#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 0.89 3.77 3.03 0.00 -1.26 -5.03 105.19 106.59 1t0g n GLY 2 Ca 0.00 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 1t0g n GLY 2 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1t0g s HIS 3 N -2.51 3.52 0.13 1.61 -0.00 -1.26 -5.00 115.29 111.78 1t0g s HIS 3 Ca 0.00 1.71 -0.30 0.00 -0.00 0.00 0.00 55.06 56.47 1t0g s HIS 3 Cb 0.00 -3.19 -0.06 0.00 -0.00 0.00 0.00 32.58 29.32 1t0g s HIS 3 CO 0.00 -0.45 0.96 -1.01 -0.00 0.00 0.00 174.74 174.24 1t0g s HIS 4 N -1.33 3.83 -0.68 0.38 3.76 -1.26 -4.95 115.29 115.04 1t0g s HIS 4 Ca 0.49 1.81 -0.27 0.00 -0.15 0.00 0.00 55.06 56.94 1t0g s HIS 4 Cb -0.28 -3.05 -0.00 0.00 1.11 0.00 0.00 32.58 30.36 1t0g s HIS 4 CO 0.35 0.24 1.64 -3.38 -0.85 0.00 0.00 174.74 172.74 1t0g s HIS 5 N -0.14 1.91 -0.24 1.40 0.00 -1.26 -4.88 115.29 112.07 1t0g s HIS 5 Ca 0.46 0.44 -0.04 0.00 -3.00 0.00 0.00 55.06 52.92 1t0g s HIS 5 Cb -0.24 -4.30 0.08 0.00 -4.00 0.00 0.00 32.58 24.12 1t0g s HIS 5 CO 0.30 -2.20 0.10 -1.01 -1.00 0.00 0.00 174.74 170.93 1t0g s HIS 6 N 7.78 0.47 -0.67 0.38 3.76 -1.26 -5.11 115.29 120.64 1t0g s HIS 6 Ca 0.55 -0.76 -0.19 0.00 -0.15 0.00 0.00 55.06 54.51 1t0g s HIS 6 Cb -0.10 -0.91 0.12 0.00 1.11 0.00 0.00 32.58 32.79 1t0g s HIS 6 CO 0.17 -0.70 0.79 -1.01 -0.85 0.00 0.00 174.74 173.14 1t0g s HIS 7 N 2.05 3.08 0.16 1.40 0.09 -1.26 -4.36 115.29 116.44 1t0g s HIS 7 Ca 0.06 -1.11 0.00 0.00 -0.00 0.00 0.00 55.06 54.00 1t0g s HIS 7 Cb -0.16 -4.05 0.00 0.00 -0.00 0.00 0.00 32.58 28.37 1t0g s HIS 7 CO -0.23 -1.31 0.00 1.58 -0.00 0.00 0.00 174.74 174.77 1t0g n HIS 8 N 6.18 -2.82 -4.12 1.40 -0.00 -1.26 -5.11 115.22 109.50 1t0g n HIS 8 Ca -0.02 0.54 -0.18 0.00 -0.00 0.00 0.00 57.72 58.05 1t0g n HIS 8 Cb 0.44 1.58 -0.16 0.00 -0.00 0.00 0.00 29.99 31.85 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 -5.42 1.44 0.02 0.27 -0.00 -1.24 -4.20 118.68 109.55 1t0g s LEU 9 Ca 0.00 -0.10 0.01 0.00 -0.00 0.00 0.00 54.13 54.04 1t0g s LEU 9 Cb 0.00 -0.36 -0.01 0.00 -0.00 0.00 0.00 46.19 45.81 1t0g s LEU 9 CO 0.00 -0.04 -0.05 -0.70 -0.00 0.00 0.00 176.35 175.57 1t0g s GLU 10 N 0.71 0.37 -0.10 1.48 2.12 -1.26 -4.93 118.70 117.08 1t0g s GLU 10 Ca -0.09 -0.48 -0.26 0.00 0.36 0.00 0.00 54.97 54.51 1t0g s GLU 10 Cb -0.12 -0.17 -0.03 0.00 0.26 0.00 0.00 34.13 34.08 1t0g s GLU 10 CO -0.00 0.03 0.82 -2.00 -0.54 0.00 0.00 175.26 173.57 1t0g s GLU 11 N -0.98 4.40 -0.08 4.30 2.12 -1.26 -1.64 118.70 125.56 1t0g s GLU 11 Ca -0.07 1.06 0.03 0.00 0.36 0.00 0.00 54.97 56.35 1t0g s GLU 11 Cb -0.07 -3.51 -0.02 0.00 0.26 0.00 0.00 34.13 30.80 1t0g s GLU 11 CO -0.00 -0.14 -0.17 -0.06 -0.54 0.00 0.00 175.26 174.35 1t0g s PHE 12 N 1.45 2.66 0.33 5.30 0.40 0.75 -4.95 117.98 123.92 1t0g s PHE 12 Ca 0.41 -0.46 -0.00 0.00 -0.60 0.00 0.00 56.93 56.28 1t0g s PHE 12 Cb -0.18 -1.68 -0.04 0.00 0.51 0.00 0.00 43.02 41.63 1t0g s PHE 12 CO 0.18 -0.04 0.54 0.99 0.70 0.00 0.00 175.22 177.58 1t0g s THR 13 N -0.26 5.10 0.15 0.64 2.01 -1.26 0.35 115.64 122.38 1t0g s THR 13 Ca 0.01 -0.37 -0.17 0.00 0.31 0.00 0.00 61.69 61.46 1t0g s THR 13 Cb -0.13 -3.83 0.03 0.00 0.01 0.00 0.00 72.50 68.58 1t0g s THR 13 CO 0.03 -0.49 1.72 0.00 -0.69 0.00 0.00 174.62 175.18 1t0g h ALA 14 N 1.00 0.31 -0.00 7.40 0.00 -1.69 0.28 119.26 126.56 1t0g h ALA 14 Ca -0.49 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.36 1t0g h ALA 14 Cb 1.21 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1t0g h ALA 14 CO 0.63 -0.38 -0.67 0.93 0.00 0.00 0.00 179.25 179.76 1t0g h GLU 15 N 0.12 0.02 -0.05 0.00 5.08 -1.95 -2.77 114.58 115.04 1t0g h GLU 15 Ca 0.16 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.39 1t0g h GLU 15 Cb 0.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1t0g h GLU 15 CO -0.24 0.68 -0.48 1.96 -1.00 0.00 0.00 179.01 179.93 1t0g h GLN 16 N 0.01 0.12 -0.28 2.33 7.50 -1.57 -2.48 115.11 120.75 1t0g h GLN 16 Ca -0.01 -0.06 -0.08 0.00 0.50 0.00 0.00 58.65 59.00 1t0g h GLN 16 Cb 1.18 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.70 1t0g h GLN 16 CO 0.09 0.57 -0.17 1.25 -1.50 0.00 0.00 178.83 179.07 1t0g h LEU 17 N 0.10 0.48 0.00 1.46 7.12 -0.24 -3.08 115.31 121.15 1t0g h LEU 17 Ca 0.00 -0.14 0.00 0.00 0.13 0.00 0.00 57.88 57.88 1t0g h LEU 17 Cb 0.88 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 40.88 1t0g h LEU 17 CO 0.07 0.67 0.00 -1.20 -0.13 0.00 0.00 178.44 177.85 1t0g n SER 18 N -4.17 0.00 -1.18 1.25 7.64 -0.93 -1.36 113.62 114.87 1t0g n SER 18 Ca 0.00 -0.66 0.11 0.00 1.01 0.00 0.00 58.87 59.33 1t0g n SER 18 Cb 0.35 0.00 0.27 0.00 -1.01 0.00 0.00 64.21 63.82 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 -0.67 2.68 -1.54 1.43 6.02 -1.17 -4.01 117.38 120.11 1t0g n GLN 19 Ca 0.03 -2.47 -0.05 0.00 -0.01 0.00 0.00 57.00 54.50 1t0g n GLN 19 Cb 0.01 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 29.87 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 1.41 1.07 0.84 1.08 4.01 -0.46 -4.56 117.16 120.55 1t0g n TYR 20 Ca 0.21 -1.66 0.09 0.00 -0.16 0.00 0.00 57.90 56.38 1t0g n TYR 20 Cb 0.58 -0.26 0.26 0.00 -0.31 0.00 0.00 39.34 39.61 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 -0.64 2.13 0.00 7.72 6.94 -1.26 -1.86 115.26 128.29 1t0g n ASN 21 Ca 0.23 -1.89 0.00 0.00 -0.02 0.00 0.00 54.58 52.90 1t0g n ASN 21 Cb 0.87 -0.21 0.00 0.00 -2.36 0.00 0.00 39.78 38.08 1t0g n ASN 21 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1t0g n GLY 22 N 1.18 0.77 0.50 4.83 0.00 -1.26 -4.43 105.19 106.78 1t0g n GLY 22 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.27 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 -2.16 0.00 -1.52 2.61 5.66 -1.26 -4.73 114.28 112.88 1t0g n THR 23 Ca 0.00 -0.31 -0.30 0.00 -3.05 0.00 0.00 64.05 60.39 1t0g n THR 23 Cb 0.00 1.26 0.19 0.00 -1.55 0.00 0.00 70.33 70.23 1t0g n THR 23 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1t0g s ASP 24 N -2.22 2.55 -0.75 1.09 1.11 -1.26 -4.92 116.67 112.27 1t0g s ASP 24 Ca 0.18 0.63 -0.09 0.00 0.18 0.00 0.00 52.55 53.44 1t0g s ASP 24 Cb 0.16 -0.93 0.20 0.00 1.07 0.00 0.00 42.92 43.42 1t0g s ASP 24 CO 0.48 -3.11 0.64 -1.61 1.18 0.00 0.00 175.17 172.75 1t0g s GLU 25 N -5.52 3.18 -0.03 8.23 2.02 -1.26 -4.30 118.70 121.03 1t0g s GLU 25 Ca 0.69 -2.51 0.00 0.00 0.02 0.00 0.00 54.97 53.18 1t0g s GLU 25 Cb -0.10 -4.14 0.00 0.00 0.10 0.00 0.00 34.13 29.99 1t0g s GLU 25 CO 0.54 -1.24 0.00 0.43 0.02 0.00 0.00 175.26 175.01 1t0g n SER 26 N 3.75 -3.05 -4.88 -0.19 7.64 -1.26 -5.04 113.62 110.60 1t0g n SER 26 Ca 0.12 0.01 -0.31 0.00 1.01 0.00 0.00 58.87 59.69 1t0g n SER 26 Cb 0.43 -0.57 -0.05 0.00 -1.01 0.00 0.00 64.21 63.01 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 -1.41 3.80 0.60 1.43 1.02 -1.26 -5.03 119.74 118.88 1t0g s LYS 27 Ca 0.00 0.30 -0.18 0.00 0.02 0.00 0.00 55.97 56.11 1t0g s LYS 27 Cb 0.00 -2.59 -0.06 0.00 -0.52 0.00 0.00 37.83 34.66 1t0g s LYS 27 CO 0.00 0.24 0.85 -2.30 -0.92 0.00 0.00 175.35 173.22 1t0g n PRO 28 N -0.44 0.78 -3.77 -1.68 -0.02 -1.26 -4.77 135.00 123.85 1t0g n PRO 28 Ca 0.01 0.30 -0.37 0.00 -2.02 0.00 0.00 63.50 61.42 1t0g n PRO 28 Cb 0.53 -2.04 -0.06 0.00 -0.02 0.00 0.00 33.50 31.90 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 -1.57 5.40 0.03 4.25 -1.09 -1.26 -4.60 121.20 122.35 1t0g s ILE 29 Ca 0.74 0.35 0.01 0.00 -2.23 0.00 0.00 60.65 59.52 1t0g s ILE 29 Cb -0.42 -3.48 -0.02 0.00 -1.58 0.00 0.00 42.46 36.96 1t0g s ILE 29 CO 0.49 0.57 -0.05 -0.31 -1.23 0.00 0.00 174.94 174.41 1t0g s TYR 30 N -0.76 0.42 0.05 3.97 2.02 -0.78 -0.41 117.35 121.86 1t0g s TYR 30 Ca 0.16 -0.44 0.03 0.00 -0.37 0.00 0.00 57.07 56.45 1t0g s TYR 30 Cb -0.13 -0.27 -0.02 0.00 -0.40 0.00 0.00 41.96 41.14 1t0g s TYR 30 CO 0.05 -0.12 -0.10 0.54 -1.57 0.00 0.00 175.55 174.35 1t0g s VAL 31 N -1.21 0.72 -0.19 0.71 0.11 -0.82 0.24 120.40 119.96 1t0g s VAL 31 Ca -0.11 -1.07 0.00 0.00 -2.93 0.00 0.00 61.98 57.87 1t0g s VAL 31 Cb -0.09 -0.74 0.02 0.00 -1.53 0.00 0.00 36.38 34.04 1t0g s VAL 31 CO -0.00 -0.28 -0.17 0.00 -3.33 0.00 0.00 175.10 171.32 1t0g s ALA 32 N -1.23 2.41 -0.12 1.54 0.00 -1.23 -1.16 121.76 121.96 1t0g s ALA 32 Ca -0.06 -1.25 0.03 0.00 0.00 0.00 0.00 51.96 50.68 1t0g s ALA 32 Cb -0.09 -1.28 0.00 0.00 0.00 0.00 0.00 23.12 21.75 1t0g s ALA 32 CO 0.01 -0.42 -0.21 0.42 0.00 0.00 0.00 175.76 175.56 1t0g s ILE 33 N 1.30 2.21 0.00 0.00 1.01 -0.74 -1.22 121.20 123.76 1t0g s ILE 33 Ca 0.04 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.74 1t0g s ILE 33 Cb -0.14 -1.87 0.00 0.00 0.01 0.00 0.00 42.46 40.46 1t0g s ILE 33 CO -0.11 0.55 0.00 1.17 0.00 0.00 0.00 174.94 176.55 1t0g n LYS 34 N 3.78 0.00 -0.15 2.79 0.00 -1.26 -1.16 118.16 122.16 1t0g n LYS 34 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.12 1t0g n LYS 34 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.55 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 0.00 0.46 3.75 3.14 0.00 -1.26 -4.80 105.19 106.47 1t0g n GLY 35 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 3.41 -0.21 1.61 0.52 -0.31 -0.44 118.95 123.52 1t0g s ARG 36 Ca 0.00 -0.28 -0.09 0.00 -0.52 0.00 0.00 55.73 54.84 1t0g s ARG 36 Cb 0.00 -3.05 -0.04 0.00 0.52 0.00 0.00 34.95 32.38 1t0g s ARG 36 CO 0.00 0.63 0.11 0.08 0.02 0.00 0.00 175.30 176.13 1t0g s VAL 37 N -0.63 4.98 0.14 3.52 1.01 0.83 -1.79 120.40 128.45 1t0g s VAL 37 Ca 0.11 0.04 0.10 0.00 0.00 0.00 0.00 61.98 62.24 1t0g s VAL 37 Cb -0.12 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1t0g s VAL 37 CO 0.02 0.40 -0.20 -0.36 0.00 0.00 0.00 175.10 174.96 1t0g s PHE 38 N 0.81 2.46 -0.22 5.22 0.08 -0.31 -0.13 117.98 125.89 1t0g s PHE 38 Ca 0.05 -0.30 -0.24 0.00 0.12 0.00 0.00 56.93 56.56 1t0g s PHE 38 Cb -0.13 -1.29 -0.01 0.00 -0.57 0.00 0.00 43.02 41.02 1t0g s PHE 38 CO 0.02 0.40 0.81 0.34 -0.10 0.00 0.00 175.22 176.69 1t0g s ASP 39 N -2.27 6.85 -0.19 1.36 -1.08 -0.71 -1.94 116.67 118.69 1t0g s ASP 39 Ca 0.18 1.05 0.15 0.00 -0.52 0.00 0.00 52.55 53.41 1t0g s ASP 39 Cb -0.10 -2.43 0.41 0.00 -1.46 0.00 0.00 42.92 39.34 1t0g s ASP 39 CO 0.10 -0.45 1.29 1.33 0.52 0.00 0.00 175.17 177.95 1t0g n VAL 40 N 5.04 2.17 0.21 1.11 0.24 0.45 -4.16 118.33 123.39 1t0g n VAL 40 Ca 0.04 -2.46 0.08 0.00 -2.04 0.00 0.00 64.34 59.96 1t0g n VAL 40 Cb 0.48 -0.26 0.40 0.00 -1.47 0.00 0.00 33.84 32.99 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 0.81 0.74 0.00 3.34 2.02 -1.89 -1.12 112.91 116.81 1t0g h THR 41 Ca 0.04 -1.31 -0.01 0.00 0.77 0.00 0.00 66.41 65.91 1t0g h THR 41 Cb 1.23 1.83 -0.00 0.00 -1.74 0.00 0.00 68.15 69.47 1t0g h THR 41 CO 0.13 0.29 -0.05 0.71 0.37 0.00 0.00 175.52 176.98 1t0g h THR 42 N 0.00 0.31 -0.74 3.16 1.35 -1.91 -2.50 112.91 112.58 1t0g h THR 42 Ca -0.00 -0.28 -0.39 0.00 -0.55 0.00 0.00 66.41 65.19 1t0g h THR 42 Cb 0.81 1.20 -0.41 0.00 -1.73 0.00 0.00 68.15 68.02 1t0g h THR 42 CO 0.04 0.04 -1.00 0.61 -0.25 0.00 0.00 175.52 174.96 1t0g n GLY 43 N -0.81 3.55 0.38 5.82 0.00 -0.52 -4.89 105.19 108.71 1t0g n GLY 43 Ca -0.02 -1.76 0.14 0.00 0.00 0.00 0.00 46.02 44.38 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 2.55 0.54 -0.47 1.61 3.64 -0.82 0.02 116.57 123.65 1t0g h LYS 44 Ca 0.06 -0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.55 1t0g h LYS 44 Cb 1.29 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1t0g h LYS 44 CO 0.48 0.36 0.38 0.77 -2.27 0.00 0.00 179.45 179.17 1t0g h SER 45 N 0.56 0.00 0.09 4.20 0.02 -1.87 0.17 113.55 116.73 1t0g h SER 45 Ca 0.42 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 61.10 1t0g h SER 45 Cb 0.80 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 1t0g h SER 45 CO -0.17 0.00 -1.41 -0.26 -1.14 0.00 0.00 176.83 173.85 1t0g h PHE 46 N 0.00 0.36 0.00 3.45 0.04 -1.35 -3.40 116.94 116.04 1t0g h PHE 46 Ca 0.22 -0.26 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1t0g h PHE 46 Cb 0.98 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.12 1t0g h PHE 46 CO 0.00 1.55 0.00 0.66 -0.60 0.00 0.00 178.31 179.92 1t0g n TYR 47 N -3.98 0.00 -1.21 -0.55 4.02 -0.70 -2.68 117.16 112.06 1t0g n TYR 47 Ca -0.27 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.39 1t0g n TYR 47 Cb 0.87 -0.13 -0.00 0.00 -0.02 0.00 0.00 39.34 40.06 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 1.75 4.38 0.21 2.72 0.00 0.53 -3.48 105.19 111.30 1t0g n GLY 48 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 0.46 0.20 -2.01 1.61 2.88 -0.99 -4.73 113.62 111.03 1t0g n SER 49 Ca 0.41 -1.55 -0.13 0.00 -1.33 0.00 0.00 58.87 56.28 1t0g n SER 49 Cb 0.57 -0.10 0.03 0.00 -0.75 0.00 0.00 64.21 63.96 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 -0.09 0.10 0.00 0.46 0.00 -1.23 -5.01 105.19 99.43 1t0g n GLY 50 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.26 0.07 0.10 -0.02 0.00 -1.22 -4.91 105.19 97.95 1t0g n GLY 51 Ca -0.02 -1.85 0.13 0.00 0.00 0.00 0.00 46.02 44.28 1t0g n GLY 51 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1t0g n ASP 52 N -2.86 0.77 -1.46 1.61 5.75 -1.25 -2.06 116.55 117.04 1t0g n ASP 52 Ca 0.00 0.59 0.09 0.00 -0.01 0.00 0.00 54.79 55.45 1t0g n ASP 52 Cb 0.00 -0.79 0.32 0.00 -1.03 0.00 0.00 41.12 39.63 1t0g n ASP 52 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1t0g n TYR 53 N -2.23 1.34 0.35 2.11 4.01 -1.09 -4.36 117.16 117.28 1t0g n TYR 53 Ca 0.05 -0.54 0.14 0.00 -0.16 0.00 0.00 57.90 57.40 1t0g n TYR 53 Cb 0.40 -0.22 0.58 0.00 -0.31 0.00 0.00 39.34 39.79 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 3.73 0.00 1.63 7.72 0.87 -1.45 -1.48 113.55 124.57 1t0g h SER 54 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1t0g h SER 54 Cb 1.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 1t0g h SER 54 CO 0.20 0.00 0.00 0.24 -0.53 0.00 0.00 176.83 176.74 1t0g h MET 55 N 0.00 0.00 0.15 2.24 2.86 -1.82 -3.14 114.93 115.21 1t0g h MET 55 Ca 0.00 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.30 1t0g h MET 55 Cb 0.40 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 1t0g h MET 55 CO 0.00 0.00 -1.79 0.74 1.06 0.00 0.00 176.91 176.92 1t0g h PHE 56 N 0.00 0.56 -1.42 -0.22 -1.00 -1.55 -3.41 116.94 109.90 1t0g h PHE 56 Ca 0.00 -0.41 -0.66 0.00 2.81 0.00 0.00 57.97 59.71 1t0g h PHE 56 Cb 0.82 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 40.35 1t0g h PHE 56 CO 0.00 1.70 1.28 0.00 -1.61 0.00 0.00 178.31 179.68 1t0g n ALA 57 N -2.96 0.89 -2.13 2.45 0.00 -1.04 -0.79 120.51 116.93 1t0g n ALA 57 Ca -0.28 0.07 -0.15 0.00 0.00 0.00 0.00 53.44 53.08 1t0g n ALA 57 Cb 1.03 -2.51 -0.02 0.00 0.00 0.00 0.00 19.45 17.94 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 5.67 0.09 3.05 0.00 0.00 0.14 -4.35 105.19 109.79 1t0g n GLY 58 Ca 0.34 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 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 -4.49 0.20 -0.32 1.61 2.47 0.03 -3.11 119.74 116.14 1t0g s LYS 59 Ca 0.00 0.47 -0.28 0.00 -1.56 0.00 0.00 55.97 54.60 1t0g s LYS 59 Cb 0.00 -0.08 -0.06 0.00 -1.46 0.00 0.00 37.83 36.23 1t0g s LYS 59 CO 0.00 -0.14 2.29 -0.40 0.16 0.00 0.00 175.35 177.26 1t0g n ASP 60 N 3.98 2.87 -1.03 1.43 5.68 -1.26 -3.55 116.55 124.67 1t0g n ASP 60 Ca -0.23 0.01 0.08 0.00 -0.50 0.00 0.00 54.79 54.16 1t0g n ASP 60 Cb 0.54 -1.54 0.28 0.00 -1.14 0.00 0.00 41.12 39.26 1t0g n ASP 60 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1t0g n ALA 61 N 12.78 3.11 -0.09 2.12 0.00 -0.36 -1.45 120.51 136.63 1t0g n ALA 61 Ca 0.33 -2.25 -0.06 0.00 0.00 0.00 0.00 53.44 51.46 1t0g n ALA 61 Cb 0.45 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.13 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 2.12 -0.22 0.25 0.00 0.02 -1.43 -0.72 113.55 113.57 1t0g h SER 62 Ca 0.00 0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 60.88 1t0g h SER 62 Cb 1.51 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 64.21 1t0g h SER 62 CO 0.26 -0.07 -0.60 -0.09 -1.14 0.00 0.00 176.83 175.19 1t0g h ARG 63 N 0.04 0.35 -0.19 3.45 2.43 0.06 -3.19 114.38 117.33 1t0g h ARG 63 Ca 0.15 -0.24 -0.07 0.00 -0.81 0.00 0.00 59.98 59.01 1t0g h ARG 63 Cb 0.22 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1t0g h ARG 63 CO -0.29 0.84 -0.21 0.00 -1.51 0.00 0.00 179.97 178.80 1t0g h ALA 64 N 1.10 1.30 -0.53 2.80 0.00 -1.37 -0.60 119.26 121.97 1t0g h ALA 64 Ca -0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1t0g h ALA 64 Cb 1.12 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1t0g h ALA 64 CO 0.10 0.47 0.21 -0.07 0.00 0.00 0.00 179.25 179.96 1t0g h LEU 65 N 0.30 0.74 0.00 0.00 3.38 -1.18 0.69 115.31 119.25 1t0g h LEU 65 Ca 0.05 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 1t0g h LEU 65 Cb 0.54 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1t0g h LEU 65 CO 0.04 0.71 -0.64 1.23 0.09 0.00 0.00 178.44 179.87 1t0g h GLY 66 N 0.73 0.00 0.77 0.83 0.00 -1.26 -3.25 103.07 100.89 1t0g h GLY 66 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.27 1t0g h GLY 66 CO -0.01 0.00 -1.71 0.28 0.00 0.00 0.00 176.54 175.09 1t0g n LYS 67 N -3.11 0.64 -1.09 4.80 4.76 -0.36 -4.67 118.16 119.13 1t0g n LYS 67 Ca -0.00 0.19 -0.03 0.00 -2.87 0.00 0.00 58.31 55.60 1t0g n LYS 67 Cb 0.72 -1.74 -0.01 0.00 -1.84 0.00 0.00 35.03 32.15 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 -2.89 -0.26 -3.43 1.97 2.81 0.24 -5.01 117.12 110.55 1t0g n MET 68 Ca -0.16 0.54 -0.34 0.00 -1.81 0.00 0.00 57.70 55.93 1t0g n MET 68 Cb 0.96 -4.13 -0.06 0.00 -0.71 0.00 0.00 33.22 29.28 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 -2.82 6.72 -0.01 7.83 0.01 -0.95 -4.98 113.70 119.49 1t0g s SER 69 Ca 0.00 0.96 0.08 0.00 1.31 0.00 0.00 55.95 58.30 1t0g s SER 69 Cb 0.00 -2.24 -0.13 0.00 0.21 0.00 0.00 66.02 63.86 1t0g s SER 69 CO 0.00 0.07 0.21 0.29 0.41 0.00 0.00 173.24 174.22 1t0g n LYS 70 N 0.54 0.80 -1.68 12.44 5.02 -1.26 -4.67 118.16 129.36 1t0g n LYS 70 Ca -0.04 -0.07 -0.45 0.00 -2.02 0.00 0.00 58.31 55.73 1t0g n LYS 70 Cb 0.52 -1.16 -0.04 0.00 -0.02 0.00 0.00 35.03 34.33 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 -1.71 3.74 0.34 4.39 6.94 -1.26 -4.86 115.26 122.83 1t0g n ASN 71 Ca -0.01 0.97 0.21 0.00 -0.02 0.00 0.00 54.58 55.73 1t0g n ASN 71 Cb 0.21 -1.46 1.10 0.00 -2.36 0.00 0.00 39.78 37.27 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 9.00 0.00 0.00 -3.83 5.08 -1.93 0.15 114.58 123.05 1t0g h GLU 72 Ca -0.48 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.80 1t0g h GLU 72 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1t0g h GLU 72 CO 0.94 0.00 -0.40 1.49 -1.00 0.00 0.00 179.01 180.04 1t0g h GLU 73 N 0.00 0.00 0.00 2.33 4.57 -2.00 -3.00 114.58 116.48 1t0g h GLU 73 Ca 0.00 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.98 1t0g h GLU 73 Cb 0.20 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.75 1t0g h GLU 73 CO -0.00 0.40 -1.94 -3.47 -1.18 0.00 0.00 179.01 172.82 1t0g n ASP 74 N -4.00 0.31 -4.63 1.04 2.03 0.45 -4.85 116.55 106.90 1t0g n ASP 74 Ca -0.02 0.14 -0.43 0.00 0.52 0.00 0.00 54.79 55.01 1t0g n ASP 74 Cb 0.44 0.94 -0.03 0.00 -0.72 0.00 0.00 41.12 41.75 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 -2.91 3.40 0.13 5.18 1.01 -0.68 -4.12 120.40 122.41 1t0g s VAL 75 Ca -0.07 0.46 -0.24 0.00 0.00 0.00 0.00 61.98 62.13 1t0g s VAL 75 Cb 0.09 -3.40 0.07 0.00 0.00 0.00 0.00 36.38 33.14 1t0g s VAL 75 CO 0.84 -0.16 0.62 -0.55 0.00 0.00 0.00 175.10 175.86 1t0g s SER 76 N 5.06 -0.57 -0.01 3.32 0.15 -0.53 -4.90 113.70 116.23 1t0g s SER 76 Ca 0.81 0.07 0.05 0.00 0.70 0.00 0.00 55.95 57.58 1t0g s SER 76 Cb -0.31 0.58 0.16 0.00 -1.71 0.00 0.00 66.02 64.74 1t0g s SER 76 CO 0.33 -0.92 1.08 -0.81 1.20 0.00 0.00 173.24 174.12 1t0g n PRO 77 N -0.25 1.47 -3.20 5.44 -0.04 -1.25 -0.15 135.00 137.01 1t0g n PRO 77 Ca -0.17 -0.64 -0.38 0.00 -0.04 0.00 0.00 63.50 62.28 1t0g n PRO 77 Cb 0.64 -1.21 -0.06 0.00 -0.04 0.00 0.00 33.50 32.83 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 -0.89 7.09 -0.47 3.54 0.15 -1.26 -4.75 113.70 117.11 1t0g s SER 78 Ca 0.12 1.34 0.06 0.00 0.70 0.00 0.00 55.95 58.16 1t0g s SER 78 Cb 0.07 -2.39 0.18 0.00 -1.71 0.00 0.00 66.02 62.17 1t0g s SER 78 CO 0.07 0.19 0.56 -1.48 1.20 0.00 0.00 173.24 173.78 1t0g s LEU 79 N -1.43 -0.36 0.28 3.45 2.34 -1.26 -2.04 118.68 119.66 1t0g s LEU 79 Ca 0.35 -2.16 0.00 0.00 0.06 0.00 0.00 54.13 52.37 1t0g s LEU 79 Cb -0.19 0.99 0.00 0.00 -0.56 0.00 0.00 46.19 46.43 1t0g s LEU 79 CO 0.21 -0.11 0.00 1.21 -1.06 0.00 0.00 176.35 176.60 1t0g n GLU 80 N 3.05 0.00 -1.43 1.48 2.13 -1.26 -4.90 120.64 119.71 1t0g n GLU 80 Ca 0.21 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.74 1t0g n GLU 80 Cb 0.52 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.17 1t0g n GLU 80 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1t0g n GLY 81 N 1.32 4.19 2.85 8.31 0.00 -1.26 -4.75 105.19 115.85 1t0g n GLY 81 Ca 0.00 -1.64 -0.14 0.00 0.00 0.00 0.00 46.02 44.25 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 -0.90 1.69 0.00 0.99 1.43 -1.26 -5.11 118.68 115.52 1t0g s LEU 82 Ca 0.63 -0.00 -0.04 0.00 -1.03 0.00 0.00 54.13 53.68 1t0g s LEU 82 Cb 0.26 -0.07 0.09 0.00 0.03 0.00 0.00 46.19 46.50 1t0g s LEU 82 CO -0.09 -0.03 0.56 1.07 0.23 0.00 0.00 176.35 178.09 1t0g n THR 83 N 3.44 0.00 -0.30 5.49 5.66 -1.26 -4.78 114.28 122.53 1t0g n THR 83 Ca -0.18 -0.60 -0.04 0.00 -3.05 0.00 0.00 64.05 60.19 1t0g n THR 83 Cb 0.56 -1.48 0.07 0.00 -1.55 0.00 0.00 70.33 67.94 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 1.06 -0.13 1.09 4.81 -2.00 -1.79 114.58 117.63 1t0g h GLU 84 Ca -0.18 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.03 1t0g h GLU 84 Cb 0.57 -0.24 -0.06 0.00 0.63 0.00 0.00 28.75 29.66 1t0g h GLU 84 CO 0.16 0.70 -0.22 -0.22 -0.73 0.00 0.00 179.01 178.70 1t0g h LYS 85 N 1.10 -0.27 -0.20 1.92 3.64 -1.98 0.43 116.57 121.20 1t0g h LYS 85 Ca 0.30 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.71 1t0g h LYS 85 Cb -0.13 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1t0g h LYS 85 CO -0.07 -0.18 0.07 0.93 -2.27 0.00 0.00 179.45 177.94 1t0g h GLU 86 N -0.28 0.16 -0.19 1.90 4.39 -1.74 -2.07 114.58 116.75 1t0g h GLU 86 Ca 0.10 -0.01 -0.18 0.00 0.34 0.00 0.00 59.36 59.61 1t0g h GLU 86 Cb 0.43 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1t0g h GLU 86 CO -0.29 0.11 -0.58 0.82 -1.16 0.00 0.00 179.01 177.91 1t0g h ILE 87 N 0.17 1.30 -0.89 3.13 2.04 -1.05 -3.12 117.51 119.10 1t0g h ILE 87 Ca 0.09 -1.80 0.19 0.00 1.00 0.00 0.00 64.86 64.34 1t0g h ILE 87 Cb 0.06 1.90 -0.07 0.00 -0.74 0.00 0.00 36.82 37.97 1t0g h ILE 87 CO -0.09 0.57 0.58 0.78 0.00 0.00 0.00 178.15 179.99 1t0g h ASN 88 N 0.44 0.45 -0.54 1.72 2.35 0.21 0.26 115.58 120.48 1t0g h ASN 88 Ca -0.02 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1t0g h ASN 88 Cb 1.20 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 39.50 1t0g h ASN 88 CO 0.12 0.19 0.32 0.74 -1.65 0.00 0.00 177.43 177.16 1t0g h THR 89 N 0.46 1.17 -0.03 2.81 2.02 -1.32 -2.03 112.91 115.99 1t0g h THR 89 Ca 0.46 -0.38 -0.22 0.00 0.77 0.00 0.00 66.41 67.04 1t0g h THR 89 Cb 1.07 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1t0g h THR 89 CO -0.18 0.17 -0.89 0.25 0.37 0.00 0.00 175.52 175.24 1t0g h LEU 90 N 0.73 0.57 -1.41 2.58 5.85 -0.76 -3.01 115.31 119.86 1t0g h LEU 90 Ca 0.19 -0.43 0.18 0.00 0.84 0.00 0.00 57.88 58.66 1t0g h LEU 90 Cb -0.00 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 40.78 1t0g h LEU 90 CO -0.04 1.22 0.58 0.78 -0.34 0.00 0.00 178.44 180.65 1t0g h ASN 91 N 0.27 0.50 -0.26 1.25 -0.26 -0.30 0.26 115.58 117.05 1t0g h ASN 91 Ca -0.07 0.04 -0.01 0.00 -0.56 0.00 0.00 56.30 55.71 1t0g h ASN 91 Cb 1.51 -0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 38.71 1t0g h ASN 91 CO 0.16 0.22 0.13 -0.78 -1.06 0.00 0.00 177.43 176.10 1t0g h ASP 92 N 0.52 0.33 -0.63 5.81 3.58 -1.24 -1.88 116.42 122.91 1t0g h ASP 92 Ca 0.46 -0.12 -0.01 0.00 0.42 0.00 0.00 57.03 57.78 1t0g h ASP 92 Cb 0.99 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.92 1t0g h ASP 92 CO -0.20 0.36 0.36 -0.50 -2.88 0.00 0.00 179.24 176.38 1t0g h TRP 93 N 0.29 0.86 -0.53 0.28 4.06 -0.89 -2.09 115.95 117.93 1t0g h TRP 93 Ca 0.09 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 61.02 1t0g h TRP 93 Cb 0.11 -0.28 -0.03 0.00 -1.00 0.00 0.00 29.16 27.96 1t0g h TRP 93 CO -0.02 0.59 0.30 0.93 -3.56 0.00 0.00 178.44 176.68 1t0g h GLU 94 N 0.89 0.73 -0.25 0.49 5.08 -0.26 -1.76 114.58 119.50 1t0g h GLU 94 Ca 0.23 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.54 1t0g h GLU 94 Cb 0.01 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1t0g h GLU 94 CO -0.04 0.56 0.17 1.15 -1.00 0.00 0.00 179.01 179.85 1t0g h THR 95 N 0.71 0.99 -0.10 1.13 2.02 -0.71 -0.04 112.91 116.91 1t0g h THR 95 Ca 0.19 -0.07 -0.19 0.00 0.77 0.00 0.00 66.41 67.11 1t0g h THR 95 Cb 0.03 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1t0g h THR 95 CO -0.03 0.04 -0.72 0.11 0.37 0.00 0.00 175.52 175.29 1t0g h LYS 96 N 0.21 0.47 0.01 6.66 1.79 -0.75 -2.40 116.57 122.55 1t0g h LYS 96 Ca 0.11 -0.37 -0.25 0.00 -2.18 0.00 0.00 60.65 57.95 1t0g h LYS 96 Cb 0.17 0.07 0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1t0g h LYS 96 CO -0.02 1.00 -1.01 0.27 -1.08 0.00 0.00 179.45 178.62 1t0g h PHE 97 N 0.32 0.85 -0.05 -1.35 -5.15 -0.88 -3.00 116.94 107.69 1t0g h PHE 97 Ca -0.03 -0.47 0.01 0.00 -0.20 0.00 0.00 57.97 57.29 1t0g h PHE 97 Cb 1.30 -0.10 -0.00 0.00 0.22 0.00 0.00 35.95 37.37 1t0g h PHE 97 CO 0.05 1.30 0.25 0.93 -2.00 0.00 0.00 178.31 178.83 1t0g h GLU 98 N 0.32 0.00 -0.00 6.09 4.39 -0.87 0.33 114.58 124.83 1t0g h GLU 98 Ca -0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.59 1t0g h GLU 98 Cb 1.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.31 1t0g h GLU 98 CO 0.19 0.00 -0.03 0.00 -1.16 0.00 0.00 179.01 178.01 1t0g n ALA 99 N -2.01 2.47 0.00 3.43 0.00 -0.92 -4.84 120.51 118.65 1t0g n ALA 99 Ca -0.01 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1t0g n ALA 99 Cb 0.31 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.04 0.00 -3.98 0.00 4.01 -0.41 -5.07 118.16 112.67 1t0g n LYS 100 Ca 0.02 0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.47 1t0g n LYS 100 Cb 0.08 -0.46 -0.09 0.00 -0.51 0.00 0.00 35.03 34.04 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 -1.64 3.30 -0.08 2.13 2.02 0.10 -5.05 117.35 118.12 1t0g s TYR 101 Ca 0.00 0.16 -0.30 0.00 -0.37 0.00 0.00 57.07 56.56 1t0g s TYR 101 Cb 0.00 -2.06 -0.03 0.00 -0.40 0.00 0.00 41.96 39.47 1t0g s TYR 101 CO 0.00 0.24 1.19 -1.25 -1.57 0.00 0.00 175.55 174.16 1t0g s PRO 102 N 0.17 4.34 -0.41 -1.71 0.04 -1.26 -4.49 135.00 131.68 1t0g s PRO 102 Ca 0.05 1.64 -0.28 0.00 0.04 0.00 0.00 61.00 62.45 1t0g s PRO 102 Cb -0.12 -3.59 -0.01 0.00 0.04 0.00 0.00 34.50 30.82 1t0g s PRO 102 CO 0.00 -0.48 1.64 0.08 0.04 0.00 0.00 177.00 178.28 1t0g s VAL 103 N 2.42 3.64 -0.17 -0.36 1.01 -1.26 -1.74 120.40 123.93 1t0g s VAL 103 Ca 0.55 0.62 -0.13 0.00 0.00 0.00 0.00 61.98 63.01 1t0g s VAL 103 Cb -0.23 -3.94 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 1t0g s VAL 103 CO 0.20 -0.66 -0.22 1.33 0.00 0.00 0.00 175.10 175.75 1t0g n VAL 104 N 7.23 1.46 -1.40 2.92 0.24 0.82 -4.97 118.33 124.62 1t0g n VAL 104 Ca 0.19 0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.63 1t0g n VAL 104 Cb 0.48 -2.32 0.00 0.00 -1.47 0.00 0.00 33.84 30.53 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 1.53 5.46 3.30 7.63 0.00 -0.93 -3.67 105.19 118.51 1t0g n GLY 105 Ca -0.14 -1.05 -0.16 0.00 0.00 0.00 0.00 46.02 44.66 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 2.86 1.21 -0.06 1.61 1.70 -0.65 -0.12 118.95 125.50 1t0g s ARG 106 Ca 0.00 -1.54 0.04 0.00 -0.47 0.00 0.00 55.73 53.76 1t0g s ARG 106 Cb 0.00 -0.84 -0.02 0.00 -0.57 0.00 0.00 34.95 33.52 1t0g s ARG 106 CO 0.00 0.10 -0.16 0.54 -1.08 0.00 0.00 175.30 174.70 1t0g s VAL 107 N -3.19 2.91 0.03 4.99 0.11 0.41 -0.17 120.40 125.49 1t0g s VAL 107 Ca 0.21 -0.77 0.05 0.00 -2.93 0.00 0.00 61.98 58.53 1t0g s VAL 107 Cb 0.02 -2.13 -0.02 0.00 -1.53 0.00 0.00 36.38 32.71 1t0g s VAL 107 CO 0.04 0.58 -0.15 0.68 -3.33 0.00 0.00 175.10 172.93 1t0g s VAL 108 N -0.55 1.15 0.00 2.04 -7.23 0.16 -4.77 120.40 111.19 1t0g s VAL 108 Ca 0.08 -0.92 0.00 0.00 -1.81 0.00 0.00 61.98 59.32 1t0g s VAL 108 Cb -0.11 -1.02 0.00 0.00 0.56 0.00 0.00 36.38 35.81 1t0g s VAL 108 CO 0.01 0.09 0.00 -1.54 -0.31 0.00 0.00 175.10 173.35