 -0.60 0.23 0.00 0.84 0.00 0.00 57.88 58.38 1t0g h LEU 90 Cb 0.25 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.03 1t0g h LEU 90 CO 0.00 1.10 0.62 -1.13 -0.34 0.00 0.00 178.44 178.69 1t0g h ASN 91 N 0.15 0.36 -0.11 1.25 -0.73 0.15 0.67 115.58 117.31 1t0g h ASN 91 Ca -0.01 0.04 -0.07 0.00 1.87 0.00 0.00 56.30 58.13 1t0g h ASN 91 Cb 1.04 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.61 1t0g h ASN 91 CO 0.09 0.12 -0.20 -0.78 -0.37 0.00 0.00 177.43 176.29 1t0g h ASP 92 N 0.35 0.36 -0.86 1.15 3.58 -1.08 -3.25 116.42 116.67 1t0g h ASP 92 Ca 0.49 -0.55 0.02 0.00 0.42 0.00 0.00 57.03 57.41 1t0g h ASP 92 Cb 1.33 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 42.23 1t0g h ASP 92 CO -0.18 0.85 0.57 -0.50 -2.88 0.00 0.00 179.24 177.10 1t0g h TRP 93 N -0.11 1.06 -0.44 0.28 4.06 -0.09 -2.33 115.95 118.39 1t0g h TRP 93 Ca 0.01 0.03 0.09 0.00 2.06 0.00 0.00 58.89 61.07 1t0g h TRP 93 Cb 0.79 -0.36 -0.09 0.00 -1.00 0.00 0.00 29.16 28.49 1t0g h TRP 93 CO 0.11 0.65 -0.20 0.93 -3.56 0.00 0.00 178.44 176.37 1t0g h GLU 94 N 1.13 -0.10 0.00 0.49 5.08 0.10 -0.56 114.58 120.72 1t0g h GLU 94 Ca 0.32 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.67 1t0g h GLU 94 Cb -0.08 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 1t0g h GLU 94 CO -0.08 -0.07 -0.09 1.15 -1.00 0.00 0.00 179.01 178.93 1t0g h THR 95 N -0.11 0.94 -0.02 1.13 2.02 -1.46 0.40 112.91 115.81 1t0g h THR 95 Ca 0.21 -0.31 -0.21 0.00 0.77 0.00 0.00 66.41 66.87 1t0g h THR 95 Cb 0.43 1.17 0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1t0g h THR 95 CO -0.51 0.08 -0.81 0.11 0.37 0.00 0.00 175.52 174.77 1t0g h LYS 96 N 0.00 0.59 0.21 6.66 1.79 -0.92 -2.23 116.57 122.67 1t0g h LYS 96 Ca -0.00 -0.60 -0.34 0.00 -2.18 0.00 0.00 60.65 57.52 1t0g h LYS 96 Cb 0.16 0.16 0.02 0.00 -1.58 0.00 0.00 32.23 31.00 1t0g h LYS 96 CO 0.01 1.22 -1.63 0.74 -1.08 0.00 0.00 179.45 178.71 1t0g h PHE 97 N 0.20 0.80 -0.11 -1.35 -1.00 -1.05 -3.30 116.94 111.13 1t0g h PHE 97 Ca -0.09 -0.58 -0.06 0.00 2.81 0.00 0.00 57.97 60.05 1t0g h PHE 97 Cb 1.48 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 41.00 1t0g h PHE 97 CO 0.12 1.61 -0.19 1.49 -1.61 0.00 0.00 178.31 179.72 1t0g h GLU 98 N 0.12 0.17 -0.54 1.51 4.22 -0.25 0.45 114.58 120.27 1t0g h GLU 98 Ca -0.30 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.09 1t0g h GLU 98 Cb 2.12 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.35 1t0g h GLU 98 CO 0.21 0.37 0.00 0.00 -2.18 0.00 0.00 179.01 177.41 1t0g n ALA 99 N -2.49 2.41 0.00 2.92 0.00 -0.84 -4.20 120.51 118.32 1t0g n ALA 99 Ca -0.01 -0.97 0.00 0.00 0.00 0.00 0.00 53.44 52.46 1t0g n ALA 99 Cb 0.30 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 1.13 0.75 -4.43 0.00 3.00 -0.58 -5.06 118.16 112.98 1t0g n LYS 100 Ca 0.19 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.20 1t0g n LYS 100 Cb 0.48 -0.76 -0.12 0.00 0.00 0.00 0.00 35.03 34.63 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 -1.51 2.43 0.23 5.64 2.02 0.15 -5.07 117.35 121.23 1t0g s TYR 101 Ca 0.00 -0.32 -0.25 0.00 -0.37 0.00 0.00 57.07 56.13 1t0g s TYR 101 Cb 0.00 -1.33 -0.09 0.00 -0.40 0.00 0.00 41.96 40.15 1t0g s TYR 101 CO 0.00 0.33 0.83 -1.25 -1.57 0.00 0.00 175.55 173.89 1t0g s PRO 102 N -1.95 4.55 -0.44 -1.71 0.04 -1.26 -4.55 135.00 129.69 1t0g s PRO 102 Ca 0.15 1.19 -0.28 0.00 0.04 0.00 0.00 61.00 62.10 1t0g s PRO 102 Cb -0.10 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.38 1t0g s PRO 102 CO 0.07 0.45 1.53 0.08 0.04 0.00 0.00 177.00 179.17 1t0g s VAL 103 N -1.36 3.74 -0.22 -0.36 1.01 -1.26 -2.36 120.40 119.59 1t0g s VAL 103 Ca 0.42 0.72 0.22 0.00 0.00 0.00 0.00 61.98 63.34 1t0g s VAL 103 Cb -0.21 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 1t0g s VAL 103 CO 0.25 -0.77 1.00 1.33 0.00 0.00 0.00 175.10 176.91 1t0g n VAL 104 N 7.13 0.64 0.00 2.92 0.24 -0.02 -5.00 118.33 124.25 1t0g n VAL 104 Ca 0.17 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 1t0g n VAL 104 Cb 0.48 -0.36 0.00 0.00 -1.47 0.00 0.00 33.84 32.50 1t0g n VAL 104 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1t0g n GLY 105 N 1.20 -0.78 3.21 7.63 0.00 -1.16 -2.27 105.19 113.02 1t0g n GLY 105 Ca -0.01 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.46 0.89 -0.18 1.61 3.03 -1.09 -1.08 118.95 121.67 1t0g s ARG 106 Ca 0.00 -1.13 -0.08 0.00 2.03 0.00 0.00 55.73 56.55 1t0g s ARG 106 Cb 0.00 0.31 -0.04 0.00 -1.03 0.00 0.00 34.95 34.19 1t0g s ARG 106 CO 0.00 -0.27 0.10 0.54 -1.13 0.00 0.00 175.30 174.53 1t0g s VAL 107 N -3.92 5.11 -0.06 4.99 0.11 0.93 -0.41 120.40 127.15 1t0g s VAL 107 Ca 0.11 0.08 0.05 0.00 -2.93 0.00 0.00 61.98 59.29 1t0g s VAL 107 Cb 0.05 -3.30 -0.02 0.00 -1.53 0.00 0.00 36.38 31.59 1t0g s VAL 107 CO -0.06 0.48 -0.21 0.54 -3.33 0.00 0.00 175.10 172.51 1t0g s VAL 108 N 0.16 2.46 0.00 2.04 0.11 0.28 -4.82 120.40 120.63 1t0g s VAL 108 Ca 0.07 -0.93 0.00 0.00 -2.93 0.00 0.00 61.98 58.19 1t0g s VAL 108 Cb -0.12 -1.93 0.00 0.00 -1.53 0.00 0.00 36.38 32.81 1t0g s VAL 108 CO -0.00 0.57 0.00 -1.20 -3.33 0.00 0.00 175.10 171.14