#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t8c n GLY 2 N 0.00 -0.13 3.79 5.00 0.00 -1.26 -5.13 105.19 107.46 1t8c n GLY 2 Ca 0.00 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 1t8c n GLY 2 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1t8c s PHE 3 N -3.94 2.86 0.14 1.61 0.40 -1.26 -4.98 117.98 112.80 1t8c s PHE 3 Ca 0.00 1.55 0.00 0.00 -0.60 0.00 0.00 56.93 57.88 1t8c s PHE 3 Cb 0.00 -3.14 0.00 0.00 0.51 0.00 0.00 43.02 40.39 1t8c s PHE 3 CO 0.00 -1.19 0.00 1.33 0.70 0.00 0.00 175.22 176.06 1t8c n VAL 4 N -1.35 0.71 -3.70 -0.44 0.24 -1.26 -5.05 118.33 107.48 1t8c n VAL 4 Ca 0.10 0.23 -0.23 0.00 -2.04 0.00 0.00 64.34 62.41 1t8c n VAL 4 Cb 0.52 -1.23 0.04 0.00 -1.47 0.00 0.00 33.84 31.70 1t8c n VAL 4 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t8c n ASN 6 N -3.02 -2.02 -0.60 0.00 0.23 -1.26 -4.91 115.26 103.68 1t8c n ASN 6 Ca -0.21 -2.64 0.12 0.00 -0.53 0.00 0.00 54.58 51.31 1t8c n ASN 6 Cb 0.64 1.37 0.40 0.00 -2.08 0.00 0.00 39.78 40.11 1t8c n ASN 6 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 1t8c n THR 7 N 1.23 0.16 -3.87 5.53 5.66 -1.26 -4.58 114.28 117.14 1t8c n THR 7 Ca 0.04 -0.36 -0.30 0.00 -3.05 0.00 0.00 64.05 60.38 1t8c n THR 7 Cb 0.69 0.52 -0.12 0.00 -1.55 0.00 0.00 70.33 69.87 1t8c n THR 7 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1t8c h PRO 9 N 5.87 -0.01 0.00 0.00 0.13 -1.81 -3.46 132.00 132.73 1t8c h PRO 9 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1t8c h PRO 9 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1t8c h PRO 9 CO 0.73 -0.01 0.00 0.39 -0.23 0.00 0.00 178.00 178.88 1t8c n GLU 10 N -2.16 0.00 -0.27 0.86 1.02 -1.26 -4.86 120.64 113.97 1t8c n GLU 10 Ca -0.00 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.19 1t8c n GLU 10 Cb 0.00 0.00 0.19 0.00 -0.02 0.00 0.00 31.44 31.61 1t8c n GLU 10 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1t8c h LYS 11 N 0.00 0.55 -6.86 3.49 1.57 -1.93 -3.40 116.57 109.98 1t8c h LYS 11 Ca 0.00 -0.03 -0.51 0.00 -1.87 0.00 0.00 60.65 58.24 1t8c h LYS 11 Cb 0.00 -0.12 0.03 0.00 0.08 0.00 0.00 32.23 32.22 1t8c h LYS 11 CO 0.00 0.36 0.52 -1.58 -0.57 0.00 0.00 179.45 178.18 1t8c s TRP 12 N -6.01 3.35 -0.06 -1.35 0.52 -1.25 -3.85 118.94 110.28 1t8c s TRP 12 Ca -0.12 1.60 0.00 0.00 0.02 0.00 0.00 56.10 57.60 1t8c s TRP 12 Cb 0.20 -3.40 0.02 0.00 -1.15 0.00 0.00 33.47 29.15 1t8c s TRP 12 CO 0.77 -1.01 -0.05 0.42 0.02 0.00 0.00 176.95 177.10 1t8c s ILE 13 N -1.22 0.64 0.12 2.03 -1.09 -0.49 -4.22 121.20 116.97 1t8c s ILE 13 Ca 0.48 -0.13 0.04 0.00 -2.23 0.00 0.00 60.65 58.81 1t8c s ILE 13 Cb -0.33 -0.68 -0.04 0.00 -1.58 0.00 0.00 42.46 39.83 1t8c s ILE 13 CO 0.43 0.27 0.09 0.21 -1.23 0.00 0.00 174.94 174.71 1t8c s ASN 14 N 1.24 5.45 0.00 3.58 3.84 -1.26 0.11 114.94 127.91 1t8c s ASN 14 Ca -0.05 -0.09 0.00 0.00 0.21 0.00 0.00 52.86 52.92 1t8c s ASN 14 Cb -0.14 -1.42 0.00 0.00 -0.55 0.00 0.00 41.25 39.14 1t8c s ASN 14 CO -0.02 0.13 0.00 0.49 -2.79 0.00 0.00 177.10 174.91 1t8c n PHE 15 N 0.10 0.00 -0.25 0.43 3.72 0.17 -4.95 117.46 116.68 1t8c n PHE 15 Ca -0.09 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.37 1t8c n PHE 15 Cb 0.53 0.00 0.19 0.00 -0.94 0.00 0.00 39.48 39.26 1t8c n PHE 15 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1t8c h GLN 16 N 0.00 0.34 0.00 -1.08 3.07 -2.04 -3.40 115.11 112.01 1t8c h GLN 16 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.72 1t8c h GLN 16 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 27.48 27.48 1t8c h GLN 16 CO 0.00 0.23 0.00 0.54 0.09 0.00 0.00 178.83 179.69 1t8c n ARG 17 N -5.08 0.00 -4.30 0.06 5.12 -1.26 -5.14 116.66 106.06 1t8c n ARG 17 Ca 0.14 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.82 1t8c n ARG 17 Cb 0.45 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.67 1t8c n ARG 17 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 1t8c s LYS 18 N 0.00 2.21 0.31 5.56 -2.85 -1.26 -3.20 119.74 120.51 1t8c s LYS 18 Ca 0.00 -1.38 0.07 0.00 -1.00 0.00 0.00 55.97 53.66 1t8c s LYS 18 Cb 0.00 -2.15 -0.06 0.00 -2.06 0.00 0.00 37.83 33.56 1t8c s LYS 18 CO 0.00 0.39 -0.04 0.00 0.10 0.00 0.00 175.35 175.80 1t8c s TYR 20 N -2.95 1.94 -0.42 0.00 1.51 0.30 -0.77 117.35 116.96 1t8c s TYR 20 Ca 0.32 -0.62 -0.16 0.00 -1.01 0.00 0.00 57.07 55.59 1t8c s TYR 20 Cb 0.05 -1.31 0.02 0.00 -0.11 0.00 0.00 41.96 40.61 1t8c s TYR 20 CO 0.14 -0.22 0.38 -0.47 -1.11 0.00 0.00 175.55 174.27 1t8c s TYR 21 N 0.11 3.20 -0.22 2.71 5.04 0.26 -1.39 117.35 127.05 1t8c s TYR 21 Ca -0.07 -0.49 -0.10 0.00 -2.44 0.00 0.00 57.07 53.97 1t8c s TYR 21 Cb -0.13 -2.79 -0.05 0.00 0.35 0.00 0.00 41.96 39.34 1t8c s TYR 21 CO 0.04 -0.67 0.14 -0.06 -1.34 0.00 0.00 175.55 173.66 1t8c s PHE 22 N 1.94 3.34 0.17 4.97 0.40 -1.25 -0.69 117.98 126.85 1t8c s PHE 22 Ca 0.09 0.23 0.02 0.00 -0.60 0.00 0.00 56.93 56.67 1t8c s PHE 22 Cb -0.18 -2.21 -0.01 0.00 0.51 0.00 0.00 43.02 41.13 1t8c s PHE 22 CO 0.12 0.14 0.19 0.41 0.70 0.00 0.00 175.22 176.78 1t8c n GLY 23 N 3.97 3.12 3.40 4.36 0.00 0.92 -4.71 105.19 116.24 1t8c n GLY 23 Ca -0.16 -1.67 -0.26 0.00 0.00 0.00 0.00 46.02 43.94 1t8c n GLY 23 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1t8c s LYS 24 N -2.57 1.44 0.00 1.61 2.20 -1.26 -0.89 119.74 120.26 1t8c s LYS 24 Ca 0.18 -1.47 0.00 0.00 -0.36 0.00 0.00 55.97 54.32 1t8c s LYS 24 Cb 0.00 -1.72 0.00 0.00 -1.51 0.00 0.00 37.83 34.60 1t8c s LYS 24 CO 0.13 0.37 0.00 0.41 -0.36 0.00 0.00 175.35 175.90 1t8c n GLY 25 N 0.36 2.87 3.57 5.54 0.00 -0.58 -4.46 105.19 112.48 1t8c n GLY 25 Ca -0.13 0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1t8c n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t8c s THR 26 N 0.00 5.03 0.00 2.61 2.01 -1.26 -2.67 115.64 121.36 1t8c s THR 26 Ca 0.00 0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.42 1t8c s THR 26 Cb 0.00 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.58 1t8c s THR 26 CO 0.00 -0.16 0.00 1.17 -0.69 0.00 0.00 174.62 174.94 1t8c n LYS 27 N 5.70 0.00 -4.38 4.92 4.81 -1.26 -5.03 118.16 122.91 1t8c n LYS 27 Ca -0.05 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.10 1t8c n LYS 27 Cb 0.49 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.48 1t8c n LYS 27 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1t8c s GLN 28 N 3.83 2.19 0.08 1.64 -0.21 -1.26 -4.30 119.66 121.63 1t8c s GLN 28 Ca 0.00 -2.16 -0.21 0.00 0.02 0.00 0.00 55.36 53.02 1t8c s GLN 28 Cb 0.00 -1.79 -0.10 0.00 1.00 0.00 0.00 33.01 32.12 1t8c s GLN 28 CO 0.00 -0.35 1.58 2.35 -2.12 0.00 0.00 175.29 176.75 1t8c h TRP 29 N 1.25 0.27 -0.53 0.91 7.01 -1.89 -2.61 115.95 120.36 1t8c h TRP 29 Ca -0.42 -0.03 0.14 0.00 2.11 0.00 0.00 58.89 60.69 1t8c h TRP 29 Cb 1.29 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 28.25 1t8c h TRP 29 CO 1.12 0.38 0.38 -0.39 -2.79 0.00 0.00 178.44 177.13 1t8c h VAL 30 N 0.09 0.78 -0.04 2.65 -1.51 -1.98 0.14 116.25 116.38 1t8c h VAL 30 Ca 0.05 -0.04 -0.14 0.00 -1.23 0.00 0.00 66.70 65.34 1t8c h VAL 30 Cb 0.24 0.66 -0.01 0.00 -2.13 0.00 0.00 31.29 30.05 1t8c h VAL 30 CO -0.00 0.02 -0.62 0.45 -1.23 0.00 0.00 177.57 176.19 1t8c h HIS 31 N 0.11 0.21 -0.04 5.19 3.86 -1.88 -2.17 115.15 120.43 1t8c h HIS 31 Ca 0.25 -0.08 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1t8c h HIS 31 Cb 0.86 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.30 1t8c h HIS 31 CO -0.00 0.73 -0.06 0.00 0.86 0.00 0.00 177.93 179.46 1t8c h ALA 32 N 1.25 0.06 -0.86 2.45 0.00 -0.51 -0.68 119.26 120.97 1t8c h ALA 32 Ca -0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1t8c h ALA 32 Cb 1.11 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 1t8c h ALA 32 CO 0.09 -0.11 0.53 0.07 0.00 0.00 0.00 179.25 179.83 1t8c h ARG 33 N -0.40 1.16 -0.04 0.00 0.11 -1.40 -1.09 114.38 112.71 1t8c h ARG 33 Ca 0.00 -0.10 -0.14 0.00 0.10 0.00 0.00 59.98 59.85 1t8c h ARG 33 Cb 0.62 -0.25 -0.01 0.00 1.11 0.00 0.00 29.97 31.44 1t8c h ARG 33 CO 0.01 0.80 -0.61 -0.92 0.10 0.00 0.00 179.97 179.35 1t8c h TYR 34 N 1.18 0.20 -0.33 4.08 5.03 -1.39 -1.41 116.97 124.33 1t8c h TYR 34 Ca 0.31 -0.08 -0.15 0.00 2.58 0.00 0.00 58.73 61.39 1t8c h TYR 34 Cb -0.07 -0.04 -0.00 0.00 1.55 0.00 0.00 36.73 38.17 1t8c h TYR 34 CO 0.00 0.72 -0.37 0.00 -1.32 0.00 0.00 178.16 177.20 1t8c h ALA 35 N 1.26 0.50 0.00 1.82 0.00 -0.36 -1.98 119.26 120.49 1t8c h ALA 35 Ca -0.01 -0.44 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 1t8c h ALA 35 Cb 1.10 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1t8c h ALA 35 CO 0.09 0.58 -0.58 0.00 0.00 0.00 0.00 179.25 179.34 1t8c h ASP 37 N 0.00 0.00 -0.98 0.00 1.82 -1.13 -1.02 116.42 115.12 1t8c h ASP 37 Ca -0.01 0.00 0.04 0.00 -0.39 0.00 0.00 57.03 56.68 1t8c h ASP 37 Cb 1.22 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 41.18 1t8c h ASP 37 CO 0.08 0.20 0.64 -0.78 -1.61 0.00 0.00 179.24 177.77 1t8c h ASP 38 N 0.00 1.05 0.00 2.28 3.58 -1.21 -3.44 116.42 118.68 1t8c h ASP 38 Ca -0.00 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1t8c h ASP 38 Cb 0.89 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.71 1t8c h ASP 38 CO 0.03 0.71 0.00 1.15 -2.88 0.00 0.00 179.24 178.25 1t8c n MET 39 N -4.45 0.00 0.00 0.28 0.00 -1.21 -5.08 117.12 106.66 1t8c n MET 39 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.84 1t8c n MET 39 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.34 1t8c n MET 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1t8c n GLU 40 N -0.02 0.00 0.00 3.17 -0.58 -1.02 -5.00 120.64 117.19 1t8c n GLU 40 Ca 0.00 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1t8c n GLU 40 Cb 0.00 -0.52 0.00 0.00 -0.57 0.00 0.00 31.44 30.35 1t8c n GLU 40 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1t8c n GLY 41 N -0.03 -0.23 3.39 0.62 0.00 -0.42 -4.83 105.19 103.70 1t8c n GLY 41 Ca 0.00 0.35 -0.10 0.00 0.00 0.00 0.00 46.02 46.26 1t8c n GLY 41 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1t8c s GLN 42 N 0.43 1.19 -0.33 1.61 0.74 0.31 -4.57 119.66 119.03 1t8c s GLN 42 Ca 0.00 -0.79 -0.29 0.00 0.05 0.00 0.00 55.36 54.33 1t8c s GLN 42 Cb 0.00 0.48 0.00 0.00 1.10 0.00 0.00 33.01 34.59 1t8c s GLN 42 CO 0.00 -0.48 1.40 -1.17 -0.55 0.00 0.00 175.29 174.49 1t8c s LEU 43 N -2.84 3.75 0.00 3.68 2.96 -1.26 0.39 118.68 125.36 1t8c s LEU 43 Ca 0.06 1.12 0.00 0.00 -0.22 0.00 0.00 54.13 55.09 1t8c s LEU 43 Cb 0.01 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.16 1t8c s LEU 43 CO -0.08 -1.26 0.13 1.33 -1.32 0.00 0.00 176.35 175.14 1t8c n VAL 44 N 6.62 0.00 -3.17 1.68 0.24 -1.26 -3.36 118.33 119.08 1t8c n VAL 44 Ca 0.16 0.20 -0.14 0.00 -2.04 0.00 0.00 64.34 62.52 1t8c n VAL 44 Cb 0.47 -0.27 0.07 0.00 -1.47 0.00 0.00 33.84 32.64 1t8c n VAL 44 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1t8c n SER 45 N -1.76 -2.34 -4.39 -1.34 2.88 -1.26 -4.54 113.62 100.87 1t8c n SER 45 Ca 0.00 -0.52 -0.45 0.00 -1.33 0.00 0.00 58.87 56.57 1t8c n SER 45 Cb 0.00 -4.35 -0.02 0.00 -0.75 0.00 0.00 64.21 59.10 1t8c n SER 45 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1t8c n ILE 46 N -3.54 1.56 -0.58 2.46 -0.00 -1.26 -4.79 119.36 113.20 1t8c n ILE 46 Ca -0.23 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.02 1t8c n ILE 46 Cb 0.64 -0.11 0.00 0.00 -0.00 0.00 0.00 39.64 40.16 1t8c n ILE 46 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1t8c n HIS 47 N -0.38 0.00 -4.50 4.28 1.44 -1.26 -4.87 115.22 109.94 1t8c n HIS 47 Ca 0.15 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.53 1t8c n HIS 47 Cb 0.31 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.26 1t8c n HIS 47 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1t8c s SER 48 N -0.04 3.13 0.55 4.39 0.01 -1.26 -4.79 113.70 115.70 1t8c s SER 48 Ca 0.00 -0.61 0.39 0.00 1.31 0.00 0.00 55.95 57.04 1t8c s SER 48 Cb 0.00 -1.46 1.56 0.00 0.21 0.00 0.00 66.02 66.33 1t8c s SER 48 CO 0.00 0.06 1.72 -0.65 0.41 0.00 0.00 173.24 174.78 1t8c h PRO 49 N 7.51 0.00 -0.06 12.44 0.11 -1.98 0.46 132.00 150.48 1t8c h PRO 49 Ca -0.37 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.66 1t8c h PRO 49 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1t8c h PRO 49 CO 0.58 0.00 -0.28 1.49 -0.21 0.00 0.00 178.00 179.58 1t8c h GLU 50 N 0.00 0.29 -0.49 1.05 4.81 -1.97 -1.30 114.58 116.97 1t8c h GLU 50 Ca 0.64 -0.23 -0.05 0.00 -0.13 0.00 0.00 59.36 59.58 1t8c h GLU 50 Cb 2.64 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 32.05 1t8c h GLU 50 CO -0.01 0.88 0.09 0.93 -0.73 0.00 0.00 179.01 180.18 1t8c h GLU 51 N -0.23 0.80 -0.63 1.92 5.08 -0.60 0.47 114.58 121.41 1t8c h GLU 51 Ca -0.02 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.04 1t8c h GLU 51 Cb 0.93 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1t8c h GLU 51 CO 0.06 0.80 0.02 -0.56 -1.00 0.00 0.00 179.01 178.33 1t8c h GLN 52 N 0.68 1.09 -0.21 2.33 -0.00 -1.11 -2.21 115.11 115.69 1t8c h GLN 52 Ca 0.15 -0.34 -0.11 0.00 -0.00 0.00 0.00 58.65 58.35 1t8c h GLN 52 Cb 0.37 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.48 27.73 1t8c h GLN 52 CO 0.01 1.05 -0.36 0.22 -0.00 0.00 0.00 178.83 179.74 1t8c h ASP 53 N 1.00 0.47 0.12 0.06 3.58 -0.98 0.41 116.42 121.08 1t8c h ASP 53 Ca 0.18 -0.19 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 1t8c h ASP 53 Cb 0.54 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.46 1t8c h ASP 53 CO 0.03 0.79 -0.07 -0.26 -2.88 0.00 0.00 179.24 176.85 1t8c h PHE 54 N 0.38 -0.19 -0.04 0.28 0.04 0.44 0.25 116.94 118.10 1t8c h PHE 54 Ca 0.04 -0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.63 1t8c h PHE 54 Cb 0.81 0.07 -0.01 0.00 2.20 0.00 0.00 35.95 39.02 1t8c h PHE 54 CO 0.03 -0.12 -0.77 1.37 -0.60 0.00 0.00 178.31 178.22 1t8c h LEU 55 N -0.19 0.35 -0.76 1.54 8.10 -1.38 -0.84 115.31 122.13 1t8c h LEU 55 Ca -0.01 -0.25 0.00 0.00 0.11 0.00 0.00 57.88 57.74 1t8c h LEU 55 Cb 0.16 -0.11 -0.04 0.00 -0.44 0.00 0.00 40.66 40.23 1t8c h LEU 55 CO 0.01 0.99 0.49 0.74 -4.11 0.00 0.00 178.44 176.57 1t8c h THR 56 N 0.19 1.20 -0.08 0.15 2.02 -0.63 0.58 112.91 116.34 1t8c h THR 56 Ca -0.03 -0.40 -0.19 0.00 0.77 0.00 0.00 66.41 66.56 1t8c h THR 56 Cb 1.35 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1t8c h THR 56 CO 0.12 0.20 -0.75 0.11 0.37 0.00 0.00 175.52 175.58 1t8c h LYS 57 N 1.04 0.44 -0.26 6.66 1.79 -0.45 -2.98 116.57 122.81 1t8c h LYS 57 Ca 0.28 -0.37 -0.05 0.00 -2.18 0.00 0.00 60.65 58.33 1t8c h LYS 57 Cb -0.09 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 1t8c h LYS 57 CO -0.06 1.01 -0.04 1.25 -1.08 0.00 0.00 179.45 180.53 1t8c h HIS 58 N 0.30 0.42 -2.93 -1.35 2.76 -0.13 -3.38 115.15 110.83 1t8c h HIS 58 Ca -0.04 -0.04 -0.60 0.00 -2.20 0.00 0.00 60.37 57.50 1t8c h HIS 58 Cb 1.34 -0.12 -0.12 0.00 1.55 0.00 0.00 27.41 30.06 1t8c h HIS 58 CO 0.05 0.46 0.69 0.00 -1.30 0.00 0.00 177.93 177.83 1t8c s ALA 59 N -4.89 3.06 -1.07 5.26 0.00 0.19 -4.97 121.76 119.35 1t8c s ALA 59 Ca -0.07 -1.37 -0.22 0.00 0.00 0.00 0.00 51.96 50.31 1t8c s ALA 59 Cb 0.15 -3.89 0.05 0.00 0.00 0.00 0.00 23.12 19.44 1t8c s ALA 59 CO 0.75 -2.66 1.50 -1.12 0.00 0.00 0.00 175.76 174.23 1t8c s SER 60 N 3.22 6.57 -1.35 0.00 0.01 -1.26 -4.09 113.70 116.79 1t8c s SER 60 Ca 0.30 -1.65 -0.00 0.00 1.31 0.00 0.00 55.95 55.91 1t8c s SER 60 Cb -0.12 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.54 1t8c s SER 60 CO 0.17 -1.44 0.03 1.41 0.41 0.00 0.00 173.24 173.82 1t8c n HIS 61 N 8.77 -1.29 -0.03 2.43 8.25 -1.26 -4.80 115.22 127.29 1t8c n HIS 61 Ca 0.36 0.03 -0.04 0.00 -0.26 0.00 0.00 57.72 57.81 1t8c n HIS 61 Cb 0.50 -3.28 -0.03 0.00 1.12 0.00 0.00 29.99 28.31 1t8c n HIS 61 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1t8c n THR 62 N -3.67 0.33 0.00 1.59 -2.24 -1.26 -4.97 114.28 104.05 1t8c n THR 62 Ca -0.18 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1t8c n THR 62 Cb 0.64 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 1t8c n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t8c n GLY 63 N 3.16 -1.59 3.55 3.38 0.00 -1.26 -0.80 105.19 111.63 1t8c n GLY 63 Ca -0.10 -1.37 -0.24 0.00 0.00 0.00 0.00 46.02 44.30 1t8c n GLY 63 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t8c s SER 64 N -2.02 3.90 -0.16 1.61 0.15 -1.21 -1.63 113.70 114.34 1t8c s SER 64 Ca 0.00 -1.01 -0.06 0.00 0.70 0.00 0.00 55.95 55.58 1t8c s SER 64 Cb 0.00 -0.44 -0.04 0.00 -1.71 0.00 0.00 66.02 63.83 1t8c s SER 64 CO 0.00 -0.09 0.03 0.26 1.20 0.00 0.00 173.24 174.64 1t8c s TRP 65 N -2.51 3.21 0.37 3.44 0.51 -1.17 -2.97 118.94 119.81 1t8c s TRP 65 Ca 0.32 0.04 0.08 0.00 -2.12 0.00 0.00 56.10 54.42 1t8c s TRP 65 Cb -0.02 -1.99 -0.04 0.00 -0.81 0.00 0.00 33.47 30.61 1t8c s TRP 65 CO 0.17 0.20 0.23 0.96 -0.51 0.00 0.00 176.95 178.00 1t8c s ILE 66 N 0.06 2.95 -0.92 2.03 -4.36 -1.26 -4.23 121.20 115.48 1t8c s ILE 66 Ca 0.04 -1.55 -0.08 0.00 -0.26 0.00 0.00 60.65 58.80 1t8c s ILE 66 Cb -0.13 -3.03 -0.15 0.00 1.25 0.00 0.00 42.46 40.41 1t8c s ILE 66 CO 0.01 -0.12 3.04 0.61 0.24 0.00 0.00 174.94 178.73 1t8c n GLY 67 N -1.29 3.58 3.10 6.27 0.00 -1.21 -4.63 105.19 111.00 1t8c n GLY 67 Ca -0.01 -1.28 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 1t8c n GLY 67 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1t8c s LEU 68 N 0.10 1.87 -0.05 0.99 1.98 -1.26 -1.56 118.68 120.74 1t8c s LEU 68 Ca 0.64 -0.49 -0.02 0.00 -2.89 0.00 0.00 54.13 51.36 1t8c s LEU 68 Cb 0.22 -1.22 0.03 0.00 0.66 0.00 0.00 46.19 45.88 1t8c s LEU 68 CO -0.03 0.04 0.09 -0.60 -1.89 0.00 0.00 176.35 173.95 1t8c s ARG 69 N 0.92 -0.04 0.75 1.98 3.52 0.12 -3.57 118.95 122.62 1t8c s ARG 69 Ca -0.07 0.40 -0.14 0.00 -0.13 0.00 0.00 55.73 55.79 1t8c s ARG 69 Cb -0.15 -0.39 0.05 0.00 -1.56 0.00 0.00 34.95 32.89 1t8c s ARG 69 CO -0.02 -0.29 1.17 -0.80 -0.81 0.00 0.00 175.30 174.55 1t8c s ASN 70 N 1.99 4.22 0.44 -2.12 -0.87 -0.66 -1.36 114.94 116.58 1t8c s ASN 70 Ca 0.02 2.22 0.24 0.00 -1.57 0.00 0.00 52.86 53.77 1t8c s ASN 70 Cb -0.12 -2.57 0.70 0.00 -0.02 0.00 0.00 41.25 39.24 1t8c s ASN 70 CO -0.04 -2.24 1.73 -0.07 -2.57 0.00 0.00 177.10 173.91 1t8c h LEU 71 N -0.51 0.00 0.00 0.60 3.38 -1.73 -3.44 115.31 113.60 1t8c h LEU 71 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1t8c h LEU 71 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1t8c h LEU 71 CO 0.49 0.16 0.00 -0.67 0.09 0.00 0.00 178.44 178.52 1t8c n ASP 72 N -3.21 0.00 0.00 -0.43 2.03 -1.26 -5.04 116.55 108.63 1t8c n ASP 72 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 1t8c n ASP 72 Cb 0.49 0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1t8c n ASP 72 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1t8c n LEU 73 N -1.40 0.00 -1.19 -2.67 4.77 -1.26 -4.82 117.00 110.43 1t8c n LEU 73 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 1t8c n LEU 73 Cb 0.00 0.04 0.26 0.00 -2.33 0.00 0.00 43.42 41.39 1t8c n LEU 73 CO 0.00 -0.08 0.73 2.29 -1.33 0.00 0.00 177.39 179.00 1t8c n LYS 74 N -1.23 2.60 0.00 3.23 2.85 -1.25 -4.35 118.16 120.01 1t8c n LYS 74 Ca 0.00 -2.43 0.00 0.00 -1.05 0.00 0.00 58.31 54.83 1t8c n LYS 74 Cb 0.00 -1.51 0.00 0.00 -0.65 0.00 0.00 35.03 32.87 1t8c n LYS 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1t8c n GLY 75 N 1.47 -1.14 3.12 2.58 0.00 -1.26 -5.00 105.19 104.96 1t8c n GLY 75 Ca 0.21 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 1t8c n GLY 75 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t8c s GLU 76 N 0.00 1.50 -0.00 1.61 2.02 -1.26 -5.02 118.70 117.55 1t8c s GLU 76 Ca 0.00 -0.56 -0.30 0.00 0.02 0.00 0.00 54.97 54.13 1t8c s GLU 76 Cb 0.00 -1.37 -0.04 0.00 0.10 0.00 0.00 34.13 32.82 1t8c s GLU 76 CO 0.00 0.27 1.20 -0.06 0.02 0.00 0.00 175.26 176.69 1t8c s PHE 77 N -0.11 3.29 0.00 1.61 0.08 -1.26 -1.95 117.98 119.63 1t8c s PHE 77 Ca 0.00 1.24 0.08 0.00 0.12 0.00 0.00 56.93 58.37 1t8c s PHE 77 Cb -0.09 -3.42 -0.02 0.00 -0.57 0.00 0.00 43.02 38.91 1t8c s PHE 77 CO 0.01 -1.32 -0.24 0.42 -0.10 0.00 0.00 175.22 173.99 1t8c s ILE 78 N 1.72 1.92 0.53 0.64 1.01 -0.46 -2.81 121.20 123.74 1t8c s ILE 78 Ca 0.57 -1.12 -0.19 0.00 0.00 0.00 0.00 60.65 59.91 1t8c s ILE 78 Cb -0.27 -1.61 -0.07 0.00 0.01 0.00 0.00 42.46 40.52 1t8c s ILE 78 CO 0.25 0.46 1.05 0.26 0.00 0.00 0.00 174.94 176.97 1t8c s TRP 79 N -0.64 2.98 0.58 3.97 0.52 -0.06 0.13 118.94 126.42 1t8c s TRP 79 Ca 0.10 1.55 0.28 0.00 0.02 0.00 0.00 56.10 58.04 1t8c s TRP 79 Cb -0.09 -3.05 1.72 0.00 -1.15 0.00 0.00 33.47 30.90 1t8c s TRP 79 CO 0.00 -0.96 2.21 -0.24 0.02 0.00 0.00 176.95 177.98 1t8c h VAL 80 N 1.13 0.57 0.00 4.03 3.04 -1.61 0.28 116.25 123.70 1t8c h VAL 80 Ca -0.49 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1t8c h VAL 80 Cb 1.22 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 31.47 1t8c h VAL 80 CO 0.58 0.00 0.00 -0.67 -1.01 0.00 0.00 177.57 176.47 1t8c n ASP 81 N -3.93 0.00 -0.44 3.17 2.03 -1.26 -4.88 116.55 111.25 1t8c n ASP 81 Ca -0.02 -0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.06 1t8c n ASP 81 Cb 0.14 -0.23 0.00 0.00 -0.72 0.00 0.00 41.12 40.31 1t8c n ASP 81 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1t8c n GLY 82 N 0.90 0.88 2.73 0.27 0.00 0.99 -5.09 105.19 105.87 1t8c n GLY 82 Ca 0.14 -0.47 -0.19 0.00 0.00 0.00 0.00 46.02 45.50 1t8c n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t8c s SER 83 N -2.69 0.87 0.59 1.61 0.01 -1.22 -4.91 113.70 107.96 1t8c s SER 83 Ca 0.00 0.03 -0.19 0.00 1.31 0.00 0.00 55.95 57.10 1t8c s SER 83 Cb 0.00 -0.18 -0.05 0.00 0.21 0.00 0.00 66.02 66.00 1t8c s SER 83 CO 0.00 -0.19 1.02 0.00 0.41 0.00 0.00 173.24 174.47 1t8c n HIS 84 N 4.86 1.02 -0.77 2.43 1.44 -1.26 -0.88 115.22 122.06 1t8c n HIS 84 Ca -0.13 0.44 -0.31 0.00 -2.01 0.00 0.00 57.72 55.71 1t8c n HIS 84 Cb 0.50 -2.17 0.16 0.00 0.12 0.00 0.00 29.99 28.60 1t8c n HIS 84 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1t8c s VAL 85 N -1.48 2.10 0.08 0.61 1.01 -1.12 -4.80 120.40 116.80 1t8c s VAL 85 Ca 0.75 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1t8c s VAL 85 Cb -0.42 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 33.84 1t8c s VAL 85 CO 0.47 -0.04 0.00 0.47 0.00 0.00 0.00 175.10 176.00 1t8c n ASP 86 N -4.09 0.50 -0.05 3.32 9.92 -1.26 -4.94 116.55 119.94 1t8c n ASP 86 Ca 0.12 0.13 -0.22 0.00 -0.53 0.00 0.00 54.79 54.29 1t8c n ASP 86 Cb 0.52 -0.11 -0.13 0.00 -0.64 0.00 0.00 41.12 40.77 1t8c n ASP 86 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1t8c n TYR 87 N -3.09 1.02 -1.47 1.24 4.02 -1.26 -5.10 117.16 112.53 1t8c n TYR 87 Ca 0.00 0.30 0.18 0.00 -0.01 0.00 0.00 57.90 58.37 1t8c n TYR 87 Cb 0.00 -1.12 -0.09 0.00 -0.02 0.00 0.00 39.34 38.11 1t8c n TYR 87 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1t8c n SER 88 N -3.87 -8.12 0.00 7.72 3.41 -1.26 -4.97 113.62 106.53 1t8c n SER 88 Ca -0.34 1.36 0.00 0.00 -0.26 0.00 0.00 58.87 59.63 1t8c n SER 88 Cb 0.90 -4.96 0.00 0.00 -0.26 0.00 0.00 64.21 59.88 1t8c n SER 88 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1t8c n ASN 89 N -4.38 0.00 -3.59 4.04 3.02 -1.26 -5.05 115.26 108.04 1t8c n ASN 89 Ca -0.08 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.20 1t8c n ASN 89 Cb 0.69 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.72 1t8c n ASN 89 CO 0.00 0.00 0.00 -2.67 -2.62 0.00 0.00 177.26 171.97 1t8c n TRP 90 N -0.01 0.26 -1.41 3.10 4.27 -1.23 -3.83 117.44 118.60 1t8c n TRP 90 Ca 0.00 0.18 0.00 0.00 -3.89 0.00 0.00 57.50 53.79 1t8c n TRP 90 Cb 0.00 -1.28 0.00 0.00 -1.36 0.00 0.00 31.31 28.67 1t8c n TRP 90 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1t8c n ALA 91 N 6.74 -1.81 0.33 -1.67 0.00 0.68 -4.57 120.51 120.21 1t8c n ALA 91 Ca 0.53 0.43 0.15 0.00 0.00 0.00 0.00 53.44 54.56 1t8c n ALA 91 Cb 0.06 -1.37 0.64 0.00 0.00 0.00 0.00 19.45 18.78 1t8c n ALA 91 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1t8c h PRO 92 N 0.17 0.00 0.00 0.00 0.13 -1.89 -3.44 132.00 126.96 1t8c h PRO 92 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1t8c h PRO 92 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1t8c h PRO 92 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 1t8c n GLY 93 N -0.22 0.22 3.25 1.56 0.00 -1.26 -5.17 105.19 103.57 1t8c n GLY 93 Ca 0.01 0.20 0.03 0.00 0.00 0.00 0.00 46.02 46.26 1t8c n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1t8c s GLU 94 N 0.00 0.56 -0.34 1.61 2.56 -1.26 -5.12 118.70 116.70 1t8c s GLU 94 Ca 0.00 1.08 -0.29 0.00 0.00 0.00 0.00 54.97 55.77 1t8c s GLU 94 Cb 0.00 0.61 -0.01 0.00 2.00 0.00 0.00 34.13 36.73 1t8c s GLU 94 CO 0.00 -0.52 1.68 -1.25 -0.56 0.00 0.00 175.26 174.61 1t8c s PRO 95 N 2.87 3.44 0.11 4.30 0.04 -1.26 -4.97 135.00 139.53 1t8c s PRO 95 Ca 0.15 1.32 -0.31 0.00 0.04 0.00 0.00 61.00 62.20 1t8c s PRO 95 Cb -0.14 -4.14 -0.07 0.00 0.04 0.00 0.00 34.50 30.19 1t8c s PRO 95 CO -0.20 -1.72 1.27 0.95 0.04 0.00 0.00 177.00 177.34 1t8c s THR 96 N 6.33 3.64 -0.90 1.26 -4.23 -1.26 -4.92 115.64 115.56 1t8c s THR 96 Ca 0.74 1.22 0.16 0.00 -1.18 0.00 0.00 61.69 62.63 1t8c s THR 96 Cb -0.20 -3.78 0.57 0.00 1.34 0.00 0.00 72.50 70.43 1t8c s THR 96 CO 0.33 0.12 1.49 -1.54 -0.54 0.00 0.00 174.62 174.48 1t8c n SER 97 N 3.60 4.10 -2.78 3.99 3.41 -1.26 -4.43 113.62 120.24 1t8c n SER 97 Ca 0.09 -2.44 -0.02 0.00 -0.26 0.00 0.00 58.87 56.24 1t8c n SER 97 Cb 0.44 -0.48 0.06 0.00 -0.26 0.00 0.00 64.21 63.97 1t8c n SER 97 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1t8c n ARG 98 N 0.64 1.57 0.00 4.33 1.85 -1.26 -4.97 116.66 118.82 1t8c n ARG 98 Ca 0.21 -3.09 0.00 0.00 -1.00 0.00 0.00 57.85 53.98 1t8c n ARG 98 Cb 0.77 -1.21 0.00 0.00 -1.05 0.00 0.00 32.46 30.97 1t8c n ARG 98 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1t8c n SER 99 N -0.65 0.00 -3.71 2.89 7.64 -1.26 -4.97 113.62 113.56 1t8c n SER 99 Ca 0.03 0.29 -0.24 0.00 1.01 0.00 0.00 58.87 59.97 1t8c n SER 99 Cb 0.82 -0.31 0.05 0.00 -1.01 0.00 0.00 64.21 63.75 1t8c n SER 99 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1t8c n GLN 100 N -1.46 -5.88 0.00 1.43 7.27 -1.26 -4.72 117.38 112.76 1t8c n GLN 100 Ca 0.00 0.68 0.00 0.00 0.07 0.00 0.00 57.00 57.75 1t8c n GLN 100 Cb 0.00 -5.50 0.00 0.00 2.41 0.00 0.00 30.24 27.15 1t8c n GLN 100 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1t8c n GLY 101 N -1.62 -1.44 2.61 1.69 0.00 -1.26 -4.99 105.19 100.19 1t8c n GLY 101 Ca -0.14 0.75 -0.04 0.00 0.00 0.00 0.00 46.02 46.59 1t8c n GLY 101 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1t8c n GLU 102 N 0.00 -4.18 0.00 1.61 1.02 -1.26 -3.91 120.64 113.93 1t8c n GLU 102 Ca 0.00 3.20 0.00 0.00 -0.02 0.00 0.00 57.16 60.34 1t8c n GLU 102 Cb 0.00 -5.13 0.00 0.00 -0.02 0.00 0.00 31.44 26.29 1t8c n GLU 102 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1t8c n ASP 103 N 1.34 0.60 -3.84 1.62 2.03 -0.53 -4.13 116.55 113.64 1t8c n ASP 103 Ca -0.28 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 54.91 1t8c n ASP 103 Cb 0.43 0.10 -0.11 0.00 -0.72 0.00 0.00 41.12 40.82 1t8c n ASP 103 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1t8c s VAL 105 N -0.59 4.66 0.38 0.00 1.01 -1.23 -2.62 120.40 122.00 1t8c s VAL 105 Ca -0.07 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 61.89 1t8c s VAL 105 Cb -0.04 -3.02 -0.07 0.00 0.00 0.00 0.00 36.38 33.26 1t8c s VAL 105 CO 0.01 0.57 0.01 0.00 0.00 0.00 0.00 175.10 175.68 1t8c s MET 106 N -0.53 1.98 -0.08 2.72 0.23 -0.87 -4.11 119.30 118.65 1t8c s MET 106 Ca 0.10 -1.95 0.03 0.00 -1.03 0.00 0.00 55.69 52.84 1t8c s MET 106 Cb -0.12 -1.76 0.01 0.00 -1.53 0.00 0.00 34.83 31.42 1t8c s MET 106 CO 0.02 0.03 -0.18 1.41 -2.03 0.00 0.00 175.02 174.27 1t8c s MET 107 N -3.71 2.26 0.35 3.16 -2.45 -1.16 -0.02 119.30 117.73 1t8c s MET 107 Ca 0.35 -0.63 0.08 0.00 -1.25 0.00 0.00 55.69 54.24 1t8c s MET 107 Cb 0.05 -1.79 -0.03 0.00 1.25 0.00 0.00 34.83 34.30 1t8c s MET 107 CO 0.19 0.12 0.23 0.50 1.05 0.00 0.00 175.02 177.10 1t8c s ARG 108 N 0.45 2.52 0.24 4.11 3.00 -0.61 -3.32 118.95 125.34 1t8c s ARG 108 Ca -0.15 -1.46 0.20 0.00 -1.00 0.00 0.00 55.73 53.31 1t8c s ARG 108 Cb -0.16 -2.30 0.93 0.00 0.00 0.00 0.00 34.95 33.42 1t8c s ARG 108 CO 0.06 0.06 1.60 0.41 0.00 0.00 0.00 175.30 177.43 1t8c n GLY 109 N -1.28 -1.01 0.41 8.12 0.00 -1.26 -2.58 105.19 107.59 1t8c n GLY 109 Ca -0.02 0.11 0.22 0.00 0.00 0.00 0.00 46.02 46.33 1t8c n GLY 109 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1t8c h SER 110 N 0.00 0.14 0.00 1.61 0.02 -1.94 -3.45 113.55 109.93 1t8c h SER 110 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1t8c h SER 110 Cb 0.17 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1t8c h SER 110 CO 0.00 0.06 0.00 0.61 -1.14 0.00 0.00 176.83 176.36 1t8c n GLY 111 N -1.62 1.92 0.00 -3.77 0.00 -1.07 -5.12 105.19 95.54 1t8c n GLY 111 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1t8c n GLY 111 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1t8c n ARG 112 N -0.17 0.00 -4.07 1.61 -4.01 -1.24 -4.80 116.66 103.97 1t8c n ARG 112 Ca 0.00 0.00 -0.22 0.00 -1.04 0.00 0.00 57.85 56.59 1t8c n ARG 112 Cb 0.00 0.00 -0.05 0.00 -3.04 0.00 0.00 32.46 29.37 1t8c n ARG 112 CO 0.00 0.00 0.00 -1.58 -3.04 0.00 0.00 177.63 173.01 1t8c s TRP 113 N -5.20 2.92 -0.10 2.89 0.51 -1.25 -1.57 118.94 117.14 1t8c s TRP 113 Ca 0.00 -0.22 -0.01 0.00 -2.12 0.00 0.00 56.10 53.75 1t8c s TRP 113 Cb 0.00 -1.50 0.03 0.00 -0.81 0.00 0.00 33.47 31.19 1t8c s TRP 113 CO 0.00 0.43 -0.04 -0.80 -0.51 0.00 0.00 176.95 176.03 1t8c s ASN 114 N -3.85 1.93 -0.15 2.95 0.01 0.97 -0.23 114.94 116.57 1t8c s ASN 114 Ca 0.35 -0.22 -0.26 0.00 -0.71 0.00 0.00 52.86 52.02 1t8c s ASN 114 Cb -0.06 -0.66 -0.01 0.00 0.41 0.00 0.00 41.25 40.93 1t8c s ASN 114 CO 0.24 -0.16 0.88 -0.62 -1.51 0.00 0.00 177.10 175.94 1t8c s ASP 115 N 1.83 7.04 0.16 -1.22 2.15 -1.26 -2.04 116.67 123.33 1t8c s ASP 115 Ca 0.05 1.28 -0.19 0.00 0.43 0.00 0.00 52.55 54.12 1t8c s ASP 115 Cb -0.13 -2.48 0.04 0.00 -0.30 0.00 0.00 42.92 40.06 1t8c s ASP 115 CO -0.07 -0.41 0.51 0.00 -0.17 0.00 0.00 175.17 175.03 1t8c s ALA 116 N 2.11 -1.16 0.00 3.66 0.00 -1.08 -4.89 121.76 120.41 1t8c s ALA 116 Ca 0.41 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1t8c s ALA 116 Cb -0.17 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.76 1t8c s ALA 116 CO 0.14 -0.75 0.60 0.34 0.00 0.00 0.00 175.76 176.09 1t8c n PHE 117 N -0.32 0.00 0.00 0.00 7.35 -1.26 -1.74 117.46 121.49 1t8c n PHE 117 Ca -0.14 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.55 1t8c n PHE 117 Cb 0.64 -0.10 0.00 0.00 0.35 0.00 0.00 39.48 40.37 1t8c n PHE 117 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1t8c n ASP 119 N 0.00 0.74 -4.61 0.00 5.75 -1.26 -4.83 116.55 112.34 1t8c n ASP 119 Ca 0.00 -0.60 -0.43 0.00 -0.01 0.00 0.00 54.79 53.75 1t8c n ASP 119 Cb 0.00 0.67 -0.03 0.00 -1.03 0.00 0.00 41.12 40.74 1t8c n ASP 119 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1t8c s ARG 120 N -3.02 3.43 -0.82 0.11 1.81 -1.26 -4.92 118.95 114.28 1t8c s ARG 120 Ca 0.09 1.93 -0.20 0.00 -1.72 0.00 0.00 55.73 55.82 1t8c s ARG 120 Cb 0.16 -4.25 0.11 0.00 -0.45 0.00 0.00 34.95 30.52 1t8c s ARG 120 CO 0.79 -1.75 1.06 0.15 -0.68 0.00 0.00 175.30 174.87 1t8c s LYS 121 N 5.65 3.40 0.00 3.54 3.01 -1.26 -4.87 119.74 129.21 1t8c s LYS 121 Ca 0.90 -1.41 0.00 0.00 -1.01 0.00 0.00 55.97 54.45 1t8c s LYS 121 Cb -0.31 -4.66 0.00 0.00 -1.01 0.00 0.00 37.83 31.85 1t8c s LYS 121 CO 0.35 -1.79 0.00 1.28 0.51 0.00 0.00 175.35 175.70 1t8c n LEU 122 N 6.98 0.00 -0.95 3.17 4.32 -1.26 -5.00 117.00 124.26 1t8c n LEU 122 Ca 0.13 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 56.06 1t8c n LEU 122 Cb 0.47 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.21 1t8c n LEU 122 CO 0.56 -0.15 0.34 0.61 -1.22 0.00 0.00 177.39 177.53 1t8c n GLY 123 N 5.00 0.54 3.02 -0.72 0.00 0.02 -4.21 105.19 108.84 1t8c n GLY 123 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1t8c n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t8c s ALA 124 N 0.00 -0.49 -0.49 4.61 0.00 -0.65 -1.53 121.76 123.22 1t8c s ALA 124 Ca 0.00 0.91 -0.17 0.00 0.00 0.00 0.00 51.96 52.70 1t8c s ALA 124 Cb 0.00 -0.58 0.07 0.00 0.00 0.00 0.00 23.12 22.61 1t8c s ALA 124 CO 0.00 -0.18 0.47 -1.58 0.00 0.00 0.00 175.76 174.46 1t8c s TRP 125 N 1.19 3.19 -0.14 0.00 0.52 -0.07 -3.05 118.94 120.58 1t8c s TRP 125 Ca -0.09 -0.84 -0.01 0.00 0.02 0.00 0.00 56.10 55.18 1t8c s TRP 125 Cb -0.10 -3.31 -0.02 0.00 -1.15 0.00 0.00 33.47 28.89 1t8c s TRP 125 CO -0.08 -0.88 -0.10 0.08 0.02 0.00 0.00 176.95 175.99 1t8c s VAL 126 N 1.93 3.29 0.17 4.03 1.01 -1.26 -0.06 120.40 129.51 1t8c s VAL 126 Ca 0.07 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1t8c s VAL 126 Cb -0.23 -2.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1t8c s VAL 126 CO 0.08 0.51 0.05 0.00 0.00 0.00 0.00 175.10 175.74 1t8c s ASP 128 N -3.15 2.17 0.11 0.00 -4.77 0.16 0.89 116.67 112.09 1t8c s ASP 128 Ca 0.27 -0.44 -0.22 0.00 -3.30 0.00 0.00 52.55 48.86 1t8c s ASP 128 Cb 0.07 -0.19 0.06 0.00 -1.09 0.00 0.00 42.92 41.76 1t8c s ASP 128 CO 0.05 0.15 0.53 0.00 0.70 0.00 0.00 175.17 176.61 1t8c s ARG 129 N -0.93 1.15 0.23 2.11 1.70 0.05 0.11 118.95 123.37 1t8c s ARG 129 Ca 0.06 -0.42 -0.30 0.00 -0.47 0.00 0.00 55.73 54.60 1t8c s ARG 129 Cb -0.08 0.52 -0.09 0.00 -0.57 0.00 0.00 34.95 34.73 1t8c s ARG 129 CO 0.01 -0.46 1.27 -0.51 -1.08 0.00 0.00 175.30 174.53 1t8c s LEU 130 N -2.47 4.44 0.00 -1.89 2.01 -1.26 0.13 118.68 119.63 1t8c s LEU 130 Ca -0.01 2.42 0.00 0.00 0.01 0.00 0.00 54.13 56.55 1t8c s LEU 130 Cb -0.00 -3.62 0.00 0.00 0.01 0.00 0.00 46.19 42.58 1t8c s LEU 130 CO -0.08 -0.47 0.00 0.00 1.01 0.00 0.00 176.35 176.81 1t8c n ALA 131 N 2.11 0.00 -2.00 4.21 0.00 -1.19 -4.74 120.51 118.91 1t8c n ALA 131 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1t8c n ALA 131 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1t8c n ALA 131 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1t8c n THR 132 N -2.41 0.00 -3.33 0.00 -2.24 -1.26 -4.65 114.28 100.38 1t8c n THR 132 Ca 0.00 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.54 1t8c n THR 132 Cb 0.00 -1.29 0.04 0.00 -2.10 0.00 0.00 70.33 66.98 1t8c n THR 132 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t8c s THR 134 N -3.20 4.74 -0.02 0.00 -4.23 -1.26 -5.03 115.64 106.63 1t8c s THR 134 Ca 0.44 1.37 -0.30 0.00 -1.18 0.00 0.00 61.69 62.02 1t8c s THR 134 Cb -0.20 -3.98 -0.05 0.00 1.34 0.00 0.00 72.50 69.60 1t8c s THR 134 CO 0.54 0.47 1.47 -2.16 -0.54 0.00 0.00 174.62 174.40 1t8c s PRO 135 N -0.63 4.25 -0.25 3.99 0.04 -1.26 -4.92 135.00 136.21 1t8c s PRO 135 Ca 0.32 2.03 -0.32 0.00 0.04 0.00 0.00 61.00 63.07 1t8c s PRO 135 Cb -0.20 -3.68 -0.08 0.00 0.04 0.00 0.00 34.50 30.58 1t8c s PRO 135 CO 0.20 -0.66 2.17 -2.30 0.04 0.00 0.00 177.00 176.45 1t8c n PRO 136 N 5.87 1.67 -0.01 0.56 -0.02 -1.26 -4.84 135.00 136.97 1t8c n PRO 136 Ca 0.14 0.48 -0.15 0.00 -2.02 0.00 0.00 63.50 61.95 1t8c n PRO 136 Cb 0.43 -2.87 -0.14 0.00 -0.02 0.00 0.00 33.50 30.90 1t8c n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1t8c n ALA 137 N 10.36 1.19 0.21 3.55 0.00 -1.26 -4.93 120.51 129.62 1t8c n ALA 137 Ca 0.33 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1t8c n ALA 137 Cb 0.35 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.05 1t8c n ALA 137 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1t8c n SER 138 N -3.26 -2.81 -4.64 0.00 3.41 -1.26 -5.08 113.62 99.98 1t8c n SER 138 Ca -0.25 0.77 -0.43 0.00 -0.26 0.00 0.00 58.87 58.70 1t8c n SER 138 Cb 1.05 2.69 -0.02 0.00 -0.26 0.00 0.00 64.21 67.66 1t8c n SER 138 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1t8c s GLU 139 N -1.96 3.88 -0.03 4.33 2.12 -1.26 -4.97 118.70 120.81 1t8c s GLU 139 Ca 0.00 1.69 -0.30 0.00 0.36 0.00 0.00 54.97 56.72 1t8c s GLU 139 Cb 0.00 -4.00 -0.03 0.00 0.26 0.00 0.00 34.13 30.36 1t8c s GLU 139 CO 0.00 -1.19 1.15 0.20 -0.54 0.00 0.00 175.26 174.89 1t8c s GLY 140 N 3.86 2.28 0.01 -1.50 0.00 -1.26 -4.86 107.32 105.85 1t8c s GLY 140 Ca 0.69 0.63 -0.30 0.00 0.00 0.00 0.00 44.72 45.74 1t8c s GLY 140 CO 0.28 2.09 1.22 -0.56 0.00 0.00 0.00 173.10 176.12 1t8c s SER 141 N 1.29 7.05 -0.32 1.64 0.01 -1.26 -5.00 113.70 117.11 1t8c s SER 141 Ca 0.55 1.95 0.02 0.00 1.31 0.00 0.00 55.95 59.78 1t8c s SER 141 Cb -0.25 -2.57 0.15 0.00 0.21 0.00 0.00 66.02 63.57 1t8c s SER 141 CO 0.24 -0.53 0.39 0.00 0.41 0.00 0.00 173.24 173.74 1t8c s ALA 142 N 1.59 -0.88 0.00 1.44 0.00 -1.26 -5.18 121.76 117.48 1t8c s ALA 142 Ca 0.58 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1t8c s ALA 142 Cb -0.28 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 20.78 1t8c s ALA 142 CO 0.26 -1.91 0.00 -1.91 0.00 0.00 0.00 175.76 172.21