#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 1.51 5.00 -5.12 0.00 -1.26 -4.85 105.19 100.47 1t0g n GLY 2 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 4.61 0.00 -1.58 1.61 8.25 -1.26 -4.89 115.22 121.96 1t0g n HIS 3 Ca 0.00 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.00 1t0g n HIS 3 Cb 0.00 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.06 1t0g n HIS 3 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1t0g n HIS 4 N 0.00 1.98 -3.64 4.41 -0.00 -1.26 -4.92 115.22 111.79 1t0g n HIS 4 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.57 1t0g n HIS 4 Cb 0.00 -2.66 -0.08 0.00 -0.00 0.00 0.00 29.99 27.25 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 6.81 -0.65 -0.12 -1.40 0.00 -1.26 -5.13 115.29 113.53 1t0g s HIS 5 Ca 1.01 1.47 0.02 0.00 -3.00 0.00 0.00 55.06 54.56 1t0g s HIS 5 Cb -0.58 0.26 0.01 0.00 -4.00 0.00 0.00 32.58 28.28 1t0g s HIS 5 CO 0.44 -0.40 -0.18 -1.01 -1.00 0.00 0.00 174.74 172.59 1t0g s HIS 6 N -0.11 2.27 -0.33 0.38 4.02 -1.26 -5.07 115.29 115.19 1t0g s HIS 6 Ca -0.03 -1.12 0.02 0.00 1.02 0.00 0.00 55.06 54.94 1t0g s HIS 6 Cb -0.03 -1.59 0.15 0.00 -1.02 0.00 0.00 32.58 30.08 1t0g s HIS 6 CO 0.03 -0.55 0.36 -1.58 1.02 0.00 0.00 174.74 174.02 1t0g s HIS 7 N 0.97 -0.50 0.00 1.40 2.46 -1.26 -4.83 115.29 113.52 1t0g s HIS 7 Ca -0.06 -0.39 0.00 0.00 0.47 0.00 0.00 55.06 55.08 1t0g s HIS 7 Cb -0.15 -0.37 0.00 0.00 -0.13 0.00 0.00 32.58 31.93 1t0g s HIS 7 CO -0.03 -0.96 0.00 1.58 -2.47 0.00 0.00 174.74 172.86 1t0g n HIS 8 N 4.80 0.00 -0.53 3.88 -0.00 -1.26 -5.11 115.22 117.00 1t0g n HIS 8 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.77 1t0g n HIS 8 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.45 1t0g n HIS 8 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.34 177.81 1t0g n LEU 9 N 0.00 -1.35 -4.20 0.27 -0.00 -1.26 -5.03 117.00 105.43 1t0g n LEU 9 Ca 0.00 1.01 -0.12 0.00 -0.00 0.00 0.00 56.01 56.90 1t0g n LEU 9 Cb 0.00 -0.33 -0.10 0.00 -0.00 0.00 0.00 43.42 42.99 1t0g n LEU 9 CO 0.00 0.12 -0.32 -1.83 -0.00 0.00 0.00 177.39 175.36 1t0g s GLU 10 N -5.21 1.01 -0.04 1.47 -1.05 -1.09 -4.93 118.70 108.86 1t0g s GLU 10 Ca 0.00 -1.48 -0.14 0.00 -0.15 0.00 0.00 54.97 53.20 1t0g s GLU 10 Cb 0.00 -0.03 -0.05 0.00 -0.44 0.00 0.00 34.13 33.60 1t0g s GLU 10 CO 0.00 -0.19 0.36 -2.00 0.95 0.00 0.00 175.26 174.38 1t0g s GLU 11 N -3.97 3.90 0.18 -4.83 2.12 -1.26 0.05 118.70 114.89 1t0g s GLU 11 Ca 0.23 0.30 0.10 0.00 0.36 0.00 0.00 54.97 55.97 1t0g s GLU 11 Cb 0.07 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.17 1t0g s GLU 11 CO 0.03 0.63 -0.22 -0.06 -0.54 0.00 0.00 175.26 175.10 1t0g s PHE 12 N -0.83 2.13 0.14 5.30 0.08 0.31 -4.90 117.98 120.20 1t0g s PHE 12 Ca 0.22 -0.39 0.05 0.00 0.12 0.00 0.00 56.93 56.92 1t0g s PHE 12 Cb -0.16 -1.06 -0.04 0.00 -0.57 0.00 0.00 43.02 41.20 1t0g s PHE 12 CO 0.11 0.44 0.09 0.99 -0.10 0.00 0.00 175.22 176.74 1t0g s THR 13 N -1.78 4.33 0.20 0.64 2.01 -1.26 0.69 115.64 120.47 1t0g s THR 13 Ca 0.19 -1.04 -0.12 0.00 0.31 0.00 0.00 61.69 61.03 1t0g s THR 13 Cb -0.07 -3.16 0.14 0.00 0.01 0.00 0.00 72.50 69.42 1t0g s THR 13 CO 0.09 -0.02 1.70 0.00 -0.69 0.00 0.00 174.62 175.70 1t0g h ALA 14 N 2.79 0.61 -0.04 7.40 0.00 -0.87 0.53 119.26 129.69 1t0g h ALA 14 Ca -0.47 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1t0g h ALA 14 Cb 1.19 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1t0g h ALA 14 CO 0.63 -0.33 -0.39 0.93 0.00 0.00 0.00 179.25 180.09 1t0g h GLU 15 N 0.22 0.08 0.01 0.00 4.39 -1.96 0.34 114.58 117.66 1t0g h GLU 15 Ca 0.28 -0.03 -0.21 0.00 0.34 0.00 0.00 59.36 59.74 1t0g h GLU 15 Cb 0.41 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1t0g h GLU 15 CO -0.39 0.46 -0.92 1.96 -1.16 0.00 0.00 179.01 178.97 1t0g h GLN 16 N 0.07 0.27 0.07 2.33 7.50 -1.56 -3.30 115.11 120.50 1t0g h GLN 16 Ca 0.01 -0.30 -0.24 0.00 0.50 0.00 0.00 58.65 58.62 1t0g h GLN 16 Cb 0.72 0.09 0.02 0.00 0.05 0.00 0.00 27.48 28.36 1t0g h GLN 16 CO 0.05 1.02 -0.97 1.25 -1.50 0.00 0.00 178.83 178.69 1t0g h LEU 17 N 0.15 0.73 0.00 1.46 7.12 0.49 -3.26 115.31 122.00 1t0g h LEU 17 Ca -0.06 -0.81 0.00 0.00 0.13 0.00 0.00 57.88 57.14 1t0g h LEU 17 Cb 1.55 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 41.46 1t0g h LEU 17 CO 0.15 1.46 0.00 -1.20 -0.13 0.00 0.00 178.44 178.72 1t0g n SER 18 N -3.98 0.00 0.02 1.25 7.64 0.11 -0.47 113.62 118.20 1t0g n SER 18 Ca -0.12 0.04 -0.09 0.00 1.01 0.00 0.00 58.87 59.71 1t0g n SER 18 Cb 0.86 -0.17 -0.13 0.00 -1.01 0.00 0.00 64.21 63.75 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 0.02 -4.45 1.43 4.20 -1.65 -3.40 115.11 111.26 1t0g h GLN 19 Ca 0.00 -0.04 -0.73 0.00 0.06 0.00 0.00 58.65 57.94 1t0g h GLN 19 Cb 0.03 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 27.68 1t0g h GLN 19 CO 0.00 0.76 1.84 0.66 -0.67 0.00 0.00 178.83 181.42 1t0g n TYR 20 N -3.21 4.17 0.24 2.96 4.01 0.38 -4.45 117.16 121.26 1t0g n TYR 20 Ca -0.10 -3.07 0.03 0.00 -0.16 0.00 0.00 57.90 54.60 1t0g n TYR 20 Cb 1.01 -2.21 -0.04 0.00 -0.31 0.00 0.00 39.34 37.79 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 5.50 1.05 0.00 7.72 0.23 -1.25 -3.02 115.26 125.49 1t0g n ASN 21 Ca 0.41 -0.50 0.00 0.00 -0.53 0.00 0.00 54.58 53.96 1t0g n ASN 21 Cb 0.41 1.07 0.00 0.00 -2.08 0.00 0.00 39.78 39.18 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 1.38 1.62 0.01 4.83 0.00 -1.24 -4.26 105.19 107.54 1t0g n GLY 22 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 0.07 -3.55 2.61 5.66 -1.22 -3.58 114.28 112.27 1t0g n THR 23 Ca 0.00 -0.04 -0.41 0.00 -3.05 0.00 0.00 64.05 60.54 1t0g n THR 23 Cb 0.00 -0.10 -0.09 0.00 -1.55 0.00 0.00 70.33 68.58 1t0g n THR 23 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1t0g s ASP 24 N -3.21 5.78 -1.86 1.09 2.15 -1.26 -4.54 116.67 114.82 1t0g s ASP 24 Ca 0.12 -1.46 0.00 0.00 0.43 0.00 0.00 52.55 51.64 1t0g s ASP 24 Cb 0.17 -2.04 0.00 0.00 -0.30 0.00 0.00 42.92 40.75 1t0g s ASP 24 CO 0.64 -0.57 0.00 -0.62 -0.17 0.00 0.00 175.17 174.45 1t0g n GLU 25 N 4.99 -1.41 -2.95 4.34 1.02 -1.26 -1.30 120.64 124.08 1t0g n GLU 25 Ca -0.11 1.04 -0.12 0.00 -0.02 0.00 0.00 57.16 57.96 1t0g n GLU 25 Cb 0.43 -5.38 0.06 0.00 -0.02 0.00 0.00 31.44 26.54 1t0g n GLU 25 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1t0g n SER 26 N -1.03 -4.25 -4.74 1.62 2.88 -1.23 -5.02 113.62 101.85 1t0g n SER 26 Ca -0.18 -0.52 -0.33 0.00 -1.33 0.00 0.00 58.87 56.51 1t0g n SER 26 Cb 0.59 -4.11 0.07 0.00 -0.75 0.00 0.00 64.21 60.00 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 -4.44 2.43 0.44 -1.46 1.02 -0.42 -4.96 119.74 112.35 1t0g s LYS 27 Ca 0.22 1.56 -0.23 0.00 0.02 0.00 0.00 55.97 57.54 1t0g s LYS 27 Cb -0.03 -1.89 -0.10 0.00 -0.52 0.00 0.00 37.83 35.29 1t0g s LYS 27 CO 0.57 -1.57 0.96 -2.30 -0.92 0.00 0.00 175.35 172.09 1t0g n PRO 28 N -2.62 1.23 -4.93 -1.68 -0.02 -1.26 -3.60 135.00 122.11 1t0g n PRO 28 Ca 0.12 0.45 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 1t0g n PRO 28 Cb 0.51 -2.01 -0.14 0.00 -0.02 0.00 0.00 33.50 31.84 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 -1.32 2.84 0.06 4.25 1.09 -1.26 -3.81 121.20 123.04 1t0g s ILE 29 Ca 0.65 -0.78 -0.05 0.00 -1.10 0.00 0.00 60.65 59.37 1t0g s ILE 29 Cb -0.54 -2.13 -0.02 0.00 -1.06 0.00 0.00 42.46 38.72 1t0g s ILE 29 CO 0.56 0.56 0.09 -0.31 -0.10 0.00 0.00 174.94 175.74 1t0g s TYR 30 N -0.23 0.28 0.03 3.97 2.02 -1.21 -1.69 117.35 120.53 1t0g s TYR 30 Ca 0.00 -0.70 0.03 0.00 -0.37 0.00 0.00 57.07 56.03 1t0g s TYR 30 Cb -0.13 -0.19 -0.02 0.00 -0.40 0.00 0.00 41.96 41.22 1t0g s TYR 30 CO 0.03 -0.43 -0.09 0.54 -1.57 0.00 0.00 175.55 174.03 1t0g s VAL 31 N -3.41 0.70 -0.11 0.71 0.11 -0.66 0.74 120.40 118.49 1t0g s VAL 31 Ca 0.02 -0.89 0.02 0.00 -2.93 0.00 0.00 61.98 58.20 1t0g s VAL 31 Cb 0.04 -0.69 -0.01 0.00 -1.53 0.00 0.00 36.38 34.19 1t0g s VAL 31 CO -0.08 -0.16 -0.17 0.00 -3.33 0.00 0.00 175.10 171.35 1t0g s ALA 32 N -0.96 2.46 -0.17 1.54 0.00 -0.68 -0.39 121.76 123.56 1t0g s ALA 32 Ca -0.04 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 1t0g s ALA 32 Cb -0.08 -1.04 0.05 0.00 0.00 0.00 0.00 23.12 22.06 1t0g s ALA 32 CO 0.01 0.30 0.00 0.42 0.00 0.00 0.00 175.76 176.49 1t0g s ILE 33 N 0.23 0.72 -1.43 0.00 1.01 -0.51 -0.56 121.20 120.65 1t0g s ILE 33 Ca -0.11 -0.51 -0.06 0.00 0.00 0.00 0.00 60.65 59.97 1t0g s ILE 33 Cb -0.16 -1.07 0.03 0.00 0.01 0.00 0.00 42.46 41.27 1t0g s ILE 33 CO 0.06 -0.04 0.51 0.29 0.00 0.00 0.00 174.94 175.76 1t0g n LYS 34 N 5.00 -4.08 -0.80 2.79 4.76 -1.26 -1.40 118.16 123.17 1t0g n LYS 34 Ca -0.10 0.73 0.00 0.00 -2.87 0.00 0.00 58.31 56.07 1t0g n LYS 34 Cb 0.48 -5.51 0.00 0.00 -1.84 0.00 0.00 35.03 28.15 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 -1.33 0.80 3.65 0.72 0.00 -1.26 -4.97 105.19 102.79 1t0g n GLY 35 Ca -0.08 0.00 -0.40 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 -0.20 4.18 -0.38 1.61 1.81 -0.49 0.14 118.95 125.62 1t0g s ARG 36 Ca 0.00 0.50 -0.14 0.00 -1.72 0.00 0.00 55.73 54.37 1t0g s ARG 36 Cb 0.00 -3.58 0.00 0.00 -0.45 0.00 0.00 34.95 30.92 1t0g s ARG 36 CO 0.00 -0.23 0.29 0.08 -0.68 0.00 0.00 175.30 174.76 1t0g s VAL 37 N 1.89 5.25 -0.05 3.52 1.01 0.10 -1.42 120.40 130.70 1t0g s VAL 37 Ca 0.26 -0.38 -0.04 0.00 0.00 0.00 0.00 61.98 61.82 1t0g s VAL 37 Cb -0.16 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1t0g s VAL 37 CO 0.10 -0.17 0.15 -0.36 0.00 0.00 0.00 175.10 174.82 1t0g s PHE 38 N 1.76 3.52 -0.49 5.22 0.08 0.48 0.18 117.98 128.73 1t0g s PHE 38 Ca 0.07 0.39 -0.29 0.00 0.12 0.00 0.00 56.93 57.22 1t0g s PHE 38 Cb -0.18 -1.85 0.03 0.00 -0.57 0.00 0.00 43.02 40.45 1t0g s PHE 38 CO 0.11 0.66 1.15 0.34 -0.10 0.00 0.00 175.22 177.37 1t0g s ASP 39 N -1.58 6.61 -0.20 1.36 -1.08 0.31 -1.65 116.67 120.44 1t0g s ASP 39 Ca 0.22 0.42 0.16 0.00 -0.52 0.00 0.00 52.55 52.83 1t0g s ASP 39 Cb -0.12 -2.55 0.52 0.00 -1.46 0.00 0.00 42.92 39.30 1t0g s ASP 39 CO 0.13 -1.29 1.42 1.33 0.52 0.00 0.00 175.17 177.28 1t0g n VAL 40 N 6.84 2.32 0.15 1.11 0.24 -0.73 -4.27 118.33 124.00 1t0g n VAL 40 Ca 0.12 -2.03 0.03 0.00 -2.04 0.00 0.00 64.34 60.41 1t0g n VAL 40 Cb 0.49 -0.27 0.12 0.00 -1.47 0.00 0.00 33.84 32.71 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 1.58 0.93 0.00 3.34 2.02 -1.64 -1.82 112.91 117.33 1t0g h THR 41 Ca 0.04 -2.09 -0.02 0.00 0.77 0.00 0.00 66.41 65.11 1t0g h THR 41 Cb 1.48 2.30 -0.00 0.00 -1.74 0.00 0.00 68.15 70.18 1t0g h THR 41 CO 0.25 0.49 -0.10 0.74 0.37 0.00 0.00 175.52 177.28 1t0g h THR 42 N 0.00 0.33 -1.26 3.16 2.02 -1.87 -3.01 112.91 112.29 1t0g h THR 42 Ca -0.01 -0.59 -0.51 0.00 0.77 0.00 0.00 66.41 66.07 1t0g h THR 42 Cb 1.26 1.44 -0.41 0.00 -1.74 0.00 0.00 68.15 68.69 1t0g h THR 42 CO 0.07 0.09 -0.88 0.61 0.37 0.00 0.00 175.52 175.78 1t0g n GLY 43 N -0.35 4.65 0.37 2.16 0.00 -0.73 -4.90 105.19 106.39 1t0g n GLY 43 Ca -0.01 -2.29 0.04 0.00 0.00 0.00 0.00 46.02 43.77 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 2.66 1.02 0.00 1.61 3.64 -1.28 -0.81 116.57 123.41 1t0g h LYS 44 Ca 0.18 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1t0g h LYS 44 Cb 1.06 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 1t0g h LYS 44 CO 0.72 0.68 0.00 0.43 -2.27 0.00 0.00 179.45 179.01 1t0g n SER 45 N -4.50 0.00 -0.04 4.20 7.64 -1.26 0.35 113.62 120.00 1t0g n SER 45 Ca 0.15 0.24 -0.02 0.00 1.01 0.00 0.00 58.87 60.24 1t0g n SER 45 Cb 0.21 -0.34 -0.10 0.00 -1.01 0.00 0.00 64.21 62.97 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 -1.34 0.00 -0.00 1.43 3.72 -0.33 -4.02 117.46 116.92 1t0g n PHE 46 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 1t0g n PHE 46 Cb 0.09 -0.50 -0.00 0.00 -0.94 0.00 0.00 39.48 38.12 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 -2.30 0.00 0.00 1.38 4.02 -0.84 -0.89 117.16 118.53 1t0g n TYR 47 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.75 1t0g n TYR 47 Cb 0.73 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.05 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 2.57 -1.07 0.55 2.72 0.00 0.15 -3.83 105.19 106.29 1t0g n GLY 48 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 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 0.00 1.03 -1.16 1.61 2.88 -1.26 -3.46 113.62 113.27 1t0g n SER 49 Ca 0.00 0.17 0.11 0.00 -1.33 0.00 0.00 58.87 57.81 1t0g n SER 49 Cb 0.00 -0.41 0.28 0.00 -0.75 0.00 0.00 64.21 63.33 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 2.13 1.90 3.80 0.46 0.00 -1.26 -4.94 105.19 107.28 1t0g n GLY 50 Ca -0.28 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.71 1t0g n GLY 50 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1t0g s GLY 51 N -1.11 2.40 0.17 -0.02 0.00 -1.26 -4.94 107.32 102.57 1t0g s GLY 51 Ca 0.42 0.52 0.08 0.00 0.00 0.00 0.00 44.72 45.73 1t0g s GLY 51 CO 0.30 0.83 1.40 -1.80 0.00 0.00 0.00 173.10 173.82 1t0g h ASP 52 N 1.37 0.02 -0.55 1.64 3.58 -1.71 -3.06 116.42 117.70 1t0g h ASP 52 Ca -0.49 -0.02 -0.17 0.00 0.42 0.00 0.00 57.03 56.78 1t0g h ASP 52 Cb 1.21 -0.01 -0.10 0.00 1.72 0.00 0.00 39.33 42.16 1t0g h ASP 52 CO 0.59 0.87 0.21 -1.22 -2.88 0.00 0.00 179.24 176.81 1t0g n TYR 53 N -3.53 1.82 0.29 0.28 4.01 -0.07 -4.34 117.16 115.62 1t0g n TYR 53 Ca -0.01 -0.94 0.18 0.00 -0.16 0.00 0.00 57.90 56.97 1t0g n TYR 53 Cb 0.82 -0.56 0.92 0.00 -0.31 0.00 0.00 39.34 40.21 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 1.92 0.00 1.07 7.72 0.87 -1.59 -0.42 113.55 123.12 1t0g h SER 54 Ca 0.20 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.62 1t0g h SER 54 Cb 1.92 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.86 1t0g h SER 54 CO 0.55 0.00 -0.67 0.24 -0.53 0.00 0.00 176.83 176.42 1t0g h MET 55 N 0.00 0.00 -0.09 2.24 2.86 -1.82 -3.12 114.93 115.01 1t0g h MET 55 Ca 0.00 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.42 1t0g h MET 55 Cb 0.12 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.79 1t0g h MET 55 CO 0.00 0.67 -0.83 0.74 1.06 0.00 0.00 176.91 178.55 1t0g h PHE 56 N 0.00 0.86 -1.50 -0.22 -1.00 -1.35 -3.41 116.94 110.32 1t0g h PHE 56 Ca -0.01 -0.40 -0.69 0.00 2.81 0.00 0.00 57.97 59.68 1t0g h PHE 56 Cb 1.39 -0.12 0.01 0.00 3.61 0.00 0.00 35.95 40.83 1t0g h PHE 56 CO 0.00 1.22 1.10 0.00 -1.61 0.00 0.00 178.31 179.02 1t0g n ALA 57 N -2.58 0.42 -2.23 2.45 0.00 -1.12 -1.30 120.51 116.14 1t0g n ALA 57 Ca -0.07 0.24 -0.16 0.00 0.00 0.00 0.00 53.44 53.44 1t0g n ALA 57 Cb 0.77 -2.38 -0.01 0.00 0.00 0.00 0.00 19.45 17.83 1t0g n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t0g n GLY 58 N 4.96 -0.12 3.16 0.00 0.00 0.23 -4.60 105.19 108.82 1t0g n GLY 58 Ca 0.30 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.03 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 -4.68 0.70 -0.15 1.61 2.20 -0.42 -3.29 119.74 115.71 1t0g s LYS 59 Ca 0.00 -0.82 -0.26 0.00 -0.36 0.00 0.00 55.97 54.53 1t0g s LYS 59 Cb 0.00 0.28 -0.01 0.00 -1.51 0.00 0.00 37.83 36.59 1t0g s LYS 59 CO 0.00 -0.20 0.87 0.34 -0.36 0.00 0.00 175.35 176.00 1t0g s ASP 60 N -2.41 7.03 -0.21 1.43 -1.08 -1.25 -1.68 116.67 118.49 1t0g s ASP 60 Ca -0.01 1.26 0.15 0.00 -0.52 0.00 0.00 52.55 53.43 1t0g s ASP 60 Cb 0.02 -2.48 0.52 0.00 -1.46 0.00 0.00 42.92 39.52 1t0g s ASP 60 CO -0.07 -0.40 1.44 0.00 0.52 0.00 0.00 175.17 176.66 1t0g n ALA 61 N 5.10 3.35 -0.36 3.66 0.00 0.27 -2.68 120.51 129.84 1t0g n ALA 61 Ca 0.05 -2.53 0.07 0.00 0.00 0.00 0.00 53.44 51.03 1t0g n ALA 61 Cb 0.49 -0.73 0.24 0.00 0.00 0.00 0.00 19.45 19.45 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 1.55 0.93 -0.51 0.00 0.02 -1.70 -0.35 113.55 113.49 1t0g h SER 62 Ca 0.07 0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 60.95 1t0g h SER 62 Cb 1.52 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.90 1t0g h SER 62 CO 0.28 0.50 -0.14 -0.09 -1.14 0.00 0.00 176.83 176.24 1t0g h ARG 63 N 1.00 1.01 -0.14 3.45 2.43 -0.55 -3.09 114.38 118.49 1t0g h ARG 63 Ca 0.50 -0.38 -0.14 0.00 -0.81 0.00 0.00 59.98 59.14 1t0g h ARG 63 Cb 0.48 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 1t0g h ARG 63 CO -0.26 1.07 -0.52 0.00 -1.51 0.00 0.00 179.97 178.74 1t0g h ALA 64 N 0.94 0.84 -0.21 2.80 0.00 -0.21 0.01 119.26 123.43 1t0g h ALA 64 Ca 0.13 -0.49 0.01 0.00 0.00 0.00 0.00 54.91 54.56 1t0g h ALA 64 Cb 0.70 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1t0g h ALA 64 CO 0.05 0.68 0.11 -0.07 0.00 0.00 0.00 179.25 180.02 1t0g h LEU 65 N 0.31 0.17 -0.75 0.00 3.38 -1.40 0.13 115.31 117.16 1t0g h LEU 65 Ca 0.01 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1t0g h LEU 65 Cb 1.02 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1t0g h LEU 65 CO 0.09 0.13 -0.57 1.23 0.09 0.00 0.00 178.44 179.41 1t0g h GLY 66 N 0.23 0.17 1.70 0.83 0.00 -1.21 -2.87 103.07 101.93 1t0g h GLY 66 Ca 0.08 -0.21 -0.20 0.00 0.00 0.00 0.00 47.33 47.00 1t0g h GLY 66 CO -0.05 0.19 -0.88 0.50 0.00 0.00 0.00 176.54 176.30 1t0g h LYS 67 N 0.12 0.27 -3.93 4.80 1.79 -0.82 -3.44 116.57 115.36 1t0g h LYS 67 Ca -0.00 -0.29 -0.01 0.00 -2.18 0.00 0.00 60.65 58.17 1t0g h LYS 67 Cb 1.05 0.08 0.01 0.00 -1.58 0.00 0.00 32.23 31.79 1t0g h LYS 67 CO 0.08 0.99 -0.04 -1.33 -1.08 0.00 0.00 179.45 178.08 1t0g n MET 68 N -3.70 -0.56 -1.98 3.15 2.81 0.37 -5.07 117.12 112.14 1t0g n MET 68 Ca -0.05 0.83 -0.03 0.00 -1.81 0.00 0.00 57.70 56.64 1t0g n MET 68 Cb 0.80 -3.17 0.00 0.00 -0.71 0.00 0.00 33.22 30.15 1t0g n MET 68 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1t0g n SER 69 N -1.40 -0.62 0.00 7.83 7.64 -0.72 -5.05 113.62 121.30 1t0g n SER 69 Ca -0.00 -1.52 0.00 0.00 1.01 0.00 0.00 58.87 58.36 1t0g n SER 69 Cb 0.51 1.06 0.00 0.00 -1.01 0.00 0.00 64.21 64.77 1t0g n SER 69 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1t0g n LYS 70 N -0.17 0.01 -1.90 1.43 2.85 -1.26 -4.46 118.16 114.67 1t0g n LYS 70 Ca -0.02 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.86 1t0g n LYS 70 Cb 0.18 -0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.59 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 0.00 5.47 0.32 -5.58 6.03 -1.26 -4.62 114.94 115.31 1t0g s ASN 71 Ca 0.00 2.64 0.19 0.00 -1.03 0.00 0.00 52.86 54.66 1t0g s ASN 71 Cb 0.00 -2.63 1.02 0.00 -3.03 0.00 0.00 41.25 36.61 1t0g s ASN 71 CO 0.00 -1.42 1.54 -0.62 -2.03 0.00 0.00 177.10 174.56 1t0g n GLU 72 N -0.93 0.12 0.07 3.55 1.02 -1.26 -1.02 120.64 122.20 1t0g n GLU 72 Ca 0.10 0.61 -0.00 0.00 -0.02 0.00 0.00 57.16 57.85 1t0g n GLU 72 Cb 0.46 -2.01 0.29 0.00 -0.02 0.00 0.00 31.44 30.16 1t0g n GLU 72 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1t0g h GLU 73 N 0.00 0.33 -0.08 3.49 4.57 -2.00 -2.84 114.58 118.05 1t0g h GLU 73 Ca 0.00 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 1t0g h GLU 73 Cb 0.21 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1t0g h GLU 73 CO 0.00 0.54 0.00 -0.40 -1.18 0.00 0.00 179.01 177.97 1t0g n ASP 74 N -4.17 1.99 -4.50 1.04 5.68 -0.19 -4.90 116.55 111.49 1t0g n ASP 74 Ca -0.01 -1.72 -0.43 0.00 -0.50 0.00 0.00 54.79 52.14 1t0g n ASP 74 Cb 0.35 -0.05 -0.04 0.00 -1.14 0.00 0.00 41.12 40.24 1t0g n ASP 74 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1t0g s VAL 75 N -0.77 4.24 -0.09 2.12 1.01 -1.00 -1.72 120.40 124.19 1t0g s VAL 75 Ca 0.07 0.02 -0.17 0.00 0.00 0.00 0.00 61.98 61.90 1t0g s VAL 75 Cb 0.04 -4.67 0.04 0.00 0.00 0.00 0.00 36.38 31.78 1t0g s VAL 75 CO 0.05 -1.40 0.41 -0.55 0.00 0.00 0.00 175.10 173.62 1t0g s SER 76 N 3.38 -0.37 0.35 3.32 0.15 -1.09 -4.86 113.70 114.57 1t0g s SER 76 Ca 0.28 0.52 0.23 0.00 0.70 0.00 0.00 55.95 57.68 1t0g s SER 76 Cb -0.14 0.60 0.21 0.00 -1.71 0.00 0.00 66.02 64.98 1t0g s SER 76 CO 0.15 -0.33 1.39 1.55 1.20 0.00 0.00 173.24 177.19 1t0g h PRO 77 N 4.47 0.00 -0.48 5.44 0.13 -1.94 0.32 132.00 139.95 1t0g h PRO 77 Ca -0.28 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 1t0g h PRO 77 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1t0g h PRO 77 CO 0.32 0.01 0.21 1.03 -0.23 0.00 0.00 178.00 179.34 1t0g h SER 78 N 0.00 0.65 -2.24 1.44 0.87 -1.97 -3.46 113.55 108.84 1t0g h SER 78 Ca -0.00 -0.15 -0.21 0.00 -1.23 0.00 0.00 61.79 60.19 1t0g h SER 78 Cb 1.01 -0.17 0.02 0.00 -0.44 0.00 0.00 62.40 62.82 1t0g h SER 78 CO 0.00 0.63 -0.30 0.18 -0.53 0.00 0.00 176.83 176.81 1t0g n LEU 79 N -4.59 -1.94 0.09 2.23 4.77 -1.26 -4.96 117.00 111.34 1t0g n LEU 79 Ca 0.01 -0.11 -0.07 0.00 -0.03 0.00 0.00 56.01 55.82 1t0g n LEU 79 Cb 0.14 -1.78 -0.04 0.00 -2.33 0.00 0.00 43.42 39.42 1t0g n LEU 79 CO 0.37 0.05 0.51 1.05 -1.33 0.00 0.00 177.39 178.04 1t0g h GLU 80 N -0.51 -0.33 -2.32 3.23 9.09 -1.94 -3.33 114.58 118.47 1t0g h GLU 80 Ca -0.27 0.02 -0.64 0.00 0.05 0.00 0.00 59.36 58.52 1t0g h GLU 80 Cb 1.19 0.08 -0.39 0.00 -1.65 0.00 0.00 28.75 27.98 1t0g h GLU 80 CO 0.30 -0.22 -0.29 0.41 0.05 0.00 0.00 179.01 179.25 1t0g n GLY 81 N -1.20 5.22 2.79 1.06 0.00 -1.26 -4.98 105.19 106.81 1t0g n GLY 81 Ca -0.04 -2.75 -0.19 0.00 0.00 0.00 0.00 46.02 43.03 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 -2.98 0.86 0.99 0.99 1.43 -1.25 -5.09 118.68 113.63 1t0g s LEU 82 Ca 0.41 -0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 53.32 1t0g s LEU 82 Cb 0.18 -0.28 0.20 0.00 0.03 0.00 0.00 46.19 46.32 1t0g s LEU 82 CO -0.04 -0.15 1.27 0.42 0.23 0.00 0.00 176.35 178.08 1t0g s THR 83 N 1.45 1.92 0.45 5.49 -4.23 -1.26 -4.71 115.64 114.75 1t0g s THR 83 Ca -0.04 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.61 1t0g s THR 83 Cb -0.13 -2.89 0.18 0.00 1.34 0.00 0.00 72.50 71.00 1t0g s THR 83 CO -0.03 0.00 1.99 -0.33 -0.54 0.00 0.00 174.62 175.72 1t0g h GLU 84 N -1.77 0.01 -0.03 3.99 5.08 -2.01 0.15 114.58 120.01 1t0g h GLU 84 Ca -0.45 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.94 1t0g h GLU 84 Cb 1.26 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.46 1t0g h GLU 84 CO 0.40 0.19 -0.22 -0.22 -1.00 0.00 0.00 179.01 178.16 1t0g h LYS 85 N 0.01 -0.32 0.17 2.33 3.64 -1.98 0.52 116.57 120.94 1t0g h LYS 85 Ca 0.00 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1t0g h LYS 85 Cb 0.31 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1t0g h LYS 85 CO 0.02 -0.21 -0.08 0.93 -2.27 0.00 0.00 179.45 177.84 1t0g h GLU 86 N -0.33 -0.22 -0.24 1.90 4.39 -1.63 -2.46 114.58 115.99 1t0g h GLU 86 Ca 0.07 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1t0g h GLU 86 Cb 0.43 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 1t0g h GLU 86 CO -0.22 0.01 0.16 0.82 -1.16 0.00 0.00 179.01 178.61 1t0g h ILE 87 N -0.42 1.06 -0.44 3.13 1.08 -0.61 -2.54 117.51 118.78 1t0g h ILE 87 Ca -0.02 -0.11 0.06 0.00 -0.39 0.00 0.00 64.86 64.40 1t0g h ILE 87 Cb 0.33 0.71 -0.02 0.00 -3.07 0.00 0.00 36.82 34.76 1t0g h ILE 87 CO 0.04 0.06 0.30 0.78 -0.69 0.00 0.00 178.15 178.63 1t0g h ASN 88 N 0.32 0.28 -0.65 1.72 2.35 0.10 0.22 115.58 119.92 1t0g h ASN 88 Ca 0.09 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.80 1t0g h ASN 88 Cb -0.03 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1t0g h ASN 88 CO -0.02 0.18 0.26 0.74 -1.65 0.00 0.00 177.43 176.94 1t0g h THR 89 N 0.32 1.24 -0.07 2.81 2.02 -1.00 -2.32 112.91 115.92 1t0g h THR 89 Ca 0.19 -0.75 -0.18 0.00 0.77 0.00 0.00 66.41 66.45 1t0g h THR 89 Cb 0.36 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1t0g h THR 89 CO -0.04 0.29 -0.72 0.17 0.37 0.00 0.00 175.52 175.59 1t0g h LEU 90 N 0.92 0.42 -1.54 2.58 8.10 -0.91 -2.15 115.31 122.73 1t0g h LEU 90 Ca 0.22 -0.27 0.12 0.00 0.11 0.00 0.00 57.88 58.06 1t0g h LEU 90 Cb 0.21 -0.12 -0.05 0.00 -0.44 0.00 0.00 40.66 40.26 1t0g h LEU 90 CO -0.02 1.01 0.48 0.78 -4.11 0.00 0.00 178.44 176.58 1t0g h ASN 91 N 0.24 0.45 -0.06 0.17 2.35 -0.98 0.64 115.58 118.40 1t0g h ASN 91 Ca -0.03 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1t0g h ASN 91 Cb 1.29 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.59 1t0g h ASN 91 CO 0.12 0.25 -0.05 -0.78 -1.65 0.00 0.00 177.43 175.32 1t0g h ASP 92 N 0.49 0.14 -0.61 5.81 3.58 -0.85 -3.18 116.42 121.81 1t0g h ASP 92 Ca 0.35 -0.48 0.09 0.00 0.42 0.00 0.00 57.03 57.41 1t0g h ASP 92 Cb 0.67 -0.04 -0.07 0.00 1.72 0.00 0.00 39.33 41.61 1t0g h ASP 92 CO -0.11 0.59 0.23 -0.50 -2.88 0.00 0.00 179.24 176.57 1t0g h TRP 93 N -0.31 0.41 0.03 0.28 4.06 -0.54 -2.30 115.95 117.57 1t0g h TRP 93 Ca 0.01 0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.01 1t0g h TRP 93 Cb 0.55 -0.09 -0.03 0.00 -1.00 0.00 0.00 29.16 28.59 1t0g h TRP 93 CO 0.09 0.11 -0.18 1.49 -3.56 0.00 0.00 178.44 176.39 1t0g h GLU 94 N 0.42 -0.29 -0.19 0.49 4.81 0.14 -1.53 114.58 118.43 1t0g h GLU 94 Ca 0.31 0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.61 1t0g h GLU 94 Cb 0.37 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1t0g h GLU 94 CO -0.30 -0.19 0.16 1.15 -0.73 0.00 0.00 179.01 179.09 1t0g h THR 95 N -0.30 0.75 0.02 0.32 2.02 -1.41 0.34 112.91 114.65 1t0g h THR 95 Ca 0.05 0.00 -0.26 0.00 0.77 0.00 0.00 66.41 66.97 1t0g h THR 95 Cb 0.36 0.89 0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1t0g h THR 95 CO -0.15 0.00 -1.02 0.11 0.37 0.00 0.00 175.52 174.83 1t0g h LYS 96 N 0.00 0.66 -0.39 6.66 1.79 -0.78 -2.16 116.57 122.35 1t0g h LYS 96 Ca 0.09 -0.73 -0.14 0.00 -2.18 0.00 0.00 60.65 57.69 1t0g h LYS 96 Cb 0.40 0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 31.26 1t0g h LYS 96 CO -0.00 1.31 -0.29 0.74 -1.08 0.00 0.00 179.45 180.13 1t0g h PHE 97 N 0.31 1.04 -0.40 -1.35 -1.00 -0.55 -2.34 116.94 112.66 1t0g h PHE 97 Ca -0.13 -0.29 0.12 0.00 2.81 0.00 0.00 57.97 60.47 1t0g h PHE 97 Cb 1.68 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 41.00 1t0g h PHE 97 CO 0.11 1.09 0.33 0.93 -1.61 0.00 0.00 178.31 179.16 1t0g h GLU 98 N 0.69 0.00 0.00 1.51 4.39 -0.23 0.28 114.58 121.21 1t0g h GLU 98 Ca 0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1t0g h GLU 98 Cb 0.88 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 1t0g h GLU 98 CO 0.08 0.00 -0.90 0.00 -1.16 0.00 0.00 179.01 177.03 1t0g n ALA 99 N -2.53 3.24 -0.09 3.43 0.00 -0.82 -4.61 120.51 119.13 1t0g n ALA 99 Ca 0.07 -0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.06 1t0g n ALA 99 Cb 0.51 -0.44 -0.10 0.00 0.00 0.00 0.00 19.45 19.43 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 -1.50 0.78 -4.41 0.00 4.01 -0.89 -4.95 118.16 111.20 1t0g n LYS 100 Ca 0.01 0.08 -0.33 0.00 -0.51 0.00 0.00 58.31 57.56 1t0g n LYS 100 Cb 0.24 -1.38 -0.10 0.00 -0.51 0.00 0.00 35.03 33.28 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 -2.37 2.97 -0.11 2.13 2.02 0.94 -5.07 117.35 117.86 1t0g s TYR 101 Ca -0.20 0.02 -0.30 0.00 -0.37 0.00 0.00 57.07 56.22 1t0g s TYR 101 Cb 0.06 -1.65 -0.02 0.00 -0.40 0.00 0.00 41.96 39.95 1t0g s TYR 101 CO 0.48 0.40 1.17 -1.25 -1.57 0.00 0.00 175.55 174.79 1t0g s PRO 102 N -1.38 4.32 -0.85 -1.71 0.04 -1.26 -4.41 135.00 129.76 1t0g s PRO 102 Ca 0.17 1.60 -0.25 0.00 0.04 0.00 0.00 61.00 62.56 1t0g s PRO 102 Cb -0.11 -3.61 0.03 0.00 0.04 0.00 0.00 34.50 30.84 1t0g s PRO 102 CO 0.08 -0.51 1.46 0.54 0.04 0.00 0.00 177.00 178.60 1t0g s VAL 103 N 2.59 3.74 -2.64 -0.36 0.11 -1.26 -0.53 120.40 122.04 1t0g s VAL 103 Ca 0.53 -0.12 0.25 0.00 -2.93 0.00 0.00 61.98 59.71 1t0g s VAL 103 Cb -0.22 -4.80 0.39 0.00 -1.53 0.00 0.00 36.38 30.22 1t0g s VAL 103 CO 0.18 -1.72 1.50 1.33 -3.33 0.00 0.00 175.10 173.06 1t0g n VAL 104 N 6.78 0.09 -3.77 2.04 0.24 0.13 -4.77 118.33 119.07 1t0g n VAL 104 Ca 0.19 -0.41 -0.03 0.00 -2.04 0.00 0.00 64.34 62.06 1t0g n VAL 104 Cb 0.50 0.89 0.02 0.00 -1.47 0.00 0.00 33.84 33.78 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 1.27 0.81 2.94 7.63 0.00 -0.52 -2.69 105.19 114.63 1t0g n GLY 105 Ca 0.17 -1.10 -0.23 0.00 0.00 0.00 0.00 46.02 44.86 1t0g n GLY 105 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1t0g s ARG 106 N -2.04 1.28 -0.16 1.61 6.06 0.11 0.03 118.95 125.83 1t0g s ARG 106 Ca 0.17 -0.24 -0.05 0.00 -2.50 0.00 0.00 55.73 53.10 1t0g s ARG 106 Cb -0.02 -1.18 -0.03 0.00 0.06 0.00 0.00 34.95 33.77 1t0g s ARG 106 CO 0.04 -0.07 0.01 0.54 -2.50 0.00 0.00 175.30 173.32 1t0g s VAL 107 N 0.97 4.32 0.01 7.11 0.11 0.12 0.11 120.40 133.15 1t0g s VAL 107 Ca -0.10 -0.21 0.04 0.00 -2.93 0.00 0.00 61.98 58.78 1t0g s VAL 107 Cb -0.15 -2.91 -0.03 0.00 -1.53 0.00 0.00 36.38 31.76 1t0g s VAL 107 CO 0.00 0.49 -0.08 0.68 -3.33 0.00 0.00 175.10 172.87 1t0g s VAL 108 N 0.23 3.57 0.00 2.04 -7.23 0.22 -4.52 120.40 114.71 1t0g s VAL 108 Ca 0.01 -0.82 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 1t0g s VAL 108 Cb -0.13 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.26 1t0g s VAL 108 CO 0.02 0.38 0.05 -0.24 -0.31 0.00 0.00 175.10 175.00