#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 0.68 2.72 3.03 0.00 -1.26 -4.96 105.19 105.41 1t0g n GLY 2 Ca 0.00 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1t0g n GLY 2 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1t0g n HIS 3 N -2.10 2.80 -3.66 1.61 1.44 -1.26 -4.77 115.22 109.28 1t0g n HIS 3 Ca -0.01 -2.80 -0.08 0.00 -2.01 0.00 0.00 57.72 52.82 1t0g n HIS 3 Cb 0.51 -1.92 -0.08 0.00 0.12 0.00 0.00 29.99 28.61 1t0g n HIS 3 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 1t0g s HIS 4 N -0.08 -0.90 0.16 -1.40 3.76 -1.26 -5.16 115.29 110.40 1t0g s HIS 4 Ca 0.45 1.77 0.07 0.00 -0.15 0.00 0.00 55.06 57.20 1t0g s HIS 4 Cb 0.13 0.48 -0.04 0.00 1.11 0.00 0.00 32.58 34.26 1t0g s HIS 4 CO -0.03 -0.48 -0.01 -1.01 -0.85 0.00 0.00 174.74 172.37 1t0g s HIS 5 N 1.90 2.85 -0.91 1.40 0.09 -1.26 -5.04 115.29 114.31 1t0g s HIS 5 Ca -0.08 -0.13 -0.22 0.00 -0.00 0.00 0.00 55.06 54.63 1t0g s HIS 5 Cb -0.08 -1.39 0.08 0.00 -0.00 0.00 0.00 32.58 31.18 1t0g s HIS 5 CO -0.16 0.51 1.25 -1.01 -0.00 0.00 0.00 174.74 175.33 1t0g s HIS 6 N -1.66 2.74 -0.99 1.40 3.76 -1.26 -4.94 115.29 114.34 1t0g s HIS 6 Ca 0.27 -0.93 -0.23 0.00 -0.15 0.00 0.00 55.06 54.02 1t0g s HIS 6 Cb -0.10 -4.49 0.02 0.00 1.11 0.00 0.00 32.58 29.12 1t0g s HIS 6 CO 0.18 -1.75 1.62 -1.58 -0.85 0.00 0.00 174.74 172.36 1t0g s HIS 7 N 4.10 2.29 0.00 1.40 2.46 -1.26 -2.73 115.29 121.56 1t0g s HIS 7 Ca 0.37 -0.36 0.00 0.00 0.47 0.00 0.00 55.06 55.54 1t0g s HIS 7 Cb -0.05 -4.48 0.00 0.00 -0.13 0.00 0.00 32.58 27.93 1t0g s HIS 7 CO -0.05 -1.86 0.00 1.58 -2.47 0.00 0.00 174.74 171.94 1t0g n HIS 8 N 10.61 0.00 -3.64 3.88 -0.00 -1.26 -5.09 115.22 119.72 1t0g n HIS 8 Ca 0.36 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 58.05 1t0g n HIS 8 Cb 0.49 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.44 1t0g n HIS 8 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 176.34 175.86 1t0g s LEU 9 N 0.00 -0.08 -0.33 0.27 -0.00 -1.10 -5.08 118.68 112.35 1t0g s LEU 9 Ca 0.00 0.10 -0.10 0.00 -0.00 0.00 0.00 54.13 54.13 1t0g s LEU 9 Cb 0.00 1.17 0.01 0.00 -0.00 0.00 0.00 46.19 47.37 1t0g s LEU 9 CO 0.00 -0.06 0.17 -1.61 -0.00 0.00 0.00 176.35 174.85 1t0g s GLU 10 N -0.76 3.13 -0.20 1.48 2.02 0.10 -4.71 118.70 119.76 1t0g s GLU 10 Ca 0.07 -0.86 -0.22 0.00 0.02 0.00 0.00 54.97 53.98 1t0g s GLU 10 Cb -0.02 -3.61 -0.02 0.00 0.10 0.00 0.00 34.13 30.58 1t0g s GLU 10 CO -0.09 -0.52 0.68 -2.00 0.02 0.00 0.00 175.26 173.34 1t0g s GLU 11 N 1.58 4.21 -0.07 1.61 2.12 -1.26 -1.35 118.70 125.55 1t0g s GLU 11 Ca 0.03 0.69 0.05 0.00 0.36 0.00 0.00 54.97 56.11 1t0g s GLU 11 Cb -0.18 -3.59 -0.01 0.00 0.26 0.00 0.00 34.13 30.61 1t0g s GLU 11 CO 0.06 -0.30 -0.22 -0.06 -0.54 0.00 0.00 175.26 174.21 1t0g s PHE 12 N 2.09 2.54 0.28 5.30 0.08 0.18 -4.97 117.98 123.48 1t0g s PHE 12 Ca 0.30 -0.65 -0.03 0.00 0.12 0.00 0.00 56.93 56.67 1t0g s PHE 12 Cb -0.16 -1.64 -0.05 0.00 -0.57 0.00 0.00 43.02 40.60 1t0g s PHE 12 CO 0.10 -0.17 0.52 0.99 -0.10 0.00 0.00 175.22 176.57 1t0g s THR 13 N -0.14 5.07 0.20 0.64 2.01 -1.26 0.95 115.64 123.10 1t0g s THR 13 Ca -0.03 -0.11 -0.11 0.00 0.31 0.00 0.00 61.69 61.74 1t0g s THR 13 Cb -0.14 -3.76 0.13 0.00 0.01 0.00 0.00 72.50 68.75 1t0g s THR 13 CO 0.04 -0.34 1.72 0.00 -0.69 0.00 0.00 174.62 175.34 1t0g h ALA 14 N 1.56 0.64 -0.10 7.40 0.00 -1.48 0.53 119.26 127.82 1t0g h ALA 14 Ca -0.48 0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.38 1t0g h ALA 14 Cb 1.19 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1t0g h ALA 14 CO 0.66 -0.29 -0.61 0.93 0.00 0.00 0.00 179.25 179.94 1t0g h GLU 15 N 0.27 0.36 -0.54 0.00 5.08 -1.95 -2.49 114.58 115.31 1t0g h GLU 15 Ca 0.28 -0.25 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 1t0g h GLU 15 Cb 0.38 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1t0g h GLU 15 CO -0.35 0.86 -0.12 1.96 -1.00 0.00 0.00 179.01 180.36 1t0g h GLN 16 N 0.27 1.03 -0.91 2.33 4.20 -1.71 -2.87 115.11 117.44 1t0g h GLN 16 Ca -0.01 -0.39 0.03 0.00 0.06 0.00 0.00 58.65 58.34 1t0g h GLN 16 Cb 1.14 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.81 1t0g h GLN 16 CO 0.10 1.08 0.60 1.25 -0.67 0.00 0.00 178.83 181.19 1t0g h LEU 17 N 0.90 1.00 -2.71 1.46 7.12 0.22 -0.83 115.31 122.47 1t0g h LEU 17 Ca 0.14 -0.02 -0.00 0.00 0.13 0.00 0.00 57.88 58.13 1t0g h LEU 17 Cb 0.70 -0.24 -0.00 0.00 -0.53 0.00 0.00 40.66 40.59 1t0g h LEU 17 CO 0.05 0.70 -0.01 0.28 -0.13 0.00 0.00 178.44 179.33 1t0g h SER 18 N 1.17 0.00 -0.04 1.25 0.02 -1.16 0.34 113.55 115.13 1t0g h SER 18 Ca 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 1t0g h SER 18 Cb -0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.51 1t0g h SER 18 CO -0.10 0.01 0.00 0.00 -1.14 0.00 0.00 176.83 175.60 1t0g n GLN 19 N -3.28 1.43 -0.75 3.45 6.02 -0.32 -3.49 117.38 120.44 1t0g n GLN 19 Ca -0.03 -0.63 0.01 0.00 -0.01 0.00 0.00 57.00 56.35 1t0g n GLN 19 Cb 0.10 -1.44 0.19 0.00 1.02 0.00 0.00 30.24 30.11 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 -0.21 0.44 1.90 1.08 4.02 0.11 -4.67 117.16 119.83 1t0g n TYR 20 Ca 0.19 -1.59 0.13 0.00 -0.01 0.00 0.00 57.90 56.62 1t0g n TYR 20 Cb 0.25 -0.31 0.73 0.00 -0.02 0.00 0.00 39.34 39.99 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 -1.09 0.26 0.00 7.72 0.23 -1.23 -1.84 115.26 119.31 1t0g n ASN 21 Ca 0.24 -1.24 0.00 0.00 -0.53 0.00 0.00 54.58 53.05 1t0g n ASN 21 Cb 0.78 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.47 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 0.95 1.13 0.25 4.83 0.00 -1.25 -4.31 105.19 106.80 1t0g n GLY 22 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.36 1t0g n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t0g h THR 23 N 0.00 0.02 -1.11 2.61 1.03 -1.84 -3.33 112.91 110.29 1t0g h THR 23 Ca 0.00 -0.78 -0.51 0.00 -0.01 0.00 0.00 66.41 65.11 1t0g h THR 23 Cb 0.00 1.77 -0.08 0.00 -1.07 0.00 0.00 68.15 68.77 1t0g h THR 23 CO 0.00 0.01 1.25 -0.62 -0.01 0.00 0.00 175.52 176.15 1t0g s ASP 24 N -5.96 6.06 0.00 0.00 -1.08 -1.26 -4.53 116.67 109.90 1t0g s ASP 24 Ca 0.04 -1.11 0.00 0.00 -0.52 0.00 0.00 52.55 50.96 1t0g s ASP 24 Cb 0.07 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.96 1t0g s ASP 24 CO 0.61 -1.90 0.00 -0.62 0.52 0.00 0.00 175.17 173.77 1t0g n GLU 25 N 8.92 0.00 -0.12 4.34 -0.58 -1.26 -1.63 120.64 130.31 1t0g n GLU 25 Ca 0.33 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 57.06 1t0g n GLU 25 Cb 0.50 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 31.37 1t0g n GLU 25 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1t0g n SER 26 N 1.95 -0.01 -4.78 1.62 3.41 -1.26 -5.16 113.62 109.40 1t0g n SER 26 Ca 0.00 -0.05 -0.31 0.00 -0.26 0.00 0.00 58.87 58.25 1t0g n SER 26 Cb 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.03 1t0g n SER 26 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1t0g s LYS 27 N 0.00 2.45 0.64 4.33 -2.85 -0.64 -4.99 119.74 118.68 1t0g s LYS 27 Ca 0.00 1.10 -0.17 0.00 -1.00 0.00 0.00 55.97 55.89 1t0g s LYS 27 Cb 0.00 -1.92 -0.05 0.00 -2.06 0.00 0.00 37.83 33.80 1t0g s LYS 27 CO 0.00 -1.49 0.71 -0.35 0.10 0.00 0.00 175.35 174.32 1t0g n PRO 28 N -3.41 0.56 -4.66 1.78 -0.04 -1.26 -4.14 135.00 123.83 1t0g n PRO 28 Ca 0.09 0.23 -0.33 0.00 -0.04 0.00 0.00 63.50 63.44 1t0g n PRO 28 Cb 0.53 -1.94 -0.13 0.00 -0.04 0.00 0.00 33.50 31.93 1t0g n PRO 28 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1t0g s ILE 29 N -1.72 3.43 -0.04 0.52 1.09 -1.25 -3.77 121.20 119.46 1t0g s ILE 29 Ca 0.71 -0.55 0.01 0.00 -1.10 0.00 0.00 60.65 59.72 1t0g s ILE 29 Cb -0.40 -2.43 0.02 0.00 -1.06 0.00 0.00 42.46 38.59 1t0g s ILE 29 CO 0.52 0.55 -0.04 -0.31 -0.10 0.00 0.00 174.94 175.57 1t0g s TYR 30 N -0.14 0.62 0.20 3.97 2.02 -0.77 -1.44 117.35 121.80 1t0g s TYR 30 Ca 0.01 -0.14 0.08 0.00 -0.37 0.00 0.00 57.07 56.64 1t0g s TYR 30 Cb -0.13 -0.57 -0.04 0.00 -0.40 0.00 0.00 41.96 40.82 1t0g s TYR 30 CO 0.03 -0.15 -0.01 0.14 -1.57 0.00 0.00 175.55 173.99 1t0g s VAL 31 N 0.82 3.61 -0.02 0.71 -7.23 -0.86 -3.12 120.40 114.31 1t0g s VAL 31 Ca -0.10 -1.56 0.03 0.00 -1.81 0.00 0.00 61.98 58.54 1t0g s VAL 31 Cb -0.13 -2.84 0.00 0.00 0.56 0.00 0.00 36.38 33.97 1t0g s VAL 31 CO -0.00 -0.17 -0.10 0.00 -0.31 0.00 0.00 175.10 174.52 1t0g s ALA 32 N -1.86 0.91 -0.18 1.32 0.00 -1.05 -0.17 121.76 120.73 1t0g s ALA 32 Ca 0.28 -0.38 -0.02 0.00 0.00 0.00 0.00 51.96 51.84 1t0g s ALA 32 Cb -0.09 -0.31 0.05 0.00 0.00 0.00 0.00 23.12 22.78 1t0g s ALA 32 CO 0.19 0.17 0.00 0.42 0.00 0.00 0.00 175.76 176.53 1t0g s ILE 33 N 0.08 0.78 -0.85 0.00 1.01 0.47 -0.20 121.20 122.49 1t0g s ILE 33 Ca -0.01 -0.60 0.00 0.00 0.00 0.00 0.00 60.65 60.04 1t0g s ILE 33 Cb -0.08 -1.15 0.00 0.00 0.01 0.00 0.00 42.46 41.25 1t0g s ILE 33 CO 0.00 -0.07 0.00 1.17 0.00 0.00 0.00 174.94 176.04 1t0g n LYS 34 N 4.97 -0.89 0.00 2.79 0.00 -1.26 -0.70 118.16 123.07 1t0g n LYS 34 Ca -0.10 0.71 0.00 0.00 0.00 0.00 0.00 58.31 58.93 1t0g n LYS 34 Cb 0.47 -4.65 0.00 0.00 0.00 0.00 0.00 35.03 30.85 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 -1.34 1.16 3.60 3.14 0.00 -1.26 -5.02 105.19 105.47 1t0g n GLY 35 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.71 3.90 -0.17 1.61 0.52 0.13 -0.54 118.95 123.70 1t0g s ARG 36 Ca 0.00 0.39 -0.18 0.00 -0.52 0.00 0.00 55.73 55.42 1t0g s ARG 36 Cb 0.00 -3.74 -0.04 0.00 0.52 0.00 0.00 34.95 31.70 1t0g s ARG 36 CO 0.00 -0.63 0.49 0.08 0.02 0.00 0.00 175.30 175.26 1t0g s VAL 37 N 2.75 5.15 0.01 3.52 1.01 -0.21 -0.40 120.40 132.24 1t0g s VAL 37 Ca 0.28 0.92 0.05 0.00 0.00 0.00 0.00 61.98 63.23 1t0g s VAL 37 Cb -0.15 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 1t0g s VAL 37 CO 0.12 0.24 -0.13 -0.36 0.00 0.00 0.00 175.10 174.98 1t0g s PHE 38 N 1.20 2.71 -0.33 5.22 0.40 0.76 0.00 117.98 127.94 1t0g s PHE 38 Ca 0.24 -0.15 -0.25 0.00 -0.60 0.00 0.00 56.93 56.17 1t0g s PHE 38 Cb -0.15 -1.56 0.01 0.00 0.51 0.00 0.00 43.02 41.83 1t0g s PHE 38 CO 0.10 0.28 0.85 0.34 0.70 0.00 0.00 175.22 177.49 1t0g s ASP 39 N -1.27 6.67 -0.18 1.36 -1.08 -0.58 -2.02 116.67 119.56 1t0g s ASP 39 Ca 0.15 0.62 0.14 0.00 -0.52 0.00 0.00 52.55 52.93 1t0g s ASP 39 Cb -0.11 -2.43 0.38 0.00 -1.46 0.00 0.00 42.92 39.30 1t0g s ASP 39 CO 0.05 -0.72 1.20 1.33 0.52 0.00 0.00 175.17 177.55 1t0g n VAL 40 N 5.73 2.11 0.15 1.11 0.24 -0.52 -4.40 118.33 122.74 1t0g n VAL 40 Ca 0.05 -2.90 0.04 0.00 -2.04 0.00 0.00 64.34 59.49 1t0g n VAL 40 Cb 0.48 -0.24 0.45 0.00 -1.47 0.00 0.00 33.84 33.06 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 0.67 1.14 0.00 3.34 2.02 -1.87 -1.30 112.91 116.91 1t0g h THR 41 Ca 0.00 -0.62 -0.11 0.00 0.77 0.00 0.00 66.41 66.45 1t0g h THR 41 Cb 1.02 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 1t0g h THR 41 CO 0.01 0.19 -0.52 0.71 0.37 0.00 0.00 175.52 176.28 1t0g h THR 42 N 0.16 1.10 -1.13 3.16 1.35 -1.91 -3.12 112.91 112.52 1t0g h THR 42 Ca 0.04 -1.97 -0.67 0.00 -0.55 0.00 0.00 66.41 63.26 1t0g h THR 42 Cb 0.29 2.15 -0.32 0.00 -1.73 0.00 0.00 68.15 68.55 1t0g h THR 42 CO 0.02 0.51 0.56 0.61 -0.25 0.00 0.00 175.52 176.96 1t0g n GLY 43 N 0.50 5.92 0.30 5.82 0.00 -0.50 -4.66 105.19 112.57 1t0g n GLY 43 Ca -0.00 -2.42 0.04 0.00 0.00 0.00 0.00 46.02 43.65 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 2.21 0.47 0.00 1.61 3.64 -1.47 -0.02 116.57 123.01 1t0g h LYS 44 Ca 0.55 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.90 1t0g h LYS 44 Cb 0.81 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1t0g h LYS 44 CO 1.40 0.32 0.00 0.43 -2.27 0.00 0.00 179.45 179.34 1t0g n SER 45 N -4.47 0.00 -0.06 4.20 7.64 -1.26 -0.30 113.62 119.37 1t0g n SER 45 Ca 0.02 0.10 -0.11 0.00 1.01 0.00 0.00 58.87 59.89 1t0g n SER 45 Cb 0.07 -0.22 -0.04 0.00 -1.01 0.00 0.00 64.21 63.01 1t0g n SER 45 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1t0g n PHE 46 N -1.22 0.00 -0.04 1.43 3.72 -0.12 -3.75 117.46 117.49 1t0g n PHE 46 Ca 0.04 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.40 1t0g n PHE 46 Cb 0.04 -0.40 -0.01 0.00 -0.94 0.00 0.00 39.48 38.17 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 -3.34 0.20 1.36 1.38 4.01 -0.63 -2.65 117.16 117.51 1t0g n TYR 47 Ca -0.21 0.09 0.14 0.00 -0.16 0.00 0.00 57.90 57.76 1t0g n TYR 47 Cb 0.67 -0.35 0.64 0.00 -0.31 0.00 0.00 39.34 39.99 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 1.58 -1.11 0.57 2.72 0.00 -0.57 -3.35 105.19 105.02 1t0g n GLY 48 Ca -0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.13 -0.14 0.03 1.61 2.88 0.59 -4.63 113.62 112.82 1t0g n SER 49 Ca 0.13 -1.16 0.11 0.00 -1.33 0.00 0.00 58.87 56.63 1t0g n SER 49 Cb 0.27 0.04 -0.05 0.00 -0.75 0.00 0.00 64.21 63.72 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 0.00 -1.17 4.85 0.46 0.00 -1.05 -4.72 105.19 103.57 1t0g n GLY 50 Ca -0.04 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 1.32 1.14 0.24 -0.02 0.00 -1.25 -4.50 105.19 102.11 1t0g n GLY 51 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.68 1.61 3.58 -1.90 -2.91 116.42 117.00 1t0g h ASP 52 Ca 0.00 -0.47 -0.18 0.00 0.42 0.00 0.00 57.03 56.80 1t0g h ASP 52 Cb 0.00 -0.25 -0.11 0.00 1.72 0.00 0.00 39.33 40.69 1t0g h ASP 52 CO 0.00 1.17 0.22 -1.22 -2.88 0.00 0.00 179.24 176.52 1t0g n TYR 53 N -4.16 2.28 0.24 0.28 4.01 -1.08 -4.53 117.16 114.19 1t0g n TYR 53 Ca -0.03 -1.16 0.07 0.00 -0.16 0.00 0.00 57.90 56.62 1t0g n TYR 53 Cb 0.51 -0.64 0.57 0.00 -0.31 0.00 0.00 39.34 39.47 1t0g n TYR 53 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1t0g h SER 54 N 2.67 0.00 0.56 7.72 4.64 -1.51 -0.56 113.55 127.07 1t0g h SER 54 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1t0g h SER 54 Cb 2.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.32 1t0g h SER 54 CO 0.67 0.12 -0.25 0.23 -0.87 0.00 0.00 176.83 176.73 1t0g n MET 55 N -4.34 0.26 -0.10 4.77 2.81 -1.26 -2.82 117.12 116.43 1t0g n MET 55 Ca -0.03 -0.11 -0.11 0.00 -1.81 0.00 0.00 57.70 55.65 1t0g n MET 55 Cb 0.19 -1.50 -0.16 0.00 -0.71 0.00 0.00 33.22 31.05 1t0g n MET 55 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1t0g n PHE 56 N -1.27 0.03 -0.19 2.03 3.01 -0.39 -4.30 117.46 116.38 1t0g n PHE 56 Ca 0.09 0.01 0.30 0.00 1.01 0.00 0.00 57.45 58.86 1t0g n PHE 56 Cb 0.32 -1.01 0.63 0.00 -0.01 0.00 0.00 39.48 39.42 1t0g n PHE 56 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1t0g h ALA 57 N 0.92 2.83 -0.15 4.37 0.00 -1.00 -1.76 119.26 124.47 1t0g h ALA 57 Ca -0.54 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.11 1t0g h ALA 57 Cb 2.22 0.07 -0.20 0.00 0.00 0.00 0.00 17.79 19.88 1t0g h ALA 57 CO 0.02 -1.43 -0.49 0.41 0.00 0.00 0.00 179.25 177.76 1t0g n GLY 58 N -1.68 1.69 3.17 0.00 0.00 -1.18 -2.38 105.19 104.81 1t0g n GLY 58 Ca 0.21 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.60 0.55 -0.18 1.61 2.47 -0.66 -2.54 119.74 120.40 1t0g s LYS 59 Ca 0.18 -0.23 -0.29 0.00 -1.56 0.00 0.00 55.97 54.07 1t0g s LYS 59 Cb 0.42 0.24 -0.00 0.00 -1.46 0.00 0.00 37.83 37.02 1t0g s LYS 59 CO -0.09 -0.14 1.11 0.34 0.16 0.00 0.00 175.35 176.73 1t0g s ASP 60 N -1.20 7.08 -0.25 1.43 -1.08 -1.26 -2.51 116.67 118.87 1t0g s ASP 60 Ca -0.13 1.53 0.12 0.00 -0.52 0.00 0.00 52.55 53.55 1t0g s ASP 60 Cb -0.06 -2.54 0.52 0.00 -1.46 0.00 0.00 42.92 39.37 1t0g s ASP 60 CO 0.03 -0.65 1.46 0.00 0.52 0.00 0.00 175.17 176.53 1t0g n ALA 61 N 6.08 3.80 0.00 3.66 0.00 0.72 -3.32 120.51 131.45 1t0g n ALA 61 Ca 0.12 -2.80 -0.09 0.00 0.00 0.00 0.00 53.44 50.67 1t0g n ALA 61 Cb 0.46 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.13 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 1.28 -0.44 -0.80 0.00 4.64 -1.71 0.22 113.55 116.73 1t0g h SER 62 Ca 0.15 0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.53 1t0g h SER 62 Cb 1.61 0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 63.87 1t0g h SER 62 CO 0.34 -0.19 0.42 -0.09 -0.87 0.00 0.00 176.83 176.45 1t0g h ARG 63 N -0.18 1.15 -0.15 4.77 2.43 -1.28 -3.01 114.38 118.11 1t0g h ARG 63 Ca 0.09 -0.15 -0.11 0.00 -0.81 0.00 0.00 59.98 59.00 1t0g h ARG 63 Cb 0.31 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1t0g h ARG 63 CO -0.22 0.86 -0.39 0.00 -1.51 0.00 0.00 179.97 178.71 1t0g h ALA 64 N 1.31 1.07 -0.76 2.80 0.00 -1.43 -0.74 119.26 121.50 1t0g h ALA 64 Ca 0.28 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1t0g h ALA 64 Cb 0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1t0g h ALA 64 CO -0.04 0.59 0.26 -0.07 0.00 0.00 0.00 179.25 180.00 1t0g h LEU 65 N 0.27 1.09 0.00 0.00 3.38 -0.50 0.72 115.31 120.26 1t0g h LEU 65 Ca 0.03 -0.19 -0.15 0.00 0.09 0.00 0.00 57.88 57.65 1t0g h LEU 65 Cb 0.81 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1t0g h LEU 65 CO 0.06 0.99 -0.97 1.23 0.09 0.00 0.00 178.44 179.85 1t0g h GLY 66 N 1.14 0.00 1.69 0.83 0.00 -1.28 -3.26 103.07 102.18 1t0g h GLY 66 Ca 0.25 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.32 1t0g h GLY 66 CO -0.01 0.00 -1.21 0.50 0.00 0.00 0.00 176.54 175.82 1t0g h LYS 67 N 0.00 0.17 -2.04 4.80 1.79 -1.05 -3.45 116.57 116.79 1t0g h LYS 67 Ca -0.08 -0.29 -0.19 0.00 -2.18 0.00 0.00 60.65 57.92 1t0g h LYS 67 Cb 1.55 0.11 0.02 0.00 -1.58 0.00 0.00 32.23 32.33 1t0g h LYS 67 CO 0.07 1.11 -0.27 -1.33 -1.08 0.00 0.00 179.45 177.95 1t0g n MET 68 N -3.44 -1.81 -4.81 3.15 2.81 0.24 -5.01 117.12 108.24 1t0g n MET 68 Ca -0.07 0.44 -0.33 0.00 -1.81 0.00 0.00 57.70 55.93 1t0g n MET 68 Cb 1.00 -4.35 -0.14 0.00 -0.71 0.00 0.00 33.22 29.02 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 -2.77 4.06 0.00 7.83 0.01 -0.91 -4.99 113.70 116.93 1t0g s SER 69 Ca 0.10 -0.26 0.15 0.00 1.31 0.00 0.00 55.95 57.24 1t0g s SER 69 Cb -0.04 -1.29 -0.11 0.00 0.21 0.00 0.00 66.02 64.78 1t0g s SER 69 CO 0.12 0.24 0.67 0.29 0.41 0.00 0.00 173.24 174.98 1t0g n LYS 70 N 2.99 2.08 -1.64 12.44 5.02 -1.26 -4.69 118.16 133.10 1t0g n LYS 70 Ca -0.18 -0.22 -0.43 0.00 -2.02 0.00 0.00 58.31 55.46 1t0g n LYS 70 Cb 0.52 -1.20 -0.03 0.00 -0.02 0.00 0.00 35.03 34.30 1t0g n LYS 70 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1t0g n ASN 71 N -1.01 3.83 0.19 4.39 6.94 -1.26 -4.82 115.26 123.52 1t0g n ASN 71 Ca 0.04 0.75 0.17 0.00 -0.02 0.00 0.00 54.58 55.51 1t0g n ASN 71 Cb 0.25 -1.51 0.80 0.00 -2.36 0.00 0.00 39.78 36.96 1t0g n ASN 71 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 1t0g h GLU 72 N 11.45 0.00 -0.45 -3.83 3.07 -1.92 0.19 114.58 123.10 1t0g h GLU 72 Ca -0.47 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.42 1t0g h GLU 72 Cb 1.25 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.13 1t0g h GLU 72 CO 0.95 0.00 0.30 1.49 -1.40 0.00 0.00 179.01 180.34 1t0g h GLU 73 N 0.00 0.48 0.10 2.33 4.57 -1.99 -2.61 114.58 117.46 1t0g h GLU 73 Ca 0.10 -0.03 -0.33 0.00 -1.18 0.00 0.00 59.36 57.92 1t0g h GLU 73 Cb 0.50 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 1t0g h GLU 73 CO -0.00 0.32 -1.79 0.22 -1.18 0.00 0.00 179.01 176.57 1t0g h ASP 74 N 0.49 0.34 -2.90 1.04 1.82 -0.99 -3.47 116.42 112.75 1t0g h ASP 74 Ca 0.18 -0.64 -0.52 0.00 -0.39 0.00 0.00 57.03 55.66 1t0g h ASP 74 Cb 0.11 -0.11 0.06 0.00 0.68 0.00 0.00 39.33 40.07 1t0g h ASP 74 CO -0.04 1.56 0.94 -0.69 -1.61 0.00 0.00 179.24 179.40 1t0g s VAL 75 N -2.58 2.19 -0.12 2.25 1.01 -0.98 -4.65 120.40 117.51 1t0g s VAL 75 Ca -0.14 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 1t0g s VAL 75 Cb 0.07 -3.09 0.08 0.00 0.00 0.00 0.00 36.38 33.44 1t0g s VAL 75 CO 0.81 0.01 0.77 -0.55 0.00 0.00 0.00 175.10 176.14 1t0g s SER 76 N 0.96 -0.61 -0.00 3.32 0.15 -1.21 -4.96 113.70 111.35 1t0g s SER 76 Ca 0.70 0.80 0.00 0.00 0.70 0.00 0.00 55.95 58.15 1t0g s SER 76 Cb -0.48 0.68 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 1t0g s SER 76 CO 0.36 -0.47 1.17 -0.81 1.20 0.00 0.00 173.24 174.69 1t0g n PRO 77 N 1.27 1.00 -3.84 5.44 -0.04 -1.24 -3.13 135.00 134.46 1t0g n PRO 77 Ca -0.16 -0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.20 1t0g n PRO 77 Cb 0.57 -1.00 -0.05 0.00 -0.04 0.00 0.00 33.50 32.98 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 1.17 -0.17 -0.02 3.54 0.15 -1.26 -4.72 113.70 112.39 1t0g s SER 78 Ca 0.00 -0.65 -0.22 0.00 0.70 0.00 0.00 55.95 55.78 1t0g s SER 78 Cb 0.00 0.56 -0.24 0.00 -1.71 0.00 0.00 66.02 64.63 1t0g s SER 78 CO 0.00 -1.06 1.06 -0.07 1.20 0.00 0.00 173.24 174.37 1t0g h LEU 79 N 2.27 0.41 0.00 3.45 3.38 -1.87 -1.91 115.31 121.03 1t0g h LEU 79 Ca -0.28 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 56.91 1t0g h LEU 79 Cb 1.25 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1t0g h LEU 79 CO 0.38 1.14 0.00 1.21 0.09 0.00 0.00 178.44 181.27 1t0g n GLU 80 N -4.32 0.00 -2.61 1.13 4.07 -1.26 -3.73 120.64 113.92 1t0g n GLU 80 Ca -0.10 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.66 1t0g n GLU 80 Cb 0.62 0.00 -0.00 0.00 -0.06 0.00 0.00 31.44 32.00 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 5.85 2.80 8.31 0.00 -1.26 -4.91 105.19 115.99 1t0g n GLY 81 Ca 0.00 -2.66 -0.20 0.00 0.00 0.00 0.00 46.02 43.16 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 -3.90 0.92 0.00 0.99 1.43 -1.24 -4.96 118.68 111.92 1t0g s LEU 82 Ca 0.46 -0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.49 1t0g s LEU 82 Cb 0.29 -0.33 0.14 0.00 0.03 0.00 0.00 46.19 46.32 1t0g s LEU 82 CO -0.19 -0.13 0.97 1.07 0.23 0.00 0.00 176.35 178.30 1t0g n THR 83 N 4.55 0.00 -0.18 5.49 5.66 -1.26 -4.73 114.28 123.80 1t0g n THR 83 Ca -0.18 -1.48 -0.01 0.00 -3.05 0.00 0.00 64.05 59.33 1t0g n THR 83 Cb 0.50 -0.94 0.09 0.00 -1.55 0.00 0.00 70.33 68.44 1t0g n THR 83 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 1t0g h GLU 84 N 0.00 0.25 -0.74 1.09 4.81 -2.01 0.33 114.58 118.31 1t0g h GLU 84 Ca -0.32 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 58.95 1t0g h GLU 84 Cb 1.17 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 1t0g h GLU 84 CO 0.34 0.17 0.49 1.57 -0.73 0.00 0.00 179.01 180.84 1t0g h LYS 85 N 0.26 0.80 0.10 1.92 2.10 -1.99 0.34 116.57 120.11 1t0g h LYS 85 Ca 0.29 -0.05 -0.17 0.00 -2.00 0.00 0.00 60.65 58.72 1t0g h LYS 85 Cb 0.41 -0.18 0.02 0.00 -0.90 0.00 0.00 32.23 31.57 1t0g h LYS 85 CO -0.36 0.53 -0.72 0.93 -2.00 0.00 0.00 179.45 177.82 1t0g h GLU 86 N 0.83 0.31 -0.83 0.07 5.08 -1.46 -3.17 114.58 115.41 1t0g h GLU 86 Ca 0.31 -0.47 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1t0g h GLU 86 Cb 0.18 0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 1t0g h GLU 86 CO -0.10 1.20 0.52 0.82 -1.00 0.00 0.00 179.01 180.44 1t0g h ILE 87 N -0.33 1.23 -0.98 3.13 2.04 0.15 -2.31 117.51 120.43 1t0g h ILE 87 Ca -0.12 -0.47 0.24 0.00 1.00 0.00 0.00 64.86 65.51 1t0g h ILE 87 Cb 1.53 0.04 -0.08 0.00 -0.74 0.00 0.00 36.82 37.57 1t0g h ILE 87 CO 0.14 0.23 0.64 0.78 0.00 0.00 0.00 178.15 179.94 1t0g h ASN 88 N 1.13 0.44 -0.10 1.72 4.21 -0.33 0.98 115.58 123.64 1t0g h ASN 88 Ca 0.30 0.06 -0.02 0.00 1.21 0.00 0.00 56.30 57.85 1t0g h ASN 88 Cb -0.08 -0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 37.11 1t0g h ASN 88 CO -0.06 0.13 -0.02 0.74 -1.29 0.00 0.00 177.43 176.93 1t0g h THR 89 N 0.41 1.29 -0.36 2.81 2.02 -1.39 -1.49 112.91 116.20 1t0g h THR 89 Ca 0.54 -0.93 -0.16 0.00 0.77 0.00 0.00 66.41 66.62 1t0g h THR 89 Cb 1.34 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 69.46 1t0g h THR 89 CO -0.24 0.26 -0.41 0.25 0.37 0.00 0.00 175.52 175.76 1t0g h LEU 90 N -0.14 0.96 -1.10 2.58 5.85 -0.79 -1.59 115.31 121.08 1t0g h LEU 90 Ca 0.02 -0.45 0.11 0.00 0.84 0.00 0.00 57.88 58.40 1t0g h LEU 90 Cb 0.42 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.11 1t0g h LEU 90 CO 0.01 1.24 0.61 -1.13 -0.34 0.00 0.00 178.44 178.83 1t0g h ASN 91 N 0.73 0.87 -0.28 1.25 -0.73 0.88 0.49 115.58 118.78 1t0g h ASN 91 Ca 0.05 0.04 -0.09 0.00 1.87 0.00 0.00 56.30 58.17 1t0g h ASN 91 Cb 1.00 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 39.44 1t0g h ASN 91 CO 0.10 0.49 -0.17 -0.78 -0.37 0.00 0.00 177.43 176.70 1t0g h ASP 92 N 0.95 0.64 -0.38 1.15 3.58 -0.93 -2.96 116.42 118.46 1t0g h ASP 92 Ca 0.46 -0.42 0.05 0.00 0.42 0.00 0.00 57.03 57.54 1t0g h ASP 92 Cb 0.46 -0.18 -0.05 0.00 1.72 0.00 0.00 39.33 41.29 1t0g h ASP 92 CO -0.22 0.92 0.11 -0.50 -2.88 0.00 0.00 179.24 176.67 1t0g h TRP 93 N 0.36 0.18 -0.33 0.28 4.06 0.10 -2.54 115.95 118.06 1t0g h TRP 93 Ca 0.06 0.02 0.07 0.00 2.06 0.00 0.00 58.89 61.10 1t0g h TRP 93 Cb 0.69 -0.03 -0.08 0.00 -1.00 0.00 0.00 29.16 28.75 1t0g h TRP 93 CO 0.06 0.06 -0.23 0.93 -3.56 0.00 0.00 178.44 175.71 1t0g h GLU 94 N 0.25 -0.18 -0.85 0.49 5.08 -0.14 -1.30 114.58 117.92 1t0g h GLU 94 Ca 0.18 0.01 0.23 0.00 -1.00 0.00 0.00 59.36 58.78 1t0g h GLU 94 Cb 0.18 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1t0g h GLU 94 CO -0.20 -0.12 0.60 1.15 -1.00 0.00 0.00 179.01 179.43 1t0g h THR 95 N -0.19 0.61 -0.00 1.13 2.02 -1.29 0.53 112.91 115.72 1t0g h THR 95 Ca 0.17 -0.04 -0.18 0.00 0.77 0.00 0.00 66.41 67.13 1t0g h THR 95 Cb 0.45 0.47 0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1t0g h THR 95 CO -0.44 0.02 -0.68 0.11 0.37 0.00 0.00 175.52 174.90 1t0g h LYS 96 N 0.13 0.47 -0.18 6.66 1.79 -1.00 -2.97 116.57 121.47 1t0g h LYS 96 Ca 0.42 -0.50 -0.12 0.00 -2.18 0.00 0.00 60.65 58.27 1t0g h LYS 96 Cb 1.45 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 32.24 1t0g h LYS 96 CO -0.06 1.15 -0.36 0.74 -1.08 0.00 0.00 179.45 179.83 1t0g h PHE 97 N -0.01 0.71 -0.01 -1.35 -1.00 -0.94 -3.11 116.94 111.23 1t0g h PHE 97 Ca -0.08 -0.26 0.00 0.00 2.81 0.00 0.00 57.97 60.44 1t0g h PHE 97 Cb 1.38 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 40.81 1t0g h PHE 97 CO 0.14 1.00 0.28 0.93 -1.61 0.00 0.00 178.31 179.05 1t0g h GLU 98 N 0.22 0.00 -0.00 1.51 4.39 -0.00 0.10 114.58 120.80 1t0g h GLU 98 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 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 -0.29 0.00 -1.16 0.00 0.00 179.01 177.64 1t0g n ALA 99 N -1.93 2.85 0.00 3.43 0.00 -1.12 -4.82 120.51 118.92 1t0g n ALA 99 Ca -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1t0g n ALA 99 Cb 0.34 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.54 1t0g n ALA 99 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1t0g n LYS 100 N -1.04 0.00 -3.46 0.00 4.01 -0.54 -5.05 118.16 112.08 1t0g n LYS 100 Ca 0.02 0.00 -0.38 0.00 -0.51 0.00 0.00 58.31 57.44 1t0g n LYS 100 Cb 0.11 -0.48 -0.06 0.00 -0.51 0.00 0.00 35.03 34.09 1t0g n LYS 100 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1t0g s TYR 101 N -2.00 3.73 0.07 2.13 2.02 0.24 -5.04 117.35 118.50 1t0g s TYR 101 Ca 0.00 1.04 -0.30 0.00 -0.37 0.00 0.00 57.07 57.44 1t0g s TYR 101 Cb 0.00 -2.32 -0.05 0.00 -0.40 0.00 0.00 41.96 39.19 1t0g s TYR 101 CO 0.00 0.62 1.03 -1.25 -1.57 0.00 0.00 175.55 174.38 1t0g s PRO 102 N -1.17 4.59 -0.61 -1.71 0.04 -1.26 -4.54 135.00 130.34 1t0g s PRO 102 Ca 0.26 1.54 -0.28 0.00 0.04 0.00 0.00 61.00 62.55 1t0g s PRO 102 Cb -0.17 -3.39 0.03 0.00 0.04 0.00 0.00 34.50 31.01 1t0g s PRO 102 CO 0.15 0.01 1.23 0.08 0.04 0.00 0.00 177.00 178.51 1t0g s VAL 103 N 0.52 3.93 -1.10 -0.36 1.01 -1.26 -1.53 120.40 121.61 1t0g s VAL 103 Ca 0.51 0.78 0.25 0.00 0.00 0.00 0.00 61.98 63.52 1t0g s VAL 103 Cb -0.24 -4.75 0.03 0.00 0.00 0.00 0.00 36.38 31.42 1t0g s VAL 103 CO 0.30 -1.44 1.41 1.33 0.00 0.00 0.00 175.10 176.70 1t0g n VAL 104 N 6.62 0.00 0.00 2.92 0.24 0.10 -4.97 118.33 123.24 1t0g n VAL 104 Ca 0.08 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 1t0g n VAL 104 Cb 0.49 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 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 1.48 -0.62 3.28 7.63 0.00 -1.20 0.00 105.19 115.76 1t0g n GLY 105 Ca 0.06 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.23 1.20 -0.10 1.61 3.03 -0.45 -1.04 118.95 121.96 1t0g s ARG 106 Ca 0.00 -1.59 -0.03 0.00 2.03 0.00 0.00 55.73 56.15 1t0g s ARG 106 Cb 0.00 -0.43 -0.03 0.00 -1.03 0.00 0.00 34.95 33.46 1t0g s ARG 106 CO 0.00 -0.10 0.01 0.54 -1.13 0.00 0.00 175.30 174.61 1t0g s VAL 107 N -3.54 4.36 0.04 4.99 0.11 0.30 -0.65 120.40 126.00 1t0g s VAL 107 Ca 0.25 -0.22 0.07 0.00 -2.93 0.00 0.00 61.98 59.15 1t0g s VAL 107 Cb 0.06 -2.86 -0.03 0.00 -1.53 0.00 0.00 36.38 32.02 1t0g s VAL 107 CO 0.06 0.58 -0.19 0.68 -3.33 0.00 0.00 175.10 172.90 1t0g s VAL 108 N -0.62 2.71 0.00 2.04 -7.23 0.27 -4.75 120.40 112.82 1t0g s VAL 108 Ca 0.10 -1.20 0.00 0.00 -1.81 0.00 0.00 61.98 59.08 1t0g s VAL 108 Cb -0.12 -2.12 0.00 0.00 0.56 0.00 0.00 36.38 34.70 1t0g s VAL 108 CO 0.02 0.35 0.00 -0.24 -0.31 0.00 0.00 175.10 174.92