#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 -0.18 0.18 3.03 0.00 -1.26 -4.73 105.19 102.23 1t0g n GLY 2 Ca 0.00 -1.56 0.12 0.00 0.00 0.00 0.00 46.02 44.58 1t0g n GLY 2 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1t0g h HIS 3 N 0.00 0.00 -3.83 1.61 -0.00 -2.01 -3.49 115.15 107.43 1t0g h HIS 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1t0g h HIS 3 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.38 1t0g h HIS 3 CO 0.00 0.00 -0.52 0.72 -0.00 0.00 0.00 177.93 178.13 1t0g n HIS 4 N -2.80 -1.71 -3.13 5.26 -0.00 -1.26 -4.65 115.22 106.93 1t0g n HIS 4 Ca 0.04 0.88 -0.45 0.00 -0.00 0.00 0.00 57.72 58.19 1t0g n HIS 4 Cb 0.50 -2.50 -0.03 0.00 -0.00 0.00 0.00 29.99 27.96 1t0g n HIS 4 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 1t0g s HIS 5 N -0.48 3.35 -0.34 4.41 2.46 -1.26 -5.01 115.29 118.42 1t0g s HIS 5 Ca -0.05 -1.53 -0.23 0.00 0.47 0.00 0.00 55.06 53.71 1t0g s HIS 5 Cb 0.00 -4.04 0.00 0.00 -0.13 0.00 0.00 32.58 28.42 1t0g s HIS 5 CO 0.32 -1.25 0.78 -3.38 -2.47 0.00 0.00 174.74 168.74 1t0g s HIS 6 N 1.69 3.15 -0.01 3.88 -0.00 -1.26 -5.02 115.29 117.72 1t0g s HIS 6 Ca 0.22 0.66 -0.30 0.00 -0.00 0.00 0.00 55.06 55.64 1t0g s HIS 6 Cb -0.11 -3.31 -0.05 0.00 -0.00 0.00 0.00 32.58 29.11 1t0g s HIS 6 CO -0.06 -0.65 1.27 -3.38 -0.00 0.00 0.00 174.74 171.92 1t0g s HIS 7 N 3.02 3.13 0.00 0.38 -3.43 -1.26 -4.22 115.29 112.91 1t0g s HIS 7 Ca 0.31 1.10 0.00 0.00 -0.80 0.00 0.00 55.06 55.67 1t0g s HIS 7 Cb -0.14 -3.51 0.00 0.00 -1.43 0.00 0.00 32.58 27.51 1t0g s HIS 7 CO 0.15 -1.70 0.00 0.72 -2.00 0.00 0.00 174.74 171.91 1t0g n HIS 8 N 4.99 0.00 -3.77 0.38 -0.00 -1.26 -4.62 115.22 110.95 1t0g n HIS 8 Ca 0.11 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.80 1t0g n HIS 8 Cb 0.45 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.46 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 0.00 -3.90 2.41 -0.00 -1.26 -4.99 117.00 109.26 1t0g n LEU 9 Ca 0.00 -1.27 -0.15 0.00 -0.00 0.00 0.00 56.01 54.59 1t0g n LEU 9 Cb 0.00 2.31 -0.15 0.00 -0.00 0.00 0.00 43.42 45.58 1t0g n LEU 9 CO 0.00 -0.42 -0.39 -0.70 -0.00 0.00 0.00 177.39 175.88 1t0g s GLU 10 N -2.04 0.32 -0.13 1.47 2.12 -1.02 -4.89 118.70 114.52 1t0g s GLU 10 Ca 0.17 -0.08 -0.24 0.00 0.36 0.00 0.00 54.97 55.18 1t0g s GLU 10 Cb -0.02 -0.35 -0.03 0.00 0.26 0.00 0.00 34.13 33.99 1t0g s GLU 10 CO 0.05 0.03 0.75 -2.00 -0.54 0.00 0.00 175.26 173.54 1t0g s GLU 11 N 0.19 4.34 -0.04 4.30 2.12 -1.26 -2.06 118.70 126.29 1t0g s GLU 11 Ca -0.02 0.90 0.05 0.00 0.36 0.00 0.00 54.97 56.26 1t0g s GLU 11 Cb -0.05 -3.52 -0.02 0.00 0.26 0.00 0.00 34.13 30.80 1t0g s GLU 11 CO -0.00 -0.15 -0.18 -0.06 -0.54 0.00 0.00 175.26 174.32 1t0g s PHE 12 N 1.55 2.59 0.17 5.30 0.08 0.65 -4.95 117.98 123.36 1t0g s PHE 12 Ca 0.37 -0.29 -0.04 0.00 0.12 0.00 0.00 56.93 57.09 1t0g s PHE 12 Cb -0.17 -1.60 -0.05 0.00 -0.57 0.00 0.00 43.02 40.63 1t0g s PHE 12 CO 0.15 0.09 0.40 0.99 -0.10 0.00 0.00 175.22 176.74 1t0g s THR 13 N -0.62 5.16 0.23 0.64 2.01 -1.26 0.98 115.64 122.78 1t0g s THR 13 Ca 0.09 -0.03 -0.06 0.00 0.31 0.00 0.00 61.69 62.00 1t0g s THR 13 Cb -0.11 -3.65 0.20 0.00 0.01 0.00 0.00 72.50 68.95 1t0g s THR 13 CO 0.00 -0.03 1.73 0.00 -0.69 0.00 0.00 174.62 175.63 1t0g h ALA 14 N 2.57 0.97 -0.18 7.40 0.00 -0.80 0.49 119.26 129.71 1t0g h ALA 14 Ca -0.46 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 1t0g h ALA 14 Cb 1.17 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1t0g h ALA 14 CO 0.71 -0.22 -0.38 0.93 0.00 0.00 0.00 179.25 180.30 1t0g h GLU 15 N 0.41 0.39 0.02 0.00 5.08 -1.92 -2.90 114.58 115.66 1t0g h GLU 15 Ca 0.38 -0.18 -0.22 0.00 -1.00 0.00 0.00 59.36 58.34 1t0g h GLU 15 Cb 0.56 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1t0g h GLU 15 CO -0.39 0.71 -0.95 1.96 -1.00 0.00 0.00 179.01 179.34 1t0g h GLN 16 N 0.33 0.30 -0.20 2.33 7.50 -1.50 -3.23 115.11 120.64 1t0g h GLN 16 Ca 0.03 -0.34 -0.01 0.00 0.50 0.00 0.00 58.65 58.83 1t0g h GLN 16 Cb 0.81 0.10 -0.01 0.00 0.05 0.00 0.00 27.48 28.44 1t0g h GLN 16 CO 0.07 1.06 0.07 1.25 -1.50 0.00 0.00 178.83 179.77 1t0g h LEU 17 N 0.16 0.25 -2.90 1.46 7.12 0.09 -2.21 115.31 119.27 1t0g h LEU 17 Ca -0.07 -0.02 -0.00 0.00 0.13 0.00 0.00 57.88 57.92 1t0g h LEU 17 Cb 1.60 -0.06 -0.00 0.00 -0.53 0.00 0.00 40.66 41.67 1t0g h LEU 17 CO 0.16 0.24 -0.00 0.28 -0.13 0.00 0.00 178.44 178.99 1t0g h SER 18 N 0.28 0.00 0.49 1.25 0.02 -1.11 0.02 113.55 114.51 1t0g h SER 18 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1t0g h SER 18 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1t0g h SER 18 CO -0.01 0.00 -0.03 0.00 -1.14 0.00 0.00 176.83 175.66 1t0g n GLN 19 N -3.08 0.51 -0.73 3.45 3.00 -0.83 -3.00 117.38 116.69 1t0g n GLN 19 Ca -0.03 -0.05 0.02 0.00 -0.01 0.00 0.00 57.00 56.93 1t0g n GLN 19 Cb 0.08 -1.50 0.28 0.00 0.00 0.00 0.00 30.24 29.11 1t0g n GLN 19 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1t0g n TYR 20 N -1.20 1.57 0.30 1.08 4.02 -0.01 -4.55 117.16 118.37 1t0g n TYR 20 Ca 0.15 -1.08 0.16 0.00 -0.01 0.00 0.00 57.90 57.12 1t0g n TYR 20 Cb 0.24 -0.48 0.65 0.00 -0.02 0.00 0.00 39.34 39.73 1t0g n TYR 20 CO 0.00 0.00 0.00 -2.95 -1.01 0.00 0.00 176.86 172.90 1t0g h ASN 21 N 2.20 0.00 0.00 7.72 7.08 -1.50 -3.03 115.58 128.05 1t0g h ASN 21 Ca 0.12 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.34 1t0g h ASN 21 Cb 1.82 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.06 1t0g h ASN 21 CO 0.44 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 176.40 1t0g n GLY 22 N 0.06 0.82 0.59 9.14 0.00 -1.26 -3.71 105.19 110.82 1t0g n GLY 22 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1t0g n GLY 22 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1t0g n THR 23 N -0.86 0.14 -1.03 2.61 -1.04 -1.26 -4.78 114.28 108.07 1t0g n THR 23 Ca 0.00 -0.35 -0.24 0.00 -2.04 0.00 0.00 64.05 61.43 1t0g n THR 23 Cb 0.00 0.52 0.19 0.00 -1.82 0.00 0.00 70.33 69.23 1t0g n THR 23 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1t0g n ASP 24 N 0.41 -1.65 -3.78 8.00 -0.08 -1.26 -4.90 116.55 113.27 1t0g n ASP 24 Ca 0.17 -1.07 -0.38 0.00 -1.51 0.00 0.00 54.79 52.01 1t0g n ASP 24 Cb 0.37 -0.80 -0.02 0.00 2.34 0.00 0.00 41.12 43.02 1t0g n ASP 24 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1t0g n GLU 25 N -4.05 3.92 -1.15 -0.67 1.02 -1.26 -4.64 120.64 113.81 1t0g n GLU 25 Ca 0.12 -4.61 0.00 0.00 -0.02 0.00 0.00 57.16 52.65 1t0g n GLU 25 Cb 0.47 -2.43 0.00 0.00 -0.02 0.00 0.00 31.44 29.46 1t0g n GLU 25 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1t0g n SER 26 N 1.07 -1.54 -3.98 1.62 7.64 -1.26 -5.13 113.62 112.04 1t0g n SER 26 Ca 0.28 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 60.07 1t0g n SER 26 Cb 0.35 -0.77 -0.11 0.00 -1.01 0.00 0.00 64.21 62.68 1t0g n SER 26 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1t0g s LYS 27 N -0.65 0.34 0.57 1.43 1.02 -1.26 -4.87 119.74 116.32 1t0g s LYS 27 Ca 0.00 -0.63 -0.20 0.00 0.02 0.00 0.00 55.97 55.16 1t0g s LYS 27 Cb 0.00 0.12 -0.04 0.00 -0.52 0.00 0.00 37.83 37.39 1t0g s LYS 27 CO 0.00 -0.06 1.28 -1.25 -0.92 0.00 0.00 175.35 174.40 1t0g s PRO 28 N -1.59 3.04 -0.17 -1.68 0.04 -1.26 -4.69 135.00 128.70 1t0g s PRO 28 Ca -0.15 2.04 -0.09 0.00 0.04 0.00 0.00 61.00 62.84 1t0g s PRO 28 Cb -0.09 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 1t0g s PRO 28 CO -0.01 -1.21 0.14 0.42 0.04 0.00 0.00 177.00 176.38 1t0g s ILE 29 N -1.42 5.44 -0.06 0.56 1.09 -1.25 -4.63 121.20 120.92 1t0g s ILE 29 Ca 0.75 0.21 0.02 0.00 -1.10 0.00 0.00 60.65 60.53 1t0g s ILE 29 Cb -0.36 -3.45 0.01 0.00 -1.06 0.00 0.00 42.46 37.60 1t0g s ILE 29 CO 0.41 0.50 -0.12 -0.31 -0.10 0.00 0.00 174.94 175.32 1t0g s TYR 30 N -0.15 1.44 -0.05 3.97 2.02 -1.14 -1.52 117.35 121.93 1t0g s TYR 30 Ca 0.11 -0.51 0.06 0.00 -0.37 0.00 0.00 57.07 56.36 1t0g s TYR 30 Cb -0.11 -1.05 -0.02 0.00 -0.40 0.00 0.00 41.96 40.38 1t0g s TYR 30 CO 0.00 -0.25 -0.22 0.08 -1.57 0.00 0.00 175.55 173.59 1t0g s VAL 31 N 0.57 2.37 -0.10 0.71 1.01 -1.04 -3.20 120.40 120.73 1t0g s VAL 31 Ca -0.13 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 60.92 1t0g s VAL 31 Cb -0.15 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.36 1t0g s VAL 31 CO 0.03 0.58 -0.22 0.00 0.00 0.00 0.00 175.10 175.49 1t0g s ALA 32 N -0.43 2.03 -0.11 5.51 0.00 -0.95 -0.58 121.76 127.24 1t0g s ALA 32 Ca 0.04 -0.89 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 1t0g s ALA 32 Cb -0.12 -0.78 0.02 0.00 0.00 0.00 0.00 23.12 22.24 1t0g s ALA 32 CO 0.01 0.24 -0.07 0.42 0.00 0.00 0.00 175.76 176.36 1t0g s ILE 33 N 0.43 1.01 -1.61 0.00 1.01 -0.91 -1.27 121.20 119.85 1t0g s ILE 33 Ca -0.17 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.20 1t0g s ILE 33 Cb -0.17 -1.03 0.00 0.00 0.01 0.00 0.00 42.46 41.27 1t0g s ILE 33 CO 0.07 0.36 0.00 0.29 0.00 0.00 0.00 174.94 175.67 1t0g n LYS 34 N 4.93 -1.22 -0.17 2.79 5.02 -1.26 -1.55 118.16 126.70 1t0g n LYS 34 Ca -0.12 0.97 0.00 0.00 -2.02 0.00 0.00 58.31 57.13 1t0g n LYS 34 Cb 0.50 -5.25 0.00 0.00 -0.02 0.00 0.00 35.03 30.26 1t0g n LYS 34 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1t0g n GLY 35 N -0.98 1.69 3.59 0.72 0.00 -1.26 -5.00 105.19 103.95 1t0g n GLY 35 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.34 3.68 -0.27 1.61 0.52 -0.59 -0.98 118.95 122.58 1t0g s ARG 36 Ca 0.00 0.41 -0.25 0.00 -0.52 0.00 0.00 55.73 55.37 1t0g s ARG 36 Cb 0.00 -3.89 -0.00 0.00 0.52 0.00 0.00 34.95 31.58 1t0g s ARG 36 CO 0.00 -1.21 0.85 0.08 0.02 0.00 0.00 175.30 175.04 1t0g s VAL 37 N 3.93 4.79 0.03 3.52 1.01 -0.59 -2.14 120.40 130.95 1t0g s VAL 37 Ca 0.41 1.50 0.01 0.00 0.00 0.00 0.00 61.98 63.91 1t0g s VAL 37 Cb -0.10 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 1t0g s VAL 37 CO 0.26 -0.16 0.06 -0.36 0.00 0.00 0.00 175.10 174.91 1t0g s PHE 38 N 2.96 3.20 -0.54 5.22 0.08 0.25 -0.07 117.98 129.08 1t0g s PHE 38 Ca 0.35 0.13 -0.24 0.00 0.12 0.00 0.00 56.93 57.29 1t0g s PHE 38 Cb -0.15 -1.67 0.04 0.00 -0.57 0.00 0.00 43.02 40.67 1t0g s PHE 38 CO 0.09 0.52 0.93 0.34 -0.10 0.00 0.00 175.22 177.00 1t0g s ASP 39 N -1.96 6.36 -0.17 1.36 2.15 -0.14 -2.48 116.67 121.79 1t0g s ASP 39 Ca 0.25 -0.29 0.16 0.00 0.43 0.00 0.00 52.55 53.10 1t0g s ASP 39 Cb -0.12 -2.43 0.74 0.00 -0.30 0.00 0.00 42.92 40.80 1t0g s ASP 39 CO 0.16 -1.19 1.65 1.33 -0.17 0.00 0.00 175.17 176.96 1t0g n VAL 40 N 6.22 2.25 0.24 1.11 0.24 -0.58 -4.37 118.33 123.44 1t0g n VAL 40 Ca 0.02 -1.35 0.08 0.00 -2.04 0.00 0.00 64.34 61.05 1t0g n VAL 40 Cb 0.48 -0.07 0.59 0.00 -1.47 0.00 0.00 33.84 33.37 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 3.78 0.96 0.00 3.34 2.02 -1.87 0.08 112.91 121.22 1t0g h THR 41 Ca 0.00 -0.49 -0.03 0.00 0.77 0.00 0.00 66.41 66.66 1t0g h THR 41 Cb 1.66 1.27 -0.00 0.00 -1.74 0.00 0.00 68.15 69.34 1t0g h THR 41 CO 0.33 0.13 -0.15 0.00 0.37 0.00 0.00 175.52 176.21 1t0g h THR 42 N 0.00 0.74 -1.10 3.16 1.03 -1.92 -2.33 112.91 112.48 1t0g h THR 42 Ca -0.00 -0.59 -0.59 0.00 -0.01 0.00 0.00 66.41 65.22 1t0g h THR 42 Cb 0.26 1.35 -0.40 0.00 -1.07 0.00 0.00 68.15 68.29 1t0g h THR 42 CO 0.02 0.14 -0.52 0.61 -0.01 0.00 0.00 175.52 175.76 1t0g n GLY 43 N -0.77 6.18 0.38 2.99 0.00 -0.01 -4.80 105.19 109.16 1t0g n GLY 43 Ca -0.02 -2.66 0.14 0.00 0.00 0.00 0.00 46.02 43.49 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 2.35 0.50 0.00 1.61 3.64 -1.12 -0.23 116.57 123.32 1t0g h LYS 44 Ca 0.38 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1t0g h LYS 44 Cb 1.18 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1t0g h LYS 44 CO 0.91 0.33 -0.01 0.77 -2.27 0.00 0.00 179.45 179.18 1t0g h SER 45 N 0.52 0.00 0.07 4.20 0.02 -1.87 0.74 113.55 117.23 1t0g h SER 45 Ca 0.41 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 61.20 1t0g h SER 45 Cb 0.83 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1t0g h SER 45 CO -0.15 0.01 -0.78 -0.26 -1.14 0.00 0.00 176.83 174.51 1t0g h PHE 46 N 0.00 0.26 0.00 3.45 -1.00 -1.41 -3.40 116.94 114.85 1t0g h PHE 46 Ca -0.00 -0.19 0.00 0.00 2.81 0.00 0.00 57.97 60.59 1t0g h PHE 46 Cb 0.01 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1t0g h PHE 46 CO 0.00 1.30 -0.09 0.66 -1.61 0.00 0.00 178.31 178.57 1t0g n TYR 47 N -4.27 0.03 0.83 -0.55 4.01 -1.01 -3.30 117.16 112.90 1t0g n TYR 47 Ca -0.18 0.01 -0.00 0.00 -0.16 0.00 0.00 57.90 57.57 1t0g n TYR 47 Cb 0.71 -0.13 0.03 0.00 -0.31 0.00 0.00 39.34 39.64 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 1.57 1.79 0.05 2.72 0.00 0.18 -3.05 105.19 108.44 1t0g n GLY 48 Ca -0.01 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 45.97 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 0.14 1.99 0.00 1.61 7.64 -0.74 -4.45 113.62 119.81 1t0g n SER 49 Ca 0.03 -2.42 0.00 0.00 1.01 0.00 0.00 58.87 57.49 1t0g n SER 49 Cb 0.41 -0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 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 -0.86 0.46 1.78 0.23 0.00 -1.17 -5.02 105.19 100.61 1t0g n GLY 50 Ca 0.07 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.88 -1.74 0.34 -0.02 0.00 -1.21 -4.83 105.19 95.85 1t0g n GLY 51 Ca 0.00 -1.62 0.09 0.00 0.00 0.00 0.00 46.02 44.49 1t0g n GLY 51 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1t0g h ASP 52 N -1.17 0.49 -0.59 1.61 5.19 -1.91 -1.09 116.42 118.95 1t0g h ASP 52 Ca -0.20 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.15 1t0g h ASP 52 Cb 0.58 -0.10 -0.04 0.00 0.18 0.00 0.00 39.33 39.95 1t0g h ASP 52 CO 0.14 0.31 0.08 -1.22 -3.12 0.00 0.00 179.24 175.43 1t0g n TYR 53 N -4.48 2.07 0.30 4.55 4.01 -1.24 -4.42 117.16 117.96 1t0g n TYR 53 Ca 0.09 -0.90 0.17 0.00 -0.16 0.00 0.00 57.90 57.11 1t0g n TYR 53 Cb 0.26 -0.55 0.77 0.00 -0.31 0.00 0.00 39.34 39.52 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 3.36 0.00 1.54 7.72 0.87 -1.30 -1.27 113.55 124.46 1t0g h SER 54 Ca 0.08 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.55 1t0g h SER 54 Cb 2.04 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.98 1t0g h SER 54 CO 0.54 0.00 -0.46 0.24 -0.53 0.00 0.00 176.83 176.62 1t0g h MET 55 N 0.00 0.00 -0.00 2.24 2.86 -1.82 -3.08 114.93 115.13 1t0g h MET 55 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1t0g h MET 55 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1t0g h MET 55 CO 0.00 0.39 -0.49 1.19 1.06 0.00 0.00 176.91 179.06 1t0g n PHE 56 N -3.18 0.00 1.57 -0.22 3.01 -0.52 -4.21 117.46 113.90 1t0g n PHE 56 Ca 0.02 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.61 1t0g n PHE 56 Cb 0.70 -0.19 0.77 0.00 -0.01 0.00 0.00 39.48 40.75 1t0g n PHE 56 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1t0g n ALA 57 N -1.27 2.46 -2.12 4.37 0.00 -0.94 -3.48 120.51 119.53 1t0g n ALA 57 Ca 0.07 -0.16 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 1t0g n ALA 57 Cb 0.34 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.32 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 0.81 0.70 3.39 0.00 0.00 -1.19 -3.22 105.19 105.68 1t0g n GLY 58 Ca 0.18 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1t0g n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t0g s LYS 59 N 0.00 1.36 -0.59 1.61 1.02 -1.23 -1.49 119.74 120.42 1t0g s LYS 59 Ca 0.08 -1.41 -0.24 0.00 0.02 0.00 0.00 55.97 54.42 1t0g s LYS 59 Cb 0.09 0.37 0.05 0.00 -0.52 0.00 0.00 37.83 37.83 1t0g s LYS 59 CO -0.04 -0.51 0.96 0.34 -0.92 0.00 0.00 175.35 175.18 1t0g s ASP 60 N -3.08 6.27 -0.31 2.83 -1.08 -1.26 -2.23 116.67 117.82 1t0g s ASP 60 Ca 0.29 -0.58 0.11 0.00 -0.52 0.00 0.00 52.55 51.85 1t0g s ASP 60 Cb 0.03 -2.43 0.72 0.00 -1.46 0.00 0.00 42.92 39.78 1t0g s ASP 60 CO 0.09 -1.32 1.76 0.00 0.52 0.00 0.00 175.17 176.22 1t0g n ALA 61 N 7.61 4.42 -0.31 3.66 0.00 -0.40 -2.23 120.51 133.26 1t0g n ALA 61 Ca -0.00 -2.39 -0.02 0.00 0.00 0.00 0.00 53.44 51.02 1t0g n ALA 61 Cb 0.47 -1.17 0.10 0.00 0.00 0.00 0.00 19.45 18.85 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 2.53 0.92 0.59 0.00 0.02 -1.66 0.36 113.55 116.31 1t0g h SER 62 Ca 0.24 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 61.03 1t0g h SER 62 Cb 2.22 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 64.53 1t0g h SER 62 CO 0.67 0.64 -0.65 -0.09 -1.14 0.00 0.00 176.83 176.27 1t0g h ARG 63 N 1.08 0.05 -0.10 3.45 2.43 -0.78 -2.91 114.38 117.60 1t0g h ARG 63 Ca 0.33 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.33 1t0g h ARG 63 Cb -0.03 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1t0g h ARG 63 CO -0.10 0.68 -0.52 0.00 -1.51 0.00 0.00 179.97 178.52 1t0g h ALA 64 N 1.31 0.93 -0.30 2.80 0.00 -1.30 0.05 119.26 122.75 1t0g h ALA 64 Ca -0.01 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1t0g h ALA 64 Cb 1.15 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1t0g h ALA 64 CO 0.09 0.67 0.06 -0.07 0.00 0.00 0.00 179.25 180.00 1t0g h LEU 65 N 0.22 0.40 0.03 0.00 3.38 -0.78 0.65 115.31 119.20 1t0g h LEU 65 Ca 0.01 -0.05 -0.28 0.00 0.09 0.00 0.00 57.88 57.65 1t0g h LEU 65 Cb 0.99 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 1t0g h LEU 65 CO 0.08 0.42 -1.54 1.23 0.09 0.00 0.00 178.44 178.72 1t0g h GLY 66 N 0.68 0.07 1.19 0.83 0.00 -1.07 -3.23 103.07 101.53 1t0g h GLY 66 Ca 0.10 -0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.15 1t0g h GLY 66 CO -0.00 0.15 -1.11 0.50 0.00 0.00 0.00 176.54 176.08 1t0g h LYS 67 N 0.02 0.00 -4.61 4.80 1.79 -0.93 -3.43 116.57 114.20 1t0g h LYS 67 Ca -0.23 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 57.96 1t0g h LYS 67 Cb 1.96 0.00 0.11 0.00 -1.58 0.00 0.00 32.23 32.72 1t0g h LYS 67 CO 0.10 0.23 -0.52 -1.33 -1.08 0.00 0.00 179.45 176.86 1t0g n MET 68 N -2.89 -5.71 -3.27 3.15 2.81 0.22 -5.03 117.12 106.40 1t0g n MET 68 Ca -0.05 0.62 -0.23 0.00 -1.81 0.00 0.00 57.70 56.23 1t0g n MET 68 Cb 0.74 -5.00 -0.00 0.00 -0.71 0.00 0.00 33.22 28.24 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 -3.40 6.07 0.00 7.83 0.15 -1.04 -5.02 113.70 118.30 1t0g s SER 69 Ca 0.35 0.28 0.00 0.00 0.70 0.00 0.00 55.95 57.28 1t0g s SER 69 Cb -0.15 -1.72 0.00 0.00 -1.71 0.00 0.00 66.02 62.44 1t0g s SER 69 CO 0.54 -0.46 0.01 0.29 1.20 0.00 0.00 173.24 174.82 1t0g n LYS 70 N -1.86 3.55 -2.58 5.44 5.02 -1.26 -4.85 118.16 121.62 1t0g n LYS 70 Ca -0.02 -0.01 -0.39 0.00 -2.02 0.00 0.00 58.31 55.86 1t0g n LYS 70 Cb 0.57 -0.30 -0.05 0.00 -0.02 0.00 0.00 35.03 35.24 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 -0.51 7.27 0.60 4.39 6.03 -1.26 -4.87 114.94 126.58 1t0g s ASN 71 Ca 0.00 2.11 0.30 0.00 -1.03 0.00 0.00 52.86 54.24 1t0g s ASN 71 Cb 0.00 -2.61 1.76 0.00 -3.03 0.00 0.00 41.25 37.37 1t0g s ASN 71 CO 0.00 -0.13 2.16 1.05 -2.03 0.00 0.00 177.10 178.15 1t0g h GLU 72 N 3.59 0.00 0.39 3.55 4.11 -1.95 -2.42 114.58 121.86 1t0g h GLU 72 Ca -0.47 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.94 1t0g h GLU 72 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1t0g h GLU 72 CO 0.66 0.00 -0.19 1.49 0.07 0.00 0.00 179.01 181.04 1t0g h GLU 73 N 0.00 -0.51 -0.00 1.06 4.22 -2.01 -3.18 114.58 114.16 1t0g h GLU 73 Ca 0.05 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.52 1t0g h GLU 73 Cb 0.30 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1t0g h GLU 73 CO -0.00 -0.27 -0.00 -3.47 -2.18 0.00 0.00 179.01 173.09 1t0g n ASP 74 N -5.27 0.00 -4.55 1.04 2.03 -0.92 -4.48 116.55 104.40 1t0g n ASP 74 Ca -0.11 0.25 -0.40 0.00 0.52 0.00 0.00 54.79 55.06 1t0g n ASP 74 Cb 0.26 -0.42 -0.03 0.00 -0.72 0.00 0.00 41.12 40.21 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 -2.84 3.57 -0.00 5.18 1.01 -1.19 -3.47 120.40 122.66 1t0g s VAL 75 Ca 0.20 0.36 -0.19 0.00 0.00 0.00 0.00 61.98 62.35 1t0g s VAL 75 Cb 0.19 -4.40 0.04 0.00 0.00 0.00 0.00 36.38 32.21 1t0g s VAL 75 CO 0.50 -1.32 0.41 -0.55 0.00 0.00 0.00 175.10 174.14 1t0g s SER 76 N 5.78 -0.30 0.00 3.32 0.15 -0.95 -4.81 113.70 116.90 1t0g s SER 76 Ca 0.52 0.16 0.19 0.00 0.70 0.00 0.00 55.95 57.53 1t0g s SER 76 Cb -0.11 0.39 1.06 0.00 -1.71 0.00 0.00 66.02 65.65 1t0g s SER 76 CO 0.19 -0.55 1.58 -0.81 1.20 0.00 0.00 173.24 174.86 1t0g n PRO 77 N 0.95 0.43 -1.93 5.44 -0.04 -1.16 -0.35 135.00 138.34 1t0g n PRO 77 Ca -0.20 0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 62.90 1t0g n PRO 77 Cb 0.57 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.51 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 -2.32 6.61 0.00 3.54 0.15 -1.26 -4.74 113.70 115.68 1t0g s SER 78 Ca 0.23 2.41 0.07 0.00 0.70 0.00 0.00 55.95 59.36 1t0g s SER 78 Cb 0.13 -2.55 0.14 0.00 -1.71 0.00 0.00 66.02 62.03 1t0g s SER 78 CO 0.26 -0.92 0.99 0.18 1.20 0.00 0.00 173.24 174.96 1t0g n LEU 79 N 6.39 2.19 0.02 3.45 4.77 -1.26 -3.76 117.00 128.79 1t0g n LEU 79 Ca 0.17 -1.62 0.11 0.00 -0.03 0.00 0.00 56.01 54.64 1t0g n LEU 79 Cb 0.41 -0.09 0.05 0.00 -2.33 0.00 0.00 43.42 41.47 1t0g n LEU 79 CO 0.63 0.52 0.09 -1.84 -1.33 0.00 0.00 177.39 175.46 1t0g n GLU 80 N 0.22 0.20 -1.63 3.23 -0.00 -1.26 -3.79 120.64 117.61 1t0g n GLU 80 Ca 0.06 -0.00 -0.32 0.00 -0.00 0.00 0.00 57.16 56.90 1t0g n GLU 80 Cb 0.29 -1.57 0.06 0.00 -0.00 0.00 0.00 31.44 30.22 1t0g n GLU 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1t0g n GLY 81 N 1.41 6.01 2.98 -1.84 0.00 -1.26 -4.91 105.19 107.58 1t0g n GLY 81 Ca 0.03 -2.45 -0.13 0.00 0.00 0.00 0.00 46.02 43.47 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 -3.77 0.44 0.00 0.99 1.43 -1.25 -5.05 118.68 111.46 1t0g s LEU 82 Ca 0.59 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 54.12 1t0g s LEU 82 Cb 0.47 0.55 0.04 0.00 0.03 0.00 0.00 46.19 47.28 1t0g s LEU 82 CO -0.04 -0.17 0.28 1.07 0.23 0.00 0.00 176.35 177.72 1t0g n THR 83 N 4.39 0.00 -0.16 5.49 5.66 -1.26 -4.71 114.28 123.69 1t0g n THR 83 Ca -0.23 -0.44 -0.04 0.00 -3.05 0.00 0.00 64.05 60.29 1t0g n THR 83 Cb 0.52 -1.23 0.05 0.00 -1.55 0.00 0.00 70.33 68.11 1t0g n THR 83 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 1t0g h GLU 84 N 0.00 0.43 -0.61 1.09 5.08 -2.00 0.36 114.58 118.94 1t0g h GLU 84 Ca -0.09 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1t0g h GLU 84 Cb 0.34 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1t0g h GLU 84 CO 0.10 0.29 0.40 1.57 -1.00 0.00 0.00 179.01 180.37 1t0g h LYS 85 N 0.44 0.75 0.02 2.33 2.10 -1.99 0.42 116.57 120.65 1t0g h LYS 85 Ca 0.22 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.82 1t0g h LYS 85 Cb 0.16 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 31.32 1t0g h LYS 85 CO -0.17 0.50 -0.01 0.93 -2.00 0.00 0.00 179.45 178.70 1t0g h GLU 86 N 0.78 -0.03 -0.18 0.07 5.08 -1.59 -3.00 114.58 115.70 1t0g h GLU 86 Ca 0.23 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1t0g h GLU 86 Cb -0.01 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1t0g h GLU 86 CO -0.06 0.71 0.11 0.82 -1.00 0.00 0.00 179.01 179.59 1t0g h ILE 87 N -0.88 1.02 -0.76 3.13 2.04 -0.06 -2.85 117.51 119.15 1t0g h ILE 87 Ca -0.00 -0.08 0.13 0.00 1.00 0.00 0.00 64.86 65.91 1t0g h ILE 87 Cb 0.75 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.56 1t0g h ILE 87 CO 0.00 0.04 0.50 0.78 0.00 0.00 0.00 178.15 179.48 1t0g h ASN 88 N 0.22 0.48 -0.19 1.72 2.35 -0.23 0.67 115.58 120.60 1t0g h ASN 88 Ca 0.07 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1t0g h ASN 88 Cb -0.01 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1t0g h ASN 88 CO -0.03 0.26 0.10 0.74 -1.65 0.00 0.00 177.43 176.85 1t0g h THR 89 N 0.52 1.12 -0.17 2.81 2.02 -1.35 -2.09 112.91 115.77 1t0g h THR 89 Ca 0.37 -0.35 -0.20 0.00 0.77 0.00 0.00 66.41 66.99 1t0g h THR 89 Cb 0.70 1.00 0.01 0.00 -1.74 0.00 0.00 68.15 68.12 1t0g h THR 89 CO -0.13 0.12 -0.68 0.25 0.37 0.00 0.00 175.52 175.45 1t0g h LEU 90 N 0.19 0.89 -1.20 2.58 5.85 -1.16 -2.96 115.31 119.51 1t0g h LEU 90 Ca 0.07 -0.61 0.19 0.00 0.84 0.00 0.00 57.88 58.36 1t0g h LEU 90 Cb 0.10 -0.26 -0.09 0.00 0.37 0.00 0.00 40.66 40.78 1t0g h LEU 90 CO -0.01 1.36 0.61 -1.13 -0.34 0.00 0.00 178.44 178.93 1t0g h ASN 91 N 0.49 0.66 -0.03 1.25 -0.73 0.42 0.40 115.58 118.04 1t0g h ASN 91 Ca -0.04 0.07 -0.00 0.00 1.87 0.00 0.00 56.30 58.20 1t0g h ASN 91 Cb 1.31 -0.05 -0.00 0.00 0.27 0.00 0.00 38.32 39.85 1t0g h ASN 91 CO 0.14 0.26 0.00 -0.78 -0.37 0.00 0.00 177.43 176.68 1t0g h ASP 92 N 0.66 0.04 -0.90 1.15 3.58 -1.36 -3.26 116.42 116.33 1t0g h ASP 92 Ca 0.53 -0.30 0.08 0.00 0.42 0.00 0.00 57.03 57.76 1t0g h ASP 92 Cb 0.96 -0.01 -0.07 0.00 1.72 0.00 0.00 39.33 41.93 1t0g h ASP 92 CO -0.29 0.34 0.55 -0.50 -2.88 0.00 0.00 179.24 176.46 1t0g h TRP 93 N -0.25 1.01 -0.31 0.28 -0.00 -0.36 -2.96 115.95 113.37 1t0g h TRP 93 Ca 0.01 0.03 0.06 0.00 -0.00 0.00 0.00 58.89 58.99 1t0g h TRP 93 Cb 0.31 -0.32 -0.08 0.00 -0.00 0.00 0.00 29.16 29.07 1t0g h TRP 93 CO 0.03 0.47 -0.43 0.93 -0.00 0.00 0.00 178.44 179.44 1t0g h GLU 94 N 0.96 -0.37 -0.38 0.49 5.08 -0.44 -0.32 114.58 119.60 1t0g h GLU 94 Ca 0.41 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.91 1t0g h GLU 94 Cb 0.27 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1t0g h GLU 94 CO -0.21 -0.25 0.28 1.15 -1.00 0.00 0.00 179.01 178.99 1t0g h THR 95 N -0.39 0.76 -0.04 1.13 2.02 -1.61 0.35 112.91 115.13 1t0g h THR 95 Ca 0.11 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 67.08 1t0g h THR 95 Cb 0.60 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1t0g h THR 95 CO -0.51 0.00 -0.86 0.11 0.37 0.00 0.00 175.52 174.63 1t0g h LYS 96 N 0.00 0.43 0.03 6.66 1.79 -1.02 -1.71 116.57 122.74 1t0g h LYS 96 Ca 0.18 -0.41 -0.11 0.00 -2.18 0.00 0.00 60.65 58.13 1t0g h LYS 96 Cb 0.74 0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.49 1t0g h LYS 96 CO -0.00 1.07 -0.57 0.74 -1.08 0.00 0.00 179.45 179.60 1t0g h PHE 97 N 0.26 0.13 -0.04 -1.35 -1.00 -1.12 -3.34 116.94 110.49 1t0g h PHE 97 Ca -0.06 -0.10 0.01 0.00 2.81 0.00 0.00 57.97 60.64 1t0g h PHE 97 Cb 1.47 -0.01 -0.00 0.00 3.61 0.00 0.00 35.95 41.03 1t0g h PHE 97 CO 0.06 1.22 0.23 0.93 -1.61 0.00 0.00 178.31 179.14 1t0g h GLU 98 N -0.83 0.00 0.00 1.51 5.08 -0.28 0.16 114.58 120.22 1t0g h GLU 98 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1t0g h GLU 98 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1t0g h GLU 98 CO -0.02 0.00 -1.31 0.00 -1.00 0.00 0.00 179.01 176.68 1t0g n ALA 99 N -2.01 3.97 -0.04 3.43 0.00 -0.65 -4.55 120.51 120.66 1t0g n ALA 99 Ca -0.02 -0.55 -0.05 0.00 0.00 0.00 0.00 53.44 52.83 1t0g n ALA 99 Cb 0.30 -0.79 -0.05 0.00 0.00 0.00 0.00 19.45 18.90 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 -1.79 1.69 -4.66 0.00 4.01 -0.33 -5.02 118.16 112.06 1t0g n LYS 100 Ca 0.01 0.02 -0.34 0.00 -0.51 0.00 0.00 58.31 57.50 1t0g n LYS 100 Cb 0.42 -1.19 -0.12 0.00 -0.51 0.00 0.00 35.03 33.64 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 -2.18 2.89 0.26 2.13 2.02 0.43 -5.10 117.35 117.80 1t0g s TYR 101 Ca -0.07 -0.01 -0.27 0.00 -0.37 0.00 0.00 57.07 56.34 1t0g s TYR 101 Cb 0.03 -1.69 -0.09 0.00 -0.40 0.00 0.00 41.96 39.81 1t0g s TYR 101 CO 0.26 0.31 0.90 -1.25 -1.57 0.00 0.00 175.55 174.20 1t0g s PRO 102 N -0.83 4.65 -0.39 -1.71 0.04 -1.26 -4.62 135.00 130.88 1t0g s PRO 102 Ca 0.12 1.32 -0.28 0.00 0.04 0.00 0.00 61.00 62.21 1t0g s PRO 102 Cb -0.11 -3.05 0.02 0.00 0.04 0.00 0.00 34.50 31.40 1t0g s PRO 102 CO 0.02 0.42 1.04 0.08 0.04 0.00 0.00 177.00 178.60 1t0g s VAL 103 N -1.38 4.44 -1.13 -0.36 1.01 -1.26 -0.97 120.40 120.75 1t0g s VAL 103 Ca 0.44 1.35 0.12 0.00 0.00 0.00 0.00 61.98 63.89 1t0g s VAL 103 Cb -0.22 -4.45 0.29 0.00 0.00 0.00 0.00 36.38 32.00 1t0g s VAL 103 CO 0.27 -0.68 1.21 1.33 0.00 0.00 0.00 175.10 177.22 1t0g n VAL 104 N 6.23 0.80 -2.03 2.92 0.24 0.90 -4.97 118.33 122.43 1t0g n VAL 104 Ca 0.10 -0.90 0.00 0.00 -2.04 0.00 0.00 64.34 61.50 1t0g n VAL 104 Cb 0.48 0.65 0.00 0.00 -1.47 0.00 0.00 33.84 33.50 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 0.64 -0.51 3.23 7.63 0.00 -1.17 -2.45 105.19 112.56 1t0g n GLY 105 Ca 0.12 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.75 1.07 -0.09 1.61 1.70 -0.88 -1.55 118.95 119.07 1t0g s ARG 106 Ca 0.00 -1.51 0.02 0.00 -0.47 0.00 0.00 55.73 53.77 1t0g s ARG 106 Cb 0.00 -0.20 -0.02 0.00 -0.57 0.00 0.00 34.95 34.16 1t0g s ARG 106 CO 0.00 -0.14 -0.14 0.54 -1.08 0.00 0.00 175.30 174.48 1t0g s VAL 107 N -3.70 3.05 0.02 4.99 0.11 -0.15 -0.25 120.40 124.46 1t0g s VAL 107 Ca 0.23 -0.70 0.06 0.00 -2.93 0.00 0.00 61.98 58.65 1t0g s VAL 107 Cb 0.06 -2.23 -0.03 0.00 -1.53 0.00 0.00 36.38 32.65 1t0g s VAL 107 CO 0.03 0.56 -0.17 0.68 -3.33 0.00 0.00 175.10 172.87 1t0g s VAL 108 N -0.19 2.86 0.00 2.04 -7.23 0.27 -4.71 120.40 113.44 1t0g s VAL 108 Ca 0.00 -1.09 0.00 0.00 -1.81 0.00 0.00 61.98 59.08 1t0g s VAL 108 Cb -0.13 -2.19 0.00 0.00 0.56 0.00 0.00 36.38 34.62 1t0g s VAL 108 CO 0.03 0.39 0.00 -0.24 -0.31 0.00 0.00 175.10 174.97