#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t0g s GLY 2 N 0.00 -1.09 0.00 3.03 0.00 -1.26 -4.97 107.32 103.03 1t0g s GLY 2 Ca 0.00 1.55 0.00 0.00 0.00 0.00 0.00 44.72 46.27 1t0g s GLY 2 CO 0.00 3.54 0.00 1.42 0.00 0.00 0.00 173.10 178.06 1t0g n HIS 3 N 5.42 0.00 -3.33 1.90 -0.00 -1.26 -4.99 115.22 112.96 1t0g n HIS 3 Ca 0.02 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.75 1t0g n HIS 3 Cb 0.52 -0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.49 1t0g n HIS 3 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1t0g s HIS 4 N -0.10 -1.49 -0.38 4.41 0.09 -1.26 -5.02 115.29 111.55 1t0g s HIS 4 Ca 0.00 1.90 0.01 0.00 -0.00 0.00 0.00 55.06 56.97 1t0g s HIS 4 Cb 0.00 0.63 0.12 0.00 -0.00 0.00 0.00 32.58 33.33 1t0g s HIS 4 CO 0.00 -0.80 0.16 -3.38 -0.00 0.00 0.00 174.74 170.72 1t0g s HIS 5 N 2.86 2.17 -1.10 1.40 -3.43 -1.26 -5.05 115.29 110.88 1t0g s HIS 5 Ca 0.11 -2.27 -0.21 0.00 -0.80 0.00 0.00 55.06 51.89 1t0g s HIS 5 Cb -0.14 -2.01 -0.08 0.00 -1.43 0.00 0.00 32.58 28.92 1t0g s HIS 5 CO -0.20 -0.84 1.92 -2.39 -2.00 0.00 0.00 174.74 171.23 1t0g n HIS 6 N 4.13 2.81 -3.46 0.38 1.44 -1.26 -4.70 115.22 114.56 1t0g n HIS 6 Ca 0.04 -1.83 -0.22 0.00 -2.01 0.00 0.00 57.72 53.70 1t0g n HIS 6 Cb 0.38 -2.37 -0.12 0.00 0.12 0.00 0.00 29.99 28.00 1t0g n HIS 6 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 1t0g s HIS 7 N 8.04 -0.14 0.00 -1.40 3.76 -1.26 -5.09 115.29 119.20 1t0g s HIS 7 Ca 0.62 -0.45 0.00 0.00 -0.15 0.00 0.00 55.06 55.08 1t0g s HIS 7 Cb 0.05 -0.64 0.00 0.00 1.11 0.00 0.00 32.58 33.10 1t0g s HIS 7 CO 0.11 -0.88 0.00 0.72 -0.85 0.00 0.00 174.74 173.85 1t0g n HIS 8 N 5.29 -0.72 -1.61 1.40 -0.00 -1.26 -4.72 115.22 113.58 1t0g n HIS 8 Ca -0.04 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.39 1t0g n HIS 8 Cb 0.45 0.15 0.10 0.00 -0.00 0.00 0.00 29.99 30.68 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 0.00 2.49 -0.55 2.41 1.43 -1.26 -4.94 118.68 118.25 1t0g s LEU 9 Ca 0.00 1.16 -0.28 0.00 -1.03 0.00 0.00 54.13 53.99 1t0g s LEU 9 Cb 0.00 -3.72 0.00 0.00 0.03 0.00 0.00 46.19 42.50 1t0g s LEU 9 CO 0.00 -2.03 1.53 -1.61 0.23 0.00 0.00 176.35 174.47 1t0g s GLU 10 N -5.24 3.18 -0.14 1.70 0.41 0.08 -4.77 118.70 113.93 1t0g s GLU 10 Ca 0.61 0.57 -0.29 0.00 -0.41 0.00 0.00 54.97 55.45 1t0g s GLU 10 Cb -0.14 -4.18 -0.01 0.00 -1.78 0.00 0.00 34.13 28.02 1t0g s GLU 10 CO 0.53 -2.07 1.14 -2.00 -0.49 0.00 0.00 175.26 172.37 1t0g s GLU 11 N 5.80 4.31 -0.00 1.61 2.12 -1.26 0.31 118.70 131.59 1t0g s GLU 11 Ca 0.58 1.53 0.07 0.00 0.36 0.00 0.00 54.97 57.51 1t0g s GLU 11 Cb -0.12 -3.63 -0.02 0.00 0.26 0.00 0.00 34.13 30.62 1t0g s GLU 11 CO 0.25 -0.53 -0.23 -0.06 -0.54 0.00 0.00 175.26 174.15 1t0g s PHE 12 N 2.73 2.04 0.05 5.30 0.08 0.57 -4.93 117.98 123.83 1t0g s PHE 12 Ca 0.51 -0.39 -0.04 0.00 0.12 0.00 0.00 56.93 57.14 1t0g s PHE 12 Cb -0.20 -1.29 -0.05 0.00 -0.57 0.00 0.00 43.02 40.91 1t0g s PHE 12 CO 0.15 0.00 0.27 0.99 -0.10 0.00 0.00 175.22 176.53 1t0g s THR 13 N -0.60 5.31 0.27 0.64 2.01 -1.26 0.69 115.64 122.70 1t0g s THR 13 Ca 0.09 -0.06 -0.04 0.00 0.31 0.00 0.00 61.69 61.98 1t0g s THR 13 Cb -0.09 -3.60 0.26 0.00 0.01 0.00 0.00 72.50 69.09 1t0g s THR 13 CO -0.00 0.21 1.94 0.00 -0.69 0.00 0.00 174.62 176.08 1t0g h ALA 14 N 3.42 1.33 -0.20 7.40 0.00 -1.73 0.47 119.26 129.93 1t0g h ALA 14 Ca -0.47 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.38 1t0g h ALA 14 Cb 1.18 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1t0g h ALA 14 CO 0.71 0.62 0.11 0.93 0.00 0.00 0.00 179.25 181.61 1t0g h GLU 15 N 1.28 0.22 -0.59 0.00 4.39 -1.95 -1.46 114.58 116.47 1t0g h GLU 15 Ca 0.35 -0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.97 1t0g h GLU 15 Cb -0.13 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 1t0g h GLU 15 CO -0.08 0.15 0.08 1.96 -1.16 0.00 0.00 179.01 179.96 1t0g h GLN 16 N 0.23 0.97 0.00 2.33 7.50 -1.71 -2.96 115.11 121.46 1t0g h GLN 16 Ca 0.08 -0.25 -0.08 0.00 0.50 0.00 0.00 58.65 58.91 1t0g h GLN 16 Cb 0.01 -0.12 -0.01 0.00 0.05 0.00 0.00 27.48 27.41 1t0g h GLN 16 CO -0.05 0.90 -0.37 1.25 -1.50 0.00 0.00 178.83 179.06 1t0g h LEU 17 N 0.91 0.00 -0.73 1.46 5.85 0.24 -3.32 115.31 119.73 1t0g h LEU 17 Ca 0.18 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1t0g h LEU 17 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1t0g h LEU 17 CO 0.01 0.37 0.00 -1.20 -0.34 0.00 0.00 178.44 177.29 1t0g n SER 18 N -4.05 0.10 0.00 1.25 7.64 -0.58 -0.23 113.62 117.76 1t0g n SER 18 Ca -0.02 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.58 1t0g n SER 18 Cb 0.41 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 1t0g n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1t0g n GLN 19 N 0.18 2.76 -1.16 1.43 6.02 -1.25 -4.76 117.38 120.60 1t0g n GLN 19 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.72 1t0g n GLN 19 Cb 0.03 -0.77 0.06 0.00 1.02 0.00 0.00 30.24 30.58 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 -1.20 2.48 1.22 1.08 4.01 0.68 -4.17 117.16 121.26 1t0g n TYR 20 Ca 0.00 -2.55 0.13 0.00 -0.16 0.00 0.00 57.90 55.32 1t0g n TYR 20 Cb 0.00 -1.24 0.46 0.00 -0.31 0.00 0.00 39.34 38.25 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 -0.34 0.59 0.00 7.72 0.23 -1.26 -1.83 115.26 120.37 1t0g n ASN 21 Ca 0.48 -0.47 0.00 0.00 -0.53 0.00 0.00 54.58 54.06 1t0g n ASN 21 Cb 0.61 0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.33 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 1.37 1.50 0.45 4.83 0.00 -1.26 -3.72 105.19 108.36 1t0g n GLY 22 Ca 0.11 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.00 0.00 -2.00 2.61 5.66 -1.26 -4.65 114.28 112.63 1t0g n THR 23 Ca 0.00 -0.23 -0.26 0.00 -3.05 0.00 0.00 64.05 60.51 1t0g n THR 23 Cb 0.00 0.76 0.17 0.00 -1.55 0.00 0.00 70.33 69.72 1t0g n THR 23 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1t0g n ASP 24 N -0.07 0.34 -4.57 1.09 -0.08 -1.26 -4.89 116.55 107.11 1t0g n ASP 24 Ca 0.13 -1.57 -0.41 0.00 -1.51 0.00 0.00 54.79 51.43 1t0g n ASP 24 Cb 0.41 -0.86 -0.02 0.00 2.34 0.00 0.00 41.12 42.99 1t0g n ASP 24 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 1t0g s GLU 25 N -5.50 3.70 -0.09 -0.67 -1.05 -1.26 -4.10 118.70 109.72 1t0g s GLU 25 Ca 0.67 -1.55 -0.00 0.00 -0.15 0.00 0.00 54.97 53.94 1t0g s GLU 25 Cb -0.02 -5.44 -0.00 0.00 -0.44 0.00 0.00 34.13 28.23 1t0g s GLU 25 CO 0.47 -2.38 0.09 0.45 0.95 0.00 0.00 175.26 174.84 1t0g n SER 26 N 9.13 -2.70 -4.15 0.83 2.88 -1.26 -5.07 113.62 113.28 1t0g n SER 26 Ca 0.42 -0.02 -0.30 0.00 -1.33 0.00 0.00 58.87 57.65 1t0g n SER 26 Cb 0.48 -1.48 -0.17 0.00 -0.75 0.00 0.00 64.21 62.29 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 -3.02 2.59 0.65 -1.46 3.01 -1.26 -5.12 119.74 115.13 1t0g s LYS 27 Ca 0.01 -0.72 -0.17 0.00 -1.01 0.00 0.00 55.97 54.08 1t0g s LYS 27 Cb -0.00 -2.02 -0.02 0.00 -1.01 0.00 0.00 37.83 34.78 1t0g s LYS 27 CO 0.09 0.10 1.07 -2.30 0.51 0.00 0.00 175.35 174.82 1t0g n PRO 28 N 3.71 0.84 -3.88 -1.68 -0.02 -1.26 -4.11 135.00 128.59 1t0g n PRO 28 Ca -0.20 0.34 -0.36 0.00 -2.02 0.00 0.00 63.50 61.26 1t0g n PRO 28 Cb 0.52 -2.30 -0.13 0.00 -0.02 0.00 0.00 33.50 31.57 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 -1.56 3.83 -0.04 4.25 1.01 -1.25 -4.31 121.20 123.12 1t0g s ILE 29 Ca 0.78 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 61.09 1t0g s ILE 29 Cb -0.38 -2.76 0.03 0.00 0.01 0.00 0.00 42.46 39.35 1t0g s ILE 29 CO 0.45 0.39 -0.01 -0.31 0.00 0.00 0.00 174.94 175.47 1t0g s TYR 30 N 1.44 0.46 -0.09 3.97 2.02 -0.71 -1.76 117.35 122.68 1t0g s TYR 30 Ca 0.05 -0.06 0.01 0.00 -0.37 0.00 0.00 57.07 56.70 1t0g s TYR 30 Cb -0.15 -0.52 -0.02 0.00 -0.40 0.00 0.00 41.96 40.87 1t0g s TYR 30 CO 0.00 -0.17 -0.11 0.08 -1.57 0.00 0.00 175.55 173.78 1t0g s VAL 31 N 1.13 3.28 -0.10 0.71 1.01 -0.98 -3.34 120.40 122.12 1t0g s VAL 31 Ca -0.08 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.30 1t0g s VAL 31 Cb -0.14 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 1t0g s VAL 31 CO -0.02 0.56 -0.14 0.00 0.00 0.00 0.00 175.10 175.50 1t0g s ALA 32 N -0.31 2.60 -0.18 5.51 0.00 -1.20 -0.01 121.76 128.16 1t0g s ALA 32 Ca 0.03 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 1t0g s ALA 32 Cb -0.13 -1.08 0.05 0.00 0.00 0.00 0.00 23.12 21.96 1t0g s ALA 32 CO 0.03 0.37 -0.03 0.42 0.00 0.00 0.00 175.76 176.54 1t0g s ILE 33 N -0.07 1.04 -0.76 0.00 1.01 0.37 -0.79 121.20 122.01 1t0g s ILE 33 Ca -0.03 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.93 1t0g s ILE 33 Cb -0.14 -1.30 0.00 0.00 0.01 0.00 0.00 42.46 41.03 1t0g s ILE 33 CO 0.04 0.02 0.00 1.17 0.00 0.00 0.00 174.94 176.17 1t0g n LYS 34 N 4.88 -1.39 0.00 2.79 0.00 -1.26 -1.20 118.16 121.98 1t0g n LYS 34 Ca -0.11 0.69 0.00 0.00 0.00 0.00 0.00 58.31 58.89 1t0g n LYS 34 Cb 0.47 -4.88 0.00 0.00 0.00 0.00 0.00 35.03 30.62 1t0g n LYS 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1t0g n GLY 35 N -0.32 2.46 3.67 3.14 0.00 -1.26 -5.01 105.19 107.87 1t0g n GLY 35 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.42 4.30 -0.28 1.61 0.52 -0.34 0.46 118.95 124.80 1t0g s ARG 36 Ca 0.00 0.94 -0.14 0.00 -0.52 0.00 0.00 55.73 56.01 1t0g s ARG 36 Cb 0.00 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.87 1t0g s ARG 36 CO 0.00 -0.26 0.33 0.08 0.02 0.00 0.00 175.30 175.47 1t0g s VAL 37 N 1.94 5.20 0.01 3.52 1.01 0.69 -0.48 120.40 132.30 1t0g s VAL 37 Ca 0.37 0.41 -0.07 0.00 0.00 0.00 0.00 61.98 62.69 1t0g s VAL 37 Cb -0.17 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 1t0g s VAL 37 CO 0.13 0.14 0.28 -0.36 0.00 0.00 0.00 175.10 175.29 1t0g s PHE 38 N 2.00 3.58 -0.46 5.22 0.40 0.98 0.14 117.98 129.82 1t0g s PHE 38 Ca 0.13 0.59 -0.25 0.00 -0.60 0.00 0.00 56.93 56.79 1t0g s PHE 38 Cb -0.16 -2.00 0.03 0.00 0.51 0.00 0.00 43.02 41.40 1t0g s PHE 38 CO 0.10 0.61 0.92 0.34 0.70 0.00 0.00 175.22 177.89 1t0g s ASP 39 N -1.71 6.49 -0.11 1.36 -1.08 -0.95 -2.33 116.67 118.35 1t0g s ASP 39 Ca 0.28 0.09 0.14 0.00 -0.52 0.00 0.00 52.55 52.54 1t0g s ASP 39 Cb -0.13 -2.45 0.45 0.00 -1.46 0.00 0.00 42.92 39.33 1t0g s ASP 39 CO 0.16 -1.06 1.36 1.33 0.52 0.00 0.00 175.17 177.49 1t0g n VAL 40 N 6.41 1.81 0.09 1.11 0.24 -0.72 -4.47 118.33 122.80 1t0g n VAL 40 Ca 0.06 -1.54 0.01 0.00 -2.04 0.00 0.00 64.34 60.82 1t0g n VAL 40 Cb 0.48 0.03 0.33 0.00 -1.47 0.00 0.00 33.84 33.21 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 1.90 1.22 0.00 3.34 2.02 -1.80 -0.68 112.91 118.91 1t0g h THR 41 Ca 0.00 -0.99 -0.04 0.00 0.77 0.00 0.00 66.41 66.16 1t0g h THR 41 Cb 1.18 1.30 -0.01 0.00 -1.74 0.00 0.00 68.15 68.89 1t0g h THR 41 CO 0.14 0.31 -0.17 0.00 0.37 0.00 0.00 175.52 176.16 1t0g h THR 42 N 0.26 0.43 -0.90 3.16 1.03 -1.90 -2.91 112.91 112.08 1t0g h THR 42 Ca 0.05 -1.00 -0.62 0.00 -0.01 0.00 0.00 66.41 64.83 1t0g h THR 42 Cb 0.49 1.73 -0.33 0.00 -1.07 0.00 0.00 68.15 68.97 1t0g h THR 42 CO 0.03 0.17 0.32 0.61 -0.01 0.00 0.00 175.52 176.65 1t0g n GLY 43 N 0.16 5.96 0.38 2.99 0.00 -0.28 -4.74 105.19 109.67 1t0g n GLY 43 Ca 0.00 -2.34 0.16 0.00 0.00 0.00 0.00 46.02 43.84 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 1.99 0.40 -0.84 1.61 3.64 -1.31 -1.02 116.57 121.03 1t0g h LYS 44 Ca 0.52 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.96 1t0g h LYS 44 Cb 1.13 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 32.81 1t0g h LYS 44 CO 1.29 0.27 0.55 0.77 -2.27 0.00 0.00 179.45 180.05 1t0g h SER 45 N 0.41 0.78 0.16 4.20 0.02 -1.88 0.19 113.55 117.43 1t0g h SER 45 Ca 0.37 0.01 -0.36 0.00 -0.84 0.00 0.00 61.79 60.98 1t0g h SER 45 Cb 0.86 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 1t0g h SER 45 CO -0.12 0.49 -1.92 -0.26 -1.14 0.00 0.00 176.83 173.87 1t0g h PHE 46 N 0.88 0.52 0.00 3.45 0.04 -1.59 -3.40 116.94 116.85 1t0g h PHE 46 Ca 0.37 -0.38 -0.05 0.00 2.80 0.00 0.00 57.97 60.71 1t0g h PHE 46 Cb 0.31 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1t0g h PHE 46 CO -0.00 1.73 -0.79 0.66 -0.60 0.00 0.00 178.31 179.30 1t0g n TYR 47 N -3.49 0.74 -1.21 -0.55 4.02 -0.86 -3.06 117.16 112.75 1t0g n TYR 47 Ca -0.29 0.32 -0.14 0.00 -0.01 0.00 0.00 57.90 57.78 1t0g n TYR 47 Cb 1.05 -0.78 0.22 0.00 -0.02 0.00 0.00 39.34 39.82 1t0g n TYR 47 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1t0g n GLY 48 N 1.55 4.31 0.15 2.72 0.00 0.61 -3.93 105.19 110.60 1t0g n GLY 48 Ca -0.14 -1.09 0.05 0.00 0.00 0.00 0.00 46.02 44.84 1t0g n GLY 48 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1t0g n SER 49 N -0.83 1.55 -1.70 1.61 7.64 -0.87 -4.17 113.62 116.85 1t0g n SER 49 Ca 0.48 -2.47 -0.04 0.00 1.01 0.00 0.00 58.87 57.85 1t0g n SER 49 Cb 1.45 -0.26 0.02 0.00 -1.01 0.00 0.00 64.21 64.41 1t0g n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t0g n GLY 50 N -0.82 0.27 0.01 0.23 0.00 -1.26 -5.04 105.19 98.58 1t0g n GLY 50 Ca 0.08 -0.26 -0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.13 2.64 0.19 -0.02 0.00 -1.22 -4.99 105.19 100.66 1t0g n GLY 51 Ca -0.06 -2.16 0.14 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.05 1.61 3.58 -1.88 -2.98 116.42 116.70 1t0g h ASP 52 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1t0g h ASP 52 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1t0g h ASP 52 CO 0.00 0.00 0.00 -1.22 -2.88 0.00 0.00 179.24 175.14 1t0g n TYR 53 N -2.61 0.16 0.24 0.28 4.01 -1.17 -4.73 117.16 113.32 1t0g n TYR 53 Ca 0.02 -0.95 0.12 0.00 -0.16 0.00 0.00 57.90 56.93 1t0g n TYR 53 Cb 0.28 -0.17 0.75 0.00 -0.31 0.00 0.00 39.34 39.88 1t0g n TYR 53 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1t0g h SER 54 N 0.31 0.00 1.44 7.72 0.02 -1.61 -1.09 113.55 120.34 1t0g h SER 54 Ca 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 1t0g h SER 54 Cb 1.04 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 1t0g h SER 54 CO 0.04 0.00 -0.57 0.24 -1.14 0.00 0.00 176.83 175.39 1t0g h MET 55 N 0.00 0.00 0.00 3.45 2.86 -1.86 -3.09 114.93 116.29 1t0g h MET 55 Ca 0.04 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.49 1t0g h MET 55 Cb 0.17 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1t0g h MET 55 CO -0.00 0.33 -1.01 0.74 1.06 0.00 0.00 176.91 178.03 1t0g h PHE 56 N 0.00 0.00 -1.03 -0.22 -1.00 -1.65 -3.39 116.94 109.64 1t0g h PHE 56 Ca -0.03 0.00 0.30 0.00 2.81 0.00 0.00 57.97 61.05 1t0g h PHE 56 Cb 1.31 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.83 1t0g h PHE 56 CO 0.00 0.82 0.78 0.00 -1.61 0.00 0.00 178.31 178.29 1t0g h ALA 57 N 1.18 2.96 0.00 2.45 0.00 -1.14 -3.07 119.26 121.64 1t0g h ALA 57 Ca -0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1t0g h ALA 57 Cb 1.68 0.08 -0.19 0.00 0.00 0.00 0.00 17.79 19.36 1t0g h ALA 57 CO 0.10 -1.31 -0.68 0.41 0.00 0.00 0.00 179.25 177.77 1t0g n GLY 58 N -1.73 0.77 3.22 0.00 0.00 -1.21 -1.73 105.19 104.50 1t0g n GLY 58 Ca 0.22 -0.38 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 0.88 0.06 1.61 2.20 -1.16 -3.08 119.74 120.26 1t0g s LYS 59 Ca 0.15 -1.03 -0.31 0.00 -0.36 0.00 0.00 55.97 54.43 1t0g s LYS 59 Cb 0.18 0.34 -0.07 0.00 -1.51 0.00 0.00 37.83 36.76 1t0g s LYS 59 CO -0.08 -0.28 1.47 0.34 -0.36 0.00 0.00 175.35 176.45 1t0g s ASP 60 N -2.89 6.76 -0.28 1.43 -1.08 -1.26 -3.23 116.67 116.13 1t0g s ASP 60 Ca 0.08 2.30 0.09 0.00 -0.52 0.00 0.00 52.55 54.50 1t0g s ASP 60 Cb 0.05 -2.57 0.46 0.00 -1.46 0.00 0.00 42.92 39.40 1t0g s ASP 60 CO -0.09 -0.75 1.32 0.00 0.52 0.00 0.00 175.17 176.17 1t0g n ALA 61 N 4.93 4.38 0.03 3.66 0.00 0.03 -1.52 120.51 132.02 1t0g n ALA 61 Ca 0.13 -3.42 -0.10 0.00 0.00 0.00 0.00 53.44 50.05 1t0g n ALA 61 Cb 0.42 -0.52 -0.04 0.00 0.00 0.00 0.00 19.45 19.31 1t0g n ALA 61 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1t0g h SER 62 N 1.39 -0.61 0.54 0.00 0.02 -1.68 0.30 113.55 113.51 1t0g h SER 62 Ca 0.20 0.10 -0.14 0.00 -0.84 0.00 0.00 61.79 61.11 1t0g h SER 62 Cb 1.33 0.27 -0.02 0.00 0.14 0.00 0.00 62.40 64.12 1t0g h SER 62 CO 0.41 -0.26 -0.62 -0.09 -1.14 0.00 0.00 176.83 175.12 1t0g h ARG 63 N -0.29 0.08 -0.15 3.45 2.43 -1.27 -3.04 114.38 115.59 1t0g h ARG 63 Ca 0.08 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.07 1t0g h ARG 63 Cb 0.40 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1t0g h ARG 63 CO -0.23 0.67 -0.45 0.00 -1.51 0.00 0.00 179.97 178.45 1t0g h ALA 64 N 1.31 0.96 -0.23 2.80 0.00 -0.78 -0.91 119.26 122.41 1t0g h ALA 64 Ca -0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1t0g h ALA 64 Cb 1.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1t0g h ALA 64 CO 0.09 0.64 0.10 -0.07 0.00 0.00 0.00 179.25 180.00 1t0g h LEU 65 N 0.29 0.31 -1.57 0.00 3.38 -0.43 0.60 115.31 117.89 1t0g h LEU 65 Ca 0.02 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1t0g h LEU 65 Cb 0.91 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1t0g h LEU 65 CO 0.08 0.37 -0.17 1.23 0.09 0.00 0.00 178.44 180.03 1t0g h GLY 66 N 0.23 0.00 0.24 0.83 0.00 -1.23 -2.64 103.07 100.50 1t0g h GLY 66 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1t0g h GLY 66 CO -0.01 0.00 -1.52 0.28 0.00 0.00 0.00 176.54 175.29 1t0g n LYS 67 N -3.53 0.48 -2.85 4.80 4.76 -0.42 -4.62 118.16 116.77 1t0g n LYS 67 Ca -0.01 -0.09 -0.20 0.00 -2.87 0.00 0.00 58.31 55.14 1t0g n LYS 67 Cb 0.32 -1.57 0.03 0.00 -1.84 0.00 0.00 35.03 31.97 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 -2.13 -4.00 -3.49 1.97 2.81 0.19 -4.96 117.12 107.51 1t0g n MET 68 Ca -0.01 0.86 -0.35 0.00 -1.81 0.00 0.00 57.70 56.39 1t0g n MET 68 Cb 0.50 -5.55 -0.06 0.00 -0.71 0.00 0.00 33.22 27.41 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 -2.62 6.72 0.00 7.83 0.15 -0.05 -4.96 113.70 120.77 1t0g s SER 69 Ca 0.23 0.91 0.04 0.00 0.70 0.00 0.00 55.95 57.82 1t0g s SER 69 Cb -0.10 -2.22 -0.01 0.00 -1.71 0.00 0.00 66.02 61.98 1t0g s SER 69 CO 0.28 0.16 0.36 0.29 1.20 0.00 0.00 173.24 175.54 1t0g n LYS 70 N 0.96 3.01 -2.62 5.44 5.02 -1.26 -4.77 118.16 123.94 1t0g n LYS 70 Ca -0.08 -0.33 -0.42 0.00 -2.02 0.00 0.00 58.31 55.46 1t0g n LYS 70 Cb 0.52 -0.85 -0.03 0.00 -0.02 0.00 0.00 35.03 34.66 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 -0.87 7.23 0.61 4.39 4.22 -1.26 -4.84 114.94 124.42 1t0g s ASN 71 Ca 0.03 1.68 0.37 0.00 -2.14 0.00 0.00 52.86 52.80 1t0g s ASN 71 Cb 0.03 -2.56 2.00 0.00 1.28 0.00 0.00 41.25 42.00 1t0g s ASN 71 CO 0.10 -0.41 2.12 -0.33 -2.04 0.00 0.00 177.10 176.54 1t0g h GLU 72 N 7.02 0.00 -0.61 3.55 5.08 -1.92 -1.18 114.58 126.51 1t0g h GLU 72 Ca -0.36 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.99 1t0g h GLU 72 Cb 1.18 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 1t0g h GLU 72 CO 0.82 0.00 0.33 0.93 -1.00 0.00 0.00 179.01 180.09 1t0g h GLU 73 N 0.00 0.85 0.00 2.33 5.08 -1.99 -2.78 114.58 118.07 1t0g h GLU 73 Ca 0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1t0g h GLU 73 Cb 0.19 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1t0g h GLU 73 CO 0.00 0.63 -1.02 -0.25 -1.00 0.00 0.00 179.01 177.37 1t0g n ASP 74 N -4.38 0.68 -4.56 1.42 8.00 -0.45 -4.69 116.55 112.58 1t0g n ASP 74 Ca 0.06 0.12 -0.41 0.00 0.71 0.00 0.00 54.79 55.27 1t0g n ASP 74 Cb 0.10 0.61 -0.03 0.00 -0.02 0.00 0.00 41.12 41.78 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 -3.29 3.70 -0.07 2.53 1.01 -1.05 -2.18 120.40 121.04 1t0g s VAL 75 Ca 0.01 0.49 -0.22 0.00 0.00 0.00 0.00 61.98 62.26 1t0g s VAL 75 Cb 0.12 -4.59 0.05 0.00 0.00 0.00 0.00 36.38 31.96 1t0g s VAL 75 CO 0.79 -1.45 0.51 -0.55 0.00 0.00 0.00 175.10 174.40 1t0g s SER 76 N 4.65 -0.46 0.00 3.32 0.15 -0.58 -4.91 113.70 115.86 1t0g s SER 76 Ca 0.46 0.57 -0.01 0.00 0.70 0.00 0.00 55.95 57.67 1t0g s SER 76 Cb -0.10 0.59 -0.07 0.00 -1.71 0.00 0.00 66.02 64.74 1t0g s SER 76 CO 0.20 -0.45 1.56 -0.81 1.20 0.00 0.00 173.24 174.94 1t0g n PRO 77 N 1.51 0.77 -3.59 5.44 -0.04 -1.24 -2.92 135.00 134.93 1t0g n PRO 77 Ca -0.19 -0.25 -0.05 0.00 -0.04 0.00 0.00 63.50 62.98 1t0g n PRO 77 Cb 0.56 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.52 1t0g n PRO 77 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1t0g s SER 78 N 2.23 -0.22 -0.07 3.54 0.15 -1.26 -4.98 113.70 113.09 1t0g s SER 78 Ca 0.17 -0.08 0.18 0.00 0.70 0.00 0.00 55.95 56.91 1t0g s SER 78 Cb 0.08 0.30 0.62 0.00 -1.71 0.00 0.00 66.02 65.30 1t0g s SER 78 CO 0.00 -0.50 1.53 0.00 1.20 0.00 0.00 173.24 175.47 1t0g n LEU 79 N -0.27 4.19 0.00 3.45 -0.00 -1.26 -1.23 117.00 121.88 1t0g n LEU 79 Ca -0.05 -2.30 0.00 0.00 -0.00 0.00 0.00 56.01 53.65 1t0g n LEU 79 Cb 0.61 -0.49 0.00 0.00 -0.00 0.00 0.00 43.42 43.53 1t0g n LEU 79 CO 0.11 0.83 0.00 1.21 -0.00 0.00 0.00 177.39 179.54 1t0g n GLU 80 N 1.02 0.00 -2.00 1.47 4.07 -1.26 -1.96 120.64 121.98 1t0g n GLU 80 Ca 0.23 0.00 -0.03 0.00 -0.06 0.00 0.00 57.16 57.30 1t0g n GLU 80 Cb 0.75 0.00 0.04 0.00 -0.06 0.00 0.00 31.44 32.16 1t0g n GLU 80 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1t0g n GLY 81 N 0.00 1.38 3.77 8.31 0.00 -1.26 -5.11 105.19 112.28 1t0g n GLY 81 Ca 0.00 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.23 4.37 0.80 0.99 1.43 -0.83 -5.02 118.68 118.19 1t0g s LEU 82 Ca 0.11 2.87 -0.09 0.00 -1.03 0.00 0.00 54.13 55.99 1t0g s LEU 82 Cb 0.27 -3.66 0.12 0.00 0.03 0.00 0.00 46.19 42.96 1t0g s LEU 82 CO -0.08 -0.72 1.13 0.28 0.23 0.00 0.00 176.35 177.20 1t0g s THR 83 N -1.04 2.12 0.25 5.49 -1.32 -1.26 -4.74 115.64 115.15 1t0g s THR 83 Ca 0.52 -0.21 -0.03 0.00 -1.21 0.00 0.00 61.69 60.77 1t0g s THR 83 Cb -0.43 -2.92 0.23 0.00 -1.51 0.00 0.00 72.50 67.87 1t0g s THR 83 CO 0.57 0.00 1.76 -0.08 -2.21 0.00 0.00 174.62 174.66 1t0g h GLU 84 N -0.99 0.58 -0.16 7.08 4.81 -1.98 0.82 114.58 124.75 1t0g h GLU 84 Ca -0.43 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 58.81 1t0g h GLU 84 Cb 1.28 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.47 1t0g h GLU 84 CO 0.50 0.38 -0.22 -0.22 -0.73 0.00 0.00 179.01 178.73 1t0g h LYS 85 N 0.60 -0.25 -0.01 1.92 3.64 -2.00 0.37 116.57 120.82 1t0g h LYS 85 Ca 0.44 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.83 1t0g h LYS 85 Cb 0.59 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1t0g h LYS 85 CO -0.35 -0.17 -0.00 0.93 -2.27 0.00 0.00 179.45 177.59 1t0g h GLU 86 N -0.26 0.02 -0.67 1.90 4.39 -1.62 -3.03 114.58 115.31 1t0g h GLU 86 Ca 0.11 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.86 1t0g h GLU 86 Cb 0.43 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.04 1t0g h GLU 86 CO -0.31 0.34 0.44 0.82 -1.16 0.00 0.00 179.01 179.14 1t0g h ILE 87 N -0.30 1.04 -1.00 3.13 2.04 -0.63 -2.21 117.51 119.58 1t0g h ILE 87 Ca 0.00 -0.25 0.22 0.00 1.00 0.00 0.00 64.86 65.84 1t0g h ILE 87 Cb 0.33 0.26 -0.10 0.00 -0.74 0.00 0.00 36.82 36.56 1t0g h ILE 87 CO 0.00 0.13 0.62 0.78 0.00 0.00 0.00 178.15 179.68 1t0g h ASN 88 N 0.72 0.65 -0.38 1.72 2.35 -0.80 0.16 115.58 120.00 1t0g h ASN 88 Ca 0.28 0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 56.10 1t0g h ASN 88 Cb 0.20 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1t0g h ASN 88 CO -0.09 0.18 0.11 0.74 -1.65 0.00 0.00 177.43 176.72 1t0g h THR 89 N 0.61 1.22 -0.13 2.81 2.02 -1.49 -0.17 112.91 117.77 1t0g h THR 89 Ca 0.59 -0.73 -0.20 0.00 0.77 0.00 0.00 66.41 66.84 1t0g h THR 89 Cb 1.14 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1t0g h THR 89 CO -0.37 0.25 -0.72 0.25 0.37 0.00 0.00 175.52 175.31 1t0g h LEU 90 N 0.47 0.70 -1.03 2.58 5.85 -1.12 -1.27 115.31 121.50 1t0g h LEU 90 Ca 0.12 -0.44 0.04 0.00 0.84 0.00 0.00 57.88 58.43 1t0g h LEU 90 Cb 0.28 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 1t0g h LEU 90 CO -0.00 1.21 0.65 0.78 -0.34 0.00 0.00 178.44 180.74 1t0g h ASN 91 N 0.42 1.09 -0.04 1.25 -0.26 -0.61 0.32 115.58 117.74 1t0g h ASN 91 Ca -0.03 -0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.70 1t0g h ASN 91 Cb 1.31 -0.25 -0.00 0.00 -1.06 0.00 0.00 38.32 38.32 1t0g h ASN 91 CO 0.14 0.75 0.02 -0.78 -1.06 0.00 0.00 177.43 176.49 1t0g h ASP 92 N 1.26 0.05 -0.99 5.81 3.58 -0.72 -3.07 116.42 122.35 1t0g h ASP 92 Ca 0.39 -0.12 0.11 0.00 0.42 0.00 0.00 57.03 57.84 1t0g h ASP 92 Cb -0.01 -0.01 -0.08 0.00 1.72 0.00 0.00 39.33 40.95 1t0g h ASP 92 CO -0.12 0.15 0.63 -0.50 -2.88 0.00 0.00 179.24 176.52 1t0g h TRP 93 N -0.05 1.12 -0.33 0.28 4.06 -0.01 -1.71 115.95 119.30 1t0g h TRP 93 Ca 0.01 0.03 0.07 0.00 2.06 0.00 0.00 58.89 61.07 1t0g h TRP 93 Cb 0.12 -0.36 -0.07 0.00 -1.00 0.00 0.00 29.16 27.85 1t0g h TRP 93 CO -0.04 0.47 -0.16 0.93 -3.56 0.00 0.00 178.44 176.09 1t0g h GLU 94 N 1.00 -0.10 -0.08 0.49 5.08 -0.33 -0.97 114.58 119.67 1t0g h GLU 94 Ca 0.47 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.81 1t0g h GLU 94 Cb 0.43 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1t0g h GLU 94 CO -0.23 -0.07 -0.09 1.15 -1.00 0.00 0.00 179.01 178.77 1t0g h THR 95 N -0.10 1.12 -0.07 1.13 2.02 -1.31 0.53 112.91 116.22 1t0g h THR 95 Ca 0.17 -0.51 -0.18 0.00 0.77 0.00 0.00 66.41 66.66 1t0g h THR 95 Cb 0.36 1.15 0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1t0g h THR 95 CO -0.40 0.16 -0.66 0.11 0.37 0.00 0.00 175.52 175.10 1t0g h LYS 96 N 0.12 0.57 -0.14 6.66 1.79 -0.60 -1.31 116.57 123.66 1t0g h LYS 96 Ca 0.03 -0.52 -0.11 0.00 -2.18 0.00 0.00 60.65 57.87 1t0g h LYS 96 Cb 0.24 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1t0g h LYS 96 CO 0.01 1.14 -0.35 0.74 -1.08 0.00 0.00 179.45 179.92 1t0g h PHE 97 N 0.18 0.61 -0.31 -1.35 -1.00 -0.93 -3.18 116.94 110.97 1t0g h PHE 97 Ca -0.06 -0.24 0.09 0.00 2.81 0.00 0.00 57.97 60.57 1t0g h PHE 97 Cb 1.32 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 40.75 1t0g h PHE 97 CO 0.12 0.97 0.29 0.93 -1.61 0.00 0.00 178.31 179.01 1t0g h GLU 98 N 0.09 0.00 -0.37 1.51 4.39 0.16 0.58 114.58 120.93 1t0g h GLU 98 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1t0g h GLU 98 Cb 0.96 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 1t0g h GLU 98 CO 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.93 1t0g n ALA 99 N -2.41 2.43 0.00 3.43 0.00 -0.51 -4.55 120.51 118.90 1t0g n ALA 99 Ca 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.52 1t0g n ALA 99 Cb 0.45 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.01 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 1.44 0.00 -4.97 0.00 3.00 0.10 -5.06 118.16 112.67 1t0g n LYS 100 Ca 0.19 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.23 1t0g n LYS 100 Cb 0.60 -0.59 -0.16 0.00 0.00 0.00 0.00 35.03 34.88 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 -1.62 1.85 0.18 5.64 2.02 0.18 -5.08 117.35 120.52 1t0g s TYR 101 Ca 0.00 -0.43 -0.27 0.00 -0.37 0.00 0.00 57.07 56.00 1t0g s TYR 101 Cb 0.00 -1.21 -0.08 0.00 -0.40 0.00 0.00 41.96 40.27 1t0g s TYR 101 CO 0.00 -0.10 0.82 -1.25 -1.57 0.00 0.00 175.55 173.46 1t0g s PRO 102 N -0.28 4.64 -0.49 -1.71 0.04 -1.26 -4.24 135.00 131.71 1t0g s PRO 102 Ca 0.03 1.25 -0.28 0.00 0.04 0.00 0.00 61.00 62.03 1t0g s PRO 102 Cb -0.10 -3.27 0.02 0.00 0.04 0.00 0.00 34.50 31.18 1t0g s PRO 102 CO 0.01 0.54 1.36 0.14 0.04 0.00 0.00 177.00 179.08 1t0g s VAL 103 N -1.07 3.92 -2.02 -0.36 -7.23 -1.26 -2.24 120.40 110.14 1t0g s VAL 103 Ca 0.37 0.88 0.17 0.00 -1.81 0.00 0.00 61.98 61.59 1t0g s VAL 103 Cb -0.24 -4.38 0.20 0.00 0.56 0.00 0.00 36.38 32.52 1t0g s VAL 103 CO 0.28 -0.98 1.11 1.33 -0.31 0.00 0.00 175.10 176.53 1t0g n VAL 104 N 6.95 0.19 -3.15 1.32 0.24 0.12 -4.92 118.33 119.08 1t0g n VAL 104 Ca 0.14 -0.59 -0.01 0.00 -2.04 0.00 0.00 64.34 61.83 1t0g n VAL 104 Cb 0.49 1.20 0.00 0.00 -1.47 0.00 0.00 33.84 34.06 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 0.99 1.86 3.13 7.63 0.00 -0.74 -0.74 105.19 117.31 1t0g n GLY 105 Ca 0.12 -1.06 -0.11 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.02 0.71 -0.10 1.61 1.70 0.15 -0.22 118.95 120.78 1t0g s ARG 106 Ca 0.03 -1.15 0.00 0.00 -0.47 0.00 0.00 55.73 54.14 1t0g s ARG 106 Cb -0.01 -0.17 -0.02 0.00 -0.57 0.00 0.00 34.95 34.18 1t0g s ARG 106 CO 0.02 -0.01 -0.10 0.54 -1.08 0.00 0.00 175.30 174.67 1t0g s VAL 107 N -3.00 3.40 -0.07 4.99 0.11 0.17 -0.32 120.40 125.69 1t0g s VAL 107 Ca 0.05 -0.56 0.04 0.00 -2.93 0.00 0.00 61.98 58.58 1t0g s VAL 107 Cb 0.01 -2.41 -0.01 0.00 -1.53 0.00 0.00 36.38 32.44 1t0g s VAL 107 CO -0.04 0.56 -0.21 0.68 -3.33 0.00 0.00 175.10 172.75 1t0g s VAL 108 N -0.23 2.37 0.00 2.04 -7.23 0.22 -4.68 120.40 112.89 1t0g s VAL 108 Ca 0.02 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 1t0g s VAL 108 Cb -0.13 -1.90 0.00 0.00 0.56 0.00 0.00 36.38 34.91 1t0g s VAL 108 CO 0.03 0.56 0.00 -0.24 -0.31 0.00 0.00 175.10 175.14