#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 1.84 5.01 0.46 0.00 -1.26 -5.06 105.19 106.18 1t8c n GLY 2 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.43 1t8c n GLY 2 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1t8c n PHE 3 N 0.00 0.00 -1.33 1.61 3.72 -1.26 -4.74 117.46 115.46 1t8c n PHE 3 Ca 0.00 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.05 1t8c n PHE 3 Cb 0.00 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 38.65 1t8c n PHE 3 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1t8c s VAL 4 N 0.00 2.03 0.00 -4.37 -7.23 -1.26 -4.77 120.40 104.79 1t8c s VAL 4 Ca 0.00 0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.18 1t8c s VAL 4 Cb 0.00 -2.62 0.00 0.00 0.56 0.00 0.00 36.38 34.32 1t8c s VAL 4 CO 0.00 -0.01 0.05 0.00 -0.31 0.00 0.00 175.10 174.83 1t8c n ASN 6 N -0.70 -3.80 -0.17 0.00 3.02 -1.24 -4.91 115.26 107.46 1t8c n ASN 6 Ca 0.00 -0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 1t8c n ASN 6 Cb 0.01 -2.31 0.00 0.00 -0.61 0.00 0.00 39.78 36.87 1t8c n ASN 6 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1t8c n THR 7 N -1.51 0.00 -3.76 3.41 5.66 -1.18 -4.46 114.28 112.43 1t8c n THR 7 Ca -0.01 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.65 1t8c n THR 7 Cb 0.51 -0.19 -0.10 0.00 -1.55 0.00 0.00 70.33 69.01 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 6.45 -0.11 0.00 0.00 0.13 -1.78 -3.47 132.00 133.22 1t8c h PRO 9 Ca 0.04 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1t8c h PRO 9 Cb 0.88 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1t8c h PRO 9 CO 0.74 -0.07 0.00 0.39 -0.23 0.00 0.00 178.00 178.83 1t8c n GLU 10 N -3.63 0.00 -0.30 0.86 -0.58 -1.26 -4.88 120.64 110.85 1t8c n GLU 10 Ca -0.01 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 56.86 1t8c n GLU 10 Cb 0.04 0.00 0.38 0.00 -0.57 0.00 0.00 31.44 31.29 1t8c n GLU 10 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1t8c h LYS 11 N 0.00 0.66 -6.97 3.49 1.57 -1.94 -3.41 116.57 109.97 1t8c h LYS 11 Ca 0.00 -0.04 -0.50 0.00 -1.87 0.00 0.00 60.65 58.24 1t8c h LYS 11 Cb 0.00 -0.15 0.04 0.00 0.08 0.00 0.00 32.23 32.21 1t8c h LYS 11 CO 0.00 0.43 0.47 -1.58 -0.57 0.00 0.00 179.45 178.20 1t8c s TRP 12 N -5.70 3.08 -0.05 -1.35 0.52 -1.25 -3.91 118.94 110.28 1t8c s TRP 12 Ca -0.10 1.58 0.00 0.00 0.02 0.00 0.00 56.10 57.60 1t8c s TRP 12 Cb 0.23 -3.30 0.02 0.00 -1.15 0.00 0.00 33.47 29.28 1t8c s TRP 12 CO 0.79 -1.13 -0.02 0.42 0.02 0.00 0.00 176.95 177.03 1t8c s ILE 13 N -1.53 0.43 0.12 2.03 -1.09 -0.58 -4.48 121.20 116.10 1t8c s ILE 13 Ca 0.59 -0.01 0.04 0.00 -2.23 0.00 0.00 60.65 59.05 1t8c s ILE 13 Cb -0.27 -0.51 -0.04 0.00 -1.58 0.00 0.00 42.46 40.06 1t8c s ILE 13 CO 0.34 0.23 0.10 0.21 -1.23 0.00 0.00 174.94 174.58 1t8c s ASN 14 N 1.31 5.46 0.00 3.58 3.84 -1.26 0.11 114.94 127.98 1t8c s ASN 14 Ca -0.05 -0.09 0.00 0.00 0.21 0.00 0.00 52.86 52.93 1t8c s ASN 14 Cb -0.13 -1.43 0.00 0.00 -0.55 0.00 0.00 41.25 39.14 1t8c s ASN 14 CO -0.02 0.12 0.00 0.49 -2.79 0.00 0.00 177.10 174.90 1t8c n PHE 15 N 0.07 0.00 -0.24 0.43 3.01 0.17 -4.95 117.46 115.96 1t8c n PHE 15 Ca -0.09 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.41 1t8c n PHE 15 Cb 0.53 0.00 0.16 0.00 -0.01 0.00 0.00 39.48 40.16 1t8c n PHE 15 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 1t8c h GLN 16 N 0.00 0.33 0.00 -1.08 3.07 -2.04 -3.40 115.11 112.00 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 0.22 0.00 2.89 0.09 0.00 0.00 178.83 182.03 1t8c n ARG 17 N -5.08 0.00 -4.29 0.06 1.85 -1.26 -5.14 116.66 102.80 1t8c n ARG 17 Ca 0.13 0.00 -0.24 0.00 -1.00 0.00 0.00 57.85 56.73 1t8c n ARG 17 Cb 0.40 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.73 1t8c n ARG 17 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 1t8c s LYS 18 N 0.00 2.24 0.32 2.89 -2.85 -1.26 -3.51 119.74 117.57 1t8c s LYS 18 Ca 0.00 -1.37 0.07 0.00 -1.00 0.00 0.00 55.97 53.67 1t8c s LYS 18 Cb 0.00 -2.17 -0.06 0.00 -2.06 0.00 0.00 37.83 33.54 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 -2.94 1.99 -0.43 0.00 1.51 0.30 -0.55 117.35 117.24 1t8c s TYR 20 Ca 0.32 -0.63 -0.17 0.00 -1.01 0.00 0.00 57.07 55.58 1t8c s TYR 20 Cb 0.05 -1.34 0.03 0.00 -0.11 0.00 0.00 41.96 40.59 1t8c s TYR 20 CO 0.14 -0.23 0.41 -0.47 -1.11 0.00 0.00 175.55 174.29 1t8c s TYR 21 N 0.09 3.19 -0.21 2.71 5.04 0.28 -1.53 117.35 126.92 1t8c s TYR 21 Ca -0.07 -0.47 -0.09 0.00 -2.44 0.00 0.00 57.07 54.00 1t8c s TYR 21 Cb -0.13 -2.86 -0.05 0.00 0.35 0.00 0.00 41.96 39.27 1t8c s TYR 21 CO 0.04 -0.69 0.11 -0.06 -1.34 0.00 0.00 175.55 173.61 1t8c s PHE 22 N 2.01 3.31 0.28 4.97 0.40 -1.25 -0.61 117.98 127.09 1t8c s PHE 22 Ca 0.10 0.16 -0.00 0.00 -0.60 0.00 0.00 56.93 56.59 1t8c s PHE 22 Cb -0.18 -2.17 0.00 0.00 0.51 0.00 0.00 43.02 41.18 1t8c s PHE 22 CO 0.12 0.14 0.37 0.41 0.70 0.00 0.00 175.22 176.96 1t8c n GLY 23 N 3.85 2.44 3.61 4.36 0.00 0.69 -4.71 105.19 115.43 1t8c n GLY 23 Ca -0.16 -1.62 -0.23 0.00 0.00 0.00 0.00 46.02 44.01 1t8c n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t8c s LYS 24 N -2.73 2.16 0.00 1.61 1.02 -1.26 -0.33 119.74 120.21 1t8c s LYS 24 Ca 0.25 -1.52 0.00 0.00 0.02 0.00 0.00 55.97 54.73 1t8c s LYS 24 Cb -0.00 -2.07 0.00 0.00 -0.52 0.00 0.00 37.83 35.24 1t8c s LYS 24 CO 0.18 0.33 0.00 0.41 -0.92 0.00 0.00 175.35 175.35 1t8c n GLY 25 N -0.86 1.12 2.75 -3.33 0.00 -0.70 -4.28 105.19 99.90 1t8c n GLY 25 Ca -0.06 -0.67 -0.03 0.00 0.00 0.00 0.00 46.02 45.27 1t8c n GLY 25 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1t8c s THR 26 N -2.22 -0.54 0.00 2.61 -1.32 -1.26 -4.11 115.64 108.80 1t8c s THR 26 Ca 0.00 -0.44 0.00 0.00 -1.21 0.00 0.00 61.69 60.04 1t8c s THR 26 Cb 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.99 1t8c s THR 26 CO 0.00 0.00 0.00 0.29 -2.21 0.00 0.00 174.62 172.70 1t8c n LYS 27 N 2.97 0.00 -4.09 7.08 4.76 -1.26 -5.07 118.16 122.54 1t8c n LYS 27 Ca 0.13 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.31 1t8c n LYS 27 Cb 0.61 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.75 1t8c n LYS 27 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1t8c n GLN 28 N 0.00 1.02 -0.02 1.97 6.02 -1.26 -4.15 117.38 120.96 1t8c n GLN 28 Ca 0.00 -2.93 -0.12 0.00 -0.01 0.00 0.00 57.00 53.94 1t8c n GLN 28 Cb 0.00 0.77 -0.07 0.00 1.02 0.00 0.00 30.24 31.95 1t8c n GLN 28 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 177.06 178.40 1t8c h TRP 29 N 1.18 0.13 -0.54 1.08 7.01 -1.96 -2.72 115.95 120.14 1t8c h TRP 29 Ca -0.33 -0.02 0.14 0.00 2.11 0.00 0.00 58.89 60.78 1t8c h TRP 29 Cb 1.01 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 28.01 1t8c h TRP 29 CO 0.00 0.36 0.38 -0.39 -2.79 0.00 0.00 178.44 176.00 1t8c h VAL 30 N -0.14 0.78 -0.05 2.65 -1.51 -1.98 0.16 116.25 116.16 1t8c h VAL 30 Ca 0.02 -0.04 -0.15 0.00 -1.23 0.00 0.00 66.70 65.30 1t8c h VAL 30 Cb 0.30 0.66 -0.01 0.00 -2.13 0.00 0.00 31.29 30.11 1t8c h VAL 30 CO 0.00 0.02 -0.63 0.45 -1.23 0.00 0.00 177.57 176.18 1t8c h HIS 31 N 0.11 0.26 -0.05 5.19 3.86 -1.90 -2.25 115.15 120.38 1t8c h HIS 31 Ca 0.26 -0.10 -0.03 0.00 -1.16 0.00 0.00 60.37 59.34 1t8c h HIS 31 Cb 0.87 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.30 1t8c h HIS 31 CO -0.00 0.77 -0.08 0.00 0.86 0.00 0.00 177.93 179.49 1t8c h ALA 32 N 1.20 0.07 -0.97 2.45 0.00 -0.42 -0.30 119.26 121.29 1t8c h ALA 32 Ca -0.01 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.60 1t8c h ALA 32 Cb 1.14 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 1t8c h ALA 32 CO 0.10 -0.09 0.64 0.07 0.00 0.00 0.00 179.25 179.97 1t8c h ARG 33 N -0.36 1.28 -0.09 0.00 -0.00 -1.37 -1.08 114.38 112.77 1t8c h ARG 33 Ca 0.00 -0.08 -0.16 0.00 -0.00 0.00 0.00 59.98 59.74 1t8c h ARG 33 Cb 0.63 -0.29 -0.01 0.00 -0.00 0.00 0.00 29.97 30.30 1t8c h ARG 33 CO 0.02 0.85 -0.64 -0.92 -0.00 0.00 0.00 179.97 179.28 1t8c h TYR 34 N 1.32 0.43 -0.47 4.08 5.03 -1.41 -1.04 116.97 124.92 1t8c h TYR 34 Ca 0.36 -0.17 -0.10 0.00 2.58 0.00 0.00 58.73 61.40 1t8c h TYR 34 Cb -0.15 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.04 1t8c h TYR 34 CO -0.00 0.88 -0.08 0.00 -1.32 0.00 0.00 178.16 177.63 1t8c h ALA 35 N 1.08 0.64 0.00 1.82 0.00 -0.43 -2.00 119.26 120.37 1t8c h ALA 35 Ca -0.01 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1t8c h ALA 35 Cb 1.17 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1t8c h ALA 35 CO 0.10 0.51 -0.44 0.00 0.00 0.00 0.00 179.25 179.43 1t8c h ASP 37 N 0.00 0.00 -0.96 0.00 3.58 -0.98 -1.58 116.42 116.48 1t8c h ASP 37 Ca -0.00 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.50 1t8c h ASP 37 Cb 1.29 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.28 1t8c h ASP 37 CO 0.06 0.09 0.62 0.44 -2.88 0.00 0.00 179.24 177.58 1t8c h ASP 38 N 0.00 1.01 0.00 2.28 3.32 -1.31 -3.44 116.42 118.28 1t8c h ASP 38 Ca -0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1t8c h ASP 38 Cb 0.82 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1t8c h ASP 38 CO 0.01 0.67 0.00 1.15 -1.72 0.00 0.00 179.24 179.35 1t8c n MET 39 N -4.47 0.00 0.00 3.56 0.00 -1.21 -5.08 117.12 109.92 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 0.14 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.36 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 -0.01 0.00 0.00 3.17 4.71 -1.00 -5.00 120.64 122.51 1t8c n GLU 40 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1t8c n GLU 40 Cb 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 31.44 30.03 1t8c n GLU 40 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1t8c n GLY 41 N 0.00 0.54 3.39 0.62 0.00 -0.63 -4.86 105.19 104.26 1t8c n GLY 41 Ca 0.00 0.13 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 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 0.69 1.19 -0.33 1.61 0.74 0.33 -4.63 119.66 119.27 1t8c s GLN 42 Ca 0.00 -0.81 -0.29 0.00 0.05 0.00 0.00 55.36 54.31 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 1.41 -1.17 -0.55 0.00 0.00 175.29 174.50 1t8c s LEU 43 N -2.85 3.76 0.00 3.68 2.96 -1.26 0.41 118.68 125.37 1t8c s LEU 43 Ca 0.07 1.13 0.00 0.00 -0.22 0.00 0.00 54.13 55.11 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 -0.07 -1.26 0.11 1.33 -1.32 0.00 0.00 176.35 175.13 1t8c n VAL 44 N 6.61 0.00 -2.90 1.68 0.24 -1.26 -3.39 118.33 119.31 1t8c n VAL 44 Ca 0.16 0.16 -0.12 0.00 -2.04 0.00 0.00 64.34 62.51 1t8c n VAL 44 Cb 0.47 -0.22 0.06 0.00 -1.47 0.00 0.00 33.84 32.67 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 -1.83 -4.82 -4.51 -1.34 2.88 -1.26 -4.54 113.62 98.19 1t8c n SER 45 Ca 0.00 -0.53 -0.41 0.00 -1.33 0.00 0.00 58.87 56.60 1t8c n SER 45 Cb 0.00 -4.12 0.02 0.00 -0.75 0.00 0.00 64.21 59.35 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 -2.96 2.15 -0.92 2.46 -5.35 -1.26 -4.80 119.36 108.67 1t8c n ILE 46 Ca -0.09 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.89 1t8c n ILE 46 Cb 0.60 -0.76 0.00 0.00 -1.74 0.00 0.00 39.64 37.74 1t8c n ILE 46 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1t8c n HIS 47 N -0.93 0.00 -4.44 4.28 1.44 -1.26 -4.91 115.22 109.40 1t8c n HIS 47 Ca 0.11 -0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.52 1t8c n HIS 47 Cb 0.41 -0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.35 1t8c n HIS 47 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1t8c s SER 48 N -0.00 2.70 0.57 4.39 0.15 -1.26 -4.79 113.70 115.46 1t8c s SER 48 Ca 0.00 -0.50 0.35 0.00 0.70 0.00 0.00 55.95 56.50 1t8c s SER 48 Cb 0.00 -1.22 1.44 0.00 -1.71 0.00 0.00 66.02 64.53 1t8c s SER 48 CO 0.00 0.02 1.69 -0.65 1.20 0.00 0.00 173.24 175.51 1t8c h PRO 49 N 7.51 0.00 -0.04 5.44 0.11 -1.97 0.37 132.00 143.42 1t8c h PRO 49 Ca -0.33 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 1t8c h PRO 49 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1t8c h PRO 49 CO 0.52 0.00 -0.18 1.49 -0.21 0.00 0.00 178.00 179.62 1t8c h GLU 50 N 0.00 0.19 -0.56 1.05 4.81 -1.98 -1.68 114.58 116.41 1t8c h GLU 50 Ca 0.53 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 59.55 1t8c h GLU 50 Cb 2.38 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 31.77 1t8c h GLU 50 CO -0.01 0.80 0.13 0.93 -0.73 0.00 0.00 179.01 180.13 1t8c h GLU 51 N -0.38 0.91 -0.62 1.92 5.08 -0.77 0.30 114.58 121.02 1t8c h GLU 51 Ca -0.01 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.09 1t8c h GLU 51 Cb 0.83 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 1t8c h GLU 51 CO 0.04 0.85 0.24 -0.56 -1.00 0.00 0.00 179.01 178.58 1t8c h GLN 52 N 0.81 0.93 -0.28 2.33 -0.00 -1.12 -1.61 115.11 116.17 1t8c h GLN 52 Ca 0.18 -0.17 -0.10 0.00 -0.00 0.00 0.00 58.65 58.55 1t8c h GLN 52 Cb 0.36 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.48 27.67 1t8c h GLN 52 CO 0.00 0.79 -0.26 0.22 -0.00 0.00 0.00 178.83 179.58 1t8c h ASP 53 N 0.87 0.55 0.12 0.06 3.58 -1.03 -0.17 116.42 120.40 1t8c h ASP 53 Ca 0.21 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 1t8c h ASP 53 Cb 0.21 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.11 1t8c h ASP 53 CO -0.02 0.80 -0.06 -0.26 -2.88 0.00 0.00 179.24 176.82 1t8c h PHE 54 N 0.48 -0.15 -0.11 0.28 0.04 0.25 0.22 116.94 117.95 1t8c h PHE 54 Ca 0.07 -0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.61 1t8c h PHE 54 Cb 0.70 0.05 0.01 0.00 2.20 0.00 0.00 35.95 38.91 1t8c h PHE 54 CO 0.03 -0.06 -0.82 1.37 -0.60 0.00 0.00 178.31 178.23 1t8c h LEU 55 N -0.20 0.91 -1.15 1.54 8.10 -1.29 -0.39 115.31 122.84 1t8c h LEU 55 Ca -0.02 -0.66 0.01 0.00 0.11 0.00 0.00 57.88 57.33 1t8c h LEU 55 Cb 0.15 -0.27 -0.04 0.00 -0.44 0.00 0.00 40.66 40.06 1t8c h LEU 55 CO 0.03 1.43 0.58 0.74 -4.11 0.00 0.00 178.44 177.10 1t8c h THR 56 N 0.46 1.21 -0.05 0.15 2.02 -0.97 0.45 112.91 116.19 1t8c h THR 56 Ca -0.07 -0.40 -0.19 0.00 0.77 0.00 0.00 66.41 66.52 1t8c h THR 56 Cb 1.45 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1t8c h THR 56 CO 0.17 0.21 -0.79 0.50 0.37 0.00 0.00 175.52 175.98 1t8c h LYS 57 N 1.17 0.36 -0.05 6.66 1.63 -0.51 -2.99 116.57 122.83 1t8c h LYS 57 Ca 0.32 -0.32 -0.07 0.00 -0.85 0.00 0.00 60.65 59.72 1t8c h LYS 57 Cb -0.11 0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.58 1t8c h LYS 57 CO -0.07 0.98 -0.31 1.25 -3.45 0.00 0.00 179.45 177.84 1t8c h HIS 58 N 0.23 0.11 -3.18 1.91 2.76 0.40 -3.41 115.15 113.98 1t8c h HIS 58 Ca -0.04 -0.02 -0.57 0.00 -2.20 0.00 0.00 60.37 57.54 1t8c h HIS 58 Cb 1.38 -0.03 -0.05 0.00 1.55 0.00 0.00 27.41 30.26 1t8c h HIS 58 CO 0.04 0.41 1.10 0.00 -1.30 0.00 0.00 177.93 178.18 1t8c s ALA 59 N -4.33 3.00 -0.07 5.26 0.00 0.15 -4.85 121.76 120.92 1t8c s ALA 59 Ca -0.04 -0.13 0.14 0.00 0.00 0.00 0.00 51.96 51.93 1t8c s ALA 59 Cb 0.15 -3.96 -0.21 0.00 0.00 0.00 0.00 23.12 19.10 1t8c s ALA 59 CO 0.73 -2.46 0.69 0.45 0.00 0.00 0.00 175.76 175.17 1t8c n SER 60 N 9.07 0.85 0.03 0.00 2.88 -1.26 -4.49 113.62 120.70 1t8c n SER 60 Ca 0.17 0.40 -0.01 0.00 -1.33 0.00 0.00 58.87 58.10 1t8c n SER 60 Cb 0.48 0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 63.95 1t8c n SER 60 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 1t8c h HIS 61 N 0.00 -0.07 0.00 0.66 3.86 -1.89 -3.48 115.15 114.24 1t8c h HIS 61 Ca -0.26 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.95 1t8c h HIS 61 Cb 1.91 0.02 0.00 0.00 1.06 0.00 0.00 27.41 30.40 1t8c h HIS 61 CO 0.00 -0.04 0.00 0.25 0.86 0.00 0.00 177.93 179.00 1t8c n THR 62 N -2.27 0.00 -3.24 2.45 -2.24 -1.26 -4.98 114.28 102.74 1t8c n THR 62 Ca -0.01 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1t8c n THR 62 Cb 0.03 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 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 -0.31 1.62 3.41 3.38 0.00 -1.24 -4.51 105.19 107.53 1t8c n GLY 63 Ca 0.00 -0.99 -0.21 0.00 0.00 0.00 0.00 46.02 44.83 1t8c n GLY 63 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1t8c s SER 64 N -1.16 2.77 -0.17 1.61 1.04 -1.26 -2.74 113.70 113.79 1t8c s SER 64 Ca 0.01 -1.13 -0.08 0.00 0.48 0.00 0.00 55.95 55.23 1t8c s SER 64 Cb -0.00 -0.17 -0.04 0.00 0.10 0.00 0.00 66.02 65.90 1t8c s SER 64 CO 0.01 -0.27 0.09 0.26 0.98 0.00 0.00 173.24 174.31 1t8c s TRP 65 N -2.97 3.35 0.37 5.02 0.51 -1.19 -3.98 118.94 120.06 1t8c s TRP 65 Ca 0.28 0.24 0.08 0.00 -2.12 0.00 0.00 56.10 54.58 1t8c s TRP 65 Cb 0.02 -2.07 -0.05 0.00 -0.81 0.00 0.00 33.47 30.56 1t8c s TRP 65 CO 0.11 0.31 0.11 0.96 -0.51 0.00 0.00 176.95 177.92 1t8c s ILE 66 N 0.07 2.59 -1.03 2.03 -4.36 -1.26 -4.20 121.20 115.04 1t8c s ILE 66 Ca 0.07 -1.80 -0.07 0.00 -0.26 0.00 0.00 60.65 58.59 1t8c s ILE 66 Cb -0.12 -2.92 -0.09 0.00 1.25 0.00 0.00 42.46 40.58 1t8c s ILE 66 CO 0.00 -0.12 2.55 0.61 0.24 0.00 0.00 174.94 178.22 1t8c n GLY 67 N -1.11 3.44 3.06 6.27 0.00 -1.22 -4.62 105.19 111.01 1t8c n GLY 67 Ca -0.03 -1.10 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 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 0.11 1.72 -0.04 0.99 1.98 -1.26 -0.77 118.68 121.40 1t8c s LEU 68 Ca 0.52 -0.39 -0.02 0.00 -2.89 0.00 0.00 54.13 51.36 1t8c s LEU 68 Cb 0.15 -1.01 0.03 0.00 0.66 0.00 0.00 46.19 46.02 1t8c s LEU 68 CO -0.04 0.04 0.05 -0.60 -1.89 0.00 0.00 176.35 173.91 1t8c s ARG 69 N 0.79 0.02 0.41 1.98 3.00 0.10 -3.64 118.95 121.62 1t8c s ARG 69 Ca -0.11 0.32 -0.04 0.00 -1.00 0.00 0.00 55.73 54.90 1t8c s ARG 69 Cb -0.16 -0.55 -0.04 0.00 0.00 0.00 0.00 34.95 34.20 1t8c s ARG 69 CO 0.02 -0.31 0.69 1.21 0.00 0.00 0.00 175.30 176.91 1t8c s ASN 70 N 2.03 6.32 0.00 -2.12 3.84 -1.14 -0.52 114.94 123.36 1t8c s ASN 70 Ca 0.04 0.80 0.16 0.00 0.21 0.00 0.00 52.86 54.06 1t8c s ASN 70 Cb -0.12 -2.19 -0.13 0.00 -0.55 0.00 0.00 41.25 38.26 1t8c s ASN 70 CO -0.03 -0.44 0.72 0.18 -2.79 0.00 0.00 177.10 174.74 1t8c n LEU 71 N -1.86 0.97 -0.97 3.21 4.77 -1.08 -3.71 117.00 118.33 1t8c n LEU 71 Ca -0.01 -0.57 -0.02 0.00 -0.03 0.00 0.00 56.01 55.38 1t8c n LEU 71 Cb 0.55 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 1t8c n LEU 71 CO 0.51 0.22 0.25 0.47 -1.33 0.00 0.00 177.39 177.50 1t8c n ASP 72 N -1.06 -0.19 0.00 -1.43 9.92 -1.26 -4.97 116.55 117.57 1t8c n ASP 72 Ca 0.04 -1.80 0.00 0.00 -0.53 0.00 0.00 54.79 52.49 1t8c n ASP 72 Cb 0.27 0.03 0.00 0.00 -0.64 0.00 0.00 41.12 40.78 1t8c n ASP 72 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1t8c n LEU 73 N 0.13 0.00 -0.13 0.64 4.32 -1.26 -1.21 117.00 119.48 1t8c n LEU 73 Ca -0.11 0.00 0.15 0.00 -0.02 0.00 0.00 56.01 56.03 1t8c n LEU 73 Cb 0.77 0.00 0.73 0.00 -1.62 0.00 0.00 43.42 43.31 1t8c n LEU 73 CO -0.07 0.00 0.97 2.29 -1.22 0.00 0.00 177.39 179.36 1t8c n LYS 74 N 0.00 0.95 0.00 3.23 2.85 -1.26 -4.64 118.16 119.29 1t8c n LYS 74 Ca 0.00 -0.25 0.00 0.00 -1.05 0.00 0.00 58.31 57.01 1t8c n LYS 74 Cb 0.00 -1.49 0.00 0.00 -0.65 0.00 0.00 35.03 32.89 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 1.16 0.76 2.99 2.58 0.00 -0.35 -5.00 105.19 107.33 1t8c n GLY 75 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1t8c n GLY 75 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1t8c s GLU 76 N 0.00 1.80 0.34 1.61 -1.05 -1.26 -4.97 118.70 115.17 1t8c s GLU 76 Ca 0.00 -0.40 -0.12 0.00 -0.15 0.00 0.00 54.97 54.29 1t8c s GLU 76 Cb 0.00 -1.63 -0.08 0.00 -0.44 0.00 0.00 34.13 31.98 1t8c s GLU 76 CO 0.00 -0.11 0.72 -0.59 0.95 0.00 0.00 175.26 176.22 1t8c s PHE 77 N 1.16 3.41 -0.00 4.83 -0.12 -1.26 -2.63 117.98 123.37 1t8c s PHE 77 Ca -0.05 1.09 0.03 0.00 -0.05 0.00 0.00 56.93 57.96 1t8c s PHE 77 Cb -0.14 -2.45 -0.01 0.00 -0.63 0.00 0.00 43.02 39.79 1t8c s PHE 77 CO -0.03 0.05 -0.09 0.42 -0.05 0.00 0.00 175.22 175.53 1t8c s ILE 78 N -2.09 0.70 0.63 -4.49 1.01 0.32 -1.73 121.20 115.56 1t8c s ILE 78 Ca 0.52 -0.44 -0.14 0.00 0.00 0.00 0.00 60.65 60.59 1t8c s ILE 78 Cb -0.10 -0.60 -0.02 0.00 0.01 0.00 0.00 42.46 41.74 1t8c s ILE 78 CO 0.23 0.16 1.05 0.26 0.00 0.00 0.00 174.94 176.64 1t8c s TRP 79 N -0.30 3.07 0.60 3.97 0.51 0.81 0.02 118.94 127.62 1t8c s TRP 79 Ca 0.03 1.47 0.33 0.00 -2.12 0.00 0.00 56.10 55.81 1t8c s TRP 79 Cb -0.04 -2.94 1.95 0.00 -0.81 0.00 0.00 33.47 31.63 1t8c s TRP 79 CO -0.00 -1.11 2.27 -0.24 -0.51 0.00 0.00 176.95 177.36 1t8c h VAL 80 N -0.01 0.40 0.00 4.03 3.04 -1.29 0.42 116.25 122.84 1t8c h VAL 80 Ca -0.46 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1t8c h VAL 80 Cb 1.21 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 1t8c h VAL 80 CO 0.57 0.01 0.00 -0.67 -1.01 0.00 0.00 177.57 176.47 1t8c n ASP 81 N -3.65 0.00 -0.35 3.17 2.03 -1.26 -4.89 116.55 111.59 1t8c n ASP 81 Ca -0.03 0.28 0.00 0.00 0.52 0.00 0.00 54.79 55.56 1t8c n ASP 81 Cb 0.09 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.07 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 1.04 0.85 3.08 0.27 0.00 0.15 -5.09 105.19 105.49 1t8c n GLY 82 Ca 0.08 -0.36 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.46 2.46 0.75 1.61 0.01 -1.22 -4.87 113.70 109.97 1t8c s SER 83 Ca 0.00 -0.43 -0.13 0.00 1.31 0.00 0.00 55.95 56.70 1t8c s SER 83 Cb 0.00 -1.11 0.05 0.00 0.21 0.00 0.00 66.02 65.17 1t8c s SER 83 CO 0.00 0.04 1.14 -2.28 0.41 0.00 0.00 173.24 172.55 1t8c s HIS 84 N 0.85 2.28 0.03 2.43 5.65 -1.26 -0.13 115.29 125.13 1t8c s HIS 84 Ca -0.09 1.61 -0.39 0.00 0.25 0.00 0.00 55.06 56.44 1t8c s HIS 84 Cb -0.15 -3.25 -0.19 0.00 -1.18 0.00 0.00 32.58 27.81 1t8c s HIS 84 CO 0.00 -2.16 1.14 0.28 -0.65 0.00 0.00 174.74 173.36 1t8c n VAL 85 N -3.12 0.05 0.00 0.89 0.31 -0.71 -4.84 118.33 110.91 1t8c n VAL 85 Ca 0.11 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1t8c n VAL 85 Cb 0.52 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 1t8c n VAL 85 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1t8c n ASP 86 N 1.82 0.00 0.02 4.52 8.00 -1.26 -4.94 116.55 124.72 1t8c n ASP 86 Ca 0.19 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.47 1t8c n ASP 86 Cb 0.12 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.08 1t8c n ASP 86 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 1t8c h TYR 87 N 0.00 0.53 -2.69 1.24 0.05 -1.91 -3.50 116.97 110.68 1t8c h TYR 87 Ca 0.00 -0.39 0.26 0.00 0.05 0.00 0.00 58.73 58.65 1t8c h TYR 87 Cb 0.00 -0.02 -0.11 0.00 1.01 0.00 0.00 36.73 37.61 1t8c h TYR 87 CO 0.00 1.66 -0.66 -1.13 -1.05 0.00 0.00 178.16 176.98 1t8c n SER 88 N -3.71 -6.06 0.00 3.88 3.41 -1.26 -4.94 113.62 104.93 1t8c n SER 88 Ca -0.27 0.76 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 1t8c n SER 88 Cb 0.99 -3.78 0.00 0.00 -0.26 0.00 0.00 64.21 61.16 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 -4.22 1.83 -0.24 4.04 4.13 -1.26 -5.03 115.26 114.51 1t8c n ASN 89 Ca -0.03 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.23 1t8c n ASN 89 Cb 0.62 0.12 0.00 0.00 -1.54 0.00 0.00 39.78 38.98 1t8c n ASN 89 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 1t8c n TRP 90 N -1.40 0.00 -1.39 3.10 7.02 -1.26 -4.65 117.44 118.85 1t8c n TRP 90 Ca 0.00 0.00 -0.46 0.00 -1.02 0.00 0.00 57.50 56.02 1t8c n TRP 90 Cb 0.20 -0.07 -0.02 0.00 -2.42 0.00 0.00 31.31 29.00 1t8c n TRP 90 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1t8c n ALA 91 N 1.05 -2.64 0.70 6.99 0.00 0.13 -4.80 120.51 121.94 1t8c n ALA 91 Ca 0.00 0.34 0.08 0.00 0.00 0.00 0.00 53.44 53.86 1t8c n ALA 91 Cb 0.00 -1.61 0.39 0.00 0.00 0.00 0.00 19.45 18.23 1t8c n ALA 91 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1t8c n PRO 92 N 1.04 0.14 0.00 0.00 -0.04 -1.26 -4.46 135.00 130.41 1t8c n PRO 92 Ca 0.15 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 1t8c n PRO 92 Cb 0.30 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 1t8c n PRO 92 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1t8c n GLY 93 N 0.15 0.43 2.58 0.55 0.00 -1.26 -4.99 105.19 102.66 1t8c n GLY 93 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 1t8c n GLY 93 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t8c s GLU 94 N 0.00 0.75 0.00 1.61 2.02 -1.26 -4.97 118.70 116.84 1t8c s GLU 94 Ca 0.00 -1.38 0.19 0.00 0.02 0.00 0.00 54.97 53.81 1t8c s GLU 94 Cb 0.00 -0.99 1.06 0.00 0.10 0.00 0.00 34.13 34.30 1t8c s GLU 94 CO 0.00 -1.27 1.58 -0.35 0.02 0.00 0.00 175.26 175.24 1t8c n PRO 95 N 3.62 0.43 -2.10 0.39 -0.04 -1.26 -4.81 135.00 131.23 1t8c n PRO 95 Ca 0.18 0.06 -0.41 0.00 -0.04 0.00 0.00 63.50 63.29 1t8c n PRO 95 Cb 0.45 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.39 1t8c n PRO 95 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1t8c s THR 96 N -2.32 2.85 0.14 0.52 2.01 -1.26 -4.45 115.64 113.13 1t8c s THR 96 Ca 0.23 0.73 -0.08 0.00 0.31 0.00 0.00 61.69 62.89 1t8c s THR 96 Cb 0.13 -3.47 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 1t8c s THR 96 CO 0.26 0.12 0.22 -0.55 -0.69 0.00 0.00 174.62 173.99 1t8c s SER 97 N 0.22 0.11 -0.50 3.53 0.15 -1.26 -5.09 113.70 110.85 1t8c s SER 97 Ca 0.57 -0.86 -0.03 0.00 0.70 0.00 0.00 55.95 56.33 1t8c s SER 97 Cb -0.40 0.39 0.13 0.00 -1.71 0.00 0.00 66.02 64.43 1t8c s SER 97 CO 0.43 -0.82 0.30 -0.60 1.20 0.00 0.00 173.24 173.75 1t8c s ARG 98 N -3.95 2.23 0.31 5.44 6.06 -1.26 -4.87 118.95 122.91 1t8c s ARG 98 Ca 0.15 -2.15 -0.14 0.00 -2.50 0.00 0.00 55.73 51.08 1t8c s ARG 98 Cb 0.04 -3.63 0.05 0.00 0.06 0.00 0.00 34.95 31.48 1t8c s ARG 98 CO -0.03 -1.12 0.73 0.43 -2.50 0.00 0.00 175.30 172.82 1t8c n SER 99 N 4.06 -1.92 -3.70 -2.12 7.64 -1.26 -5.11 113.62 111.21 1t8c n SER 99 Ca 0.02 -2.28 -0.12 0.00 1.01 0.00 0.00 58.87 57.51 1t8c n SER 99 Cb 0.39 3.19 -0.10 0.00 -1.01 0.00 0.00 64.21 66.69 1t8c n SER 99 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1t8c s GLN 100 N -2.07 0.49 0.00 1.43 0.74 -1.26 -4.98 119.66 114.01 1t8c s GLN 100 Ca 0.15 0.74 0.00 0.00 0.05 0.00 0.00 55.36 56.30 1t8c s GLN 100 Cb -0.04 0.14 0.00 0.00 1.10 0.00 0.00 33.01 34.21 1t8c s GLN 100 CO 0.09 -0.11 0.00 0.41 -0.55 0.00 0.00 175.29 175.14 1t8c n GLY 101 N 3.52 0.55 3.45 2.59 0.00 -1.26 -5.01 105.19 109.02 1t8c n GLY 101 Ca -0.18 -1.47 -0.43 0.00 0.00 0.00 0.00 46.02 43.94 1t8c n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1t8c s GLU 102 N -1.82 3.11 0.79 1.61 2.12 -1.26 -4.79 118.70 118.45 1t8c s GLU 102 Ca 0.00 -0.86 -0.11 0.00 0.36 0.00 0.00 54.97 54.36 1t8c s GLU 102 Cb 0.00 -4.24 0.06 0.00 0.26 0.00 0.00 34.13 30.21 1t8c s GLU 102 CO 0.00 -1.81 1.09 0.34 -0.54 0.00 0.00 175.26 174.34 1t8c s ASP 103 N 3.68 4.56 0.02 -1.70 -1.08 -1.24 -4.35 116.67 116.56 1t8c s ASP 103 Ca 0.22 1.43 -0.14 0.00 -0.52 0.00 0.00 52.55 53.55 1t8c s ASP 103 Cb -0.17 -2.19 0.02 0.00 -1.46 0.00 0.00 42.92 39.12 1t8c s ASP 103 CO 0.10 -1.95 0.29 0.00 0.52 0.00 0.00 175.17 174.14 1t8c s VAL 105 N -2.09 4.40 0.40 0.00 1.01 -1.24 -2.41 120.40 120.47 1t8c s VAL 105 Ca -0.08 -0.16 0.07 0.00 0.00 0.00 0.00 61.98 61.81 1t8c s VAL 105 Cb -0.03 -3.00 -0.07 0.00 0.00 0.00 0.00 36.38 33.28 1t8c s VAL 105 CO -0.01 0.41 0.03 0.00 0.00 0.00 0.00 175.10 175.54 1t8c s MET 106 N 0.92 2.00 -0.09 2.72 0.23 0.05 -4.24 119.30 120.88 1t8c s MET 106 Ca 0.03 -2.02 0.04 0.00 -1.03 0.00 0.00 55.69 52.71 1t8c s MET 106 Cb -0.14 -1.73 0.00 0.00 -1.53 0.00 0.00 34.83 31.43 1t8c s MET 106 CO 0.02 -0.03 -0.23 -1.64 -2.03 0.00 0.00 175.02 171.12 1t8c s MET 107 N -3.73 2.84 0.00 3.16 1.00 -1.26 0.13 119.30 121.44 1t8c s MET 107 Ca 0.36 -0.82 0.00 0.00 0.00 0.00 0.00 55.69 55.22 1t8c s MET 107 Cb 0.07 -2.18 0.00 0.00 0.00 0.00 0.00 34.83 32.73 1t8c s MET 107 CO 0.19 0.18 0.00 -2.13 0.00 0.00 0.00 175.02 173.25 1t8c n ARG 108 N 3.51 -0.79 0.00 2.03 0.00 -0.97 -3.70 116.66 116.75 1t8c n ARG 108 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.66 1t8c n ARG 108 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.99 1t8c n ARG 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1t8c n GLY 109 N 0.00 1.77 0.00 5.14 0.00 -1.26 -3.40 105.19 107.44 1t8c n GLY 109 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1t8c n GLY 109 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1t8c n SER 110 N 3.28 0.00 0.00 1.61 7.64 -1.26 -5.01 113.62 119.88 1t8c n SER 110 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1t8c n SER 110 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1t8c n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t8c n GLY 111 N 0.00 0.91 0.00 0.23 0.00 -1.22 -5.11 105.19 100.00 1t8c n GLY 111 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 3.88 -4.05 1.61 -4.01 -1.24 -4.68 116.66 108.17 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 2.01 2.92 -0.06 2.89 0.52 -1.26 -2.28 118.94 123.68 1t8c s TRP 113 Ca 0.00 -0.23 -0.02 0.00 0.02 0.00 0.00 56.10 55.87 1t8c s TRP 113 Cb 0.00 -1.53 0.04 0.00 -1.15 0.00 0.00 33.47 30.83 1t8c s TRP 113 CO 0.00 0.40 0.10 1.21 0.02 0.00 0.00 176.95 178.68 1t8c s ASN 114 N -3.86 0.95 -0.63 2.95 2.47 0.35 0.23 114.94 117.38 1t8c s ASN 114 Ca 0.36 0.18 -0.15 0.00 0.42 0.00 0.00 52.86 53.67 1t8c s ASN 114 Cb -0.06 0.03 0.16 0.00 -1.45 0.00 0.00 41.25 39.93 1t8c s ASN 114 CO 0.24 -0.24 0.58 -0.62 -3.72 0.00 0.00 177.10 173.34 1t8c s ASP 115 N 2.18 6.35 0.16 -4.21 -1.08 -1.26 -0.77 116.67 118.04 1t8c s ASP 115 Ca 0.04 -2.10 -0.19 0.00 -0.52 0.00 0.00 52.55 49.77 1t8c s ASP 115 Cb -0.12 -2.20 0.05 0.00 -1.46 0.00 0.00 42.92 39.19 1t8c s ASP 115 CO -0.04 -0.75 0.51 0.00 0.52 0.00 0.00 175.17 175.41 1t8c s ALA 116 N 1.10 -1.20 0.84 3.66 0.00 -1.01 -4.63 121.76 120.51 1t8c s ALA 116 Ca 0.08 0.12 -0.15 0.00 0.00 0.00 0.00 51.96 52.01 1t8c s ALA 116 Cb -0.23 0.81 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 1t8c s ALA 116 CO -0.01 -0.74 0.20 0.34 0.00 0.00 0.00 175.76 175.55 1t8c n PHE 117 N -0.32 -1.97 -1.47 0.00 7.35 -1.26 -2.73 117.46 117.06 1t8c n PHE 117 Ca -0.15 0.25 -0.40 0.00 -0.76 0.00 0.00 57.45 56.39 1t8c n PHE 117 Cb 0.64 -1.77 -0.02 0.00 0.35 0.00 0.00 39.48 38.68 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 4.88 0.50 -0.53 0.00 5.68 -1.26 -4.96 116.55 120.87 1t8c n ASP 119 Ca 0.64 -0.33 0.00 0.00 -0.50 0.00 0.00 54.79 54.60 1t8c n ASP 119 Cb 0.30 1.29 0.00 0.00 -1.14 0.00 0.00 41.12 41.57 1t8c n ASP 119 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1t8c n ARG 120 N -1.97 2.49 -3.65 0.11 1.74 -1.26 -5.14 116.66 108.96 1t8c n ARG 120 Ca 0.00 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.04 1t8c n ARG 120 Cb 0.46 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.84 1t8c n ARG 120 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1t8c s LYS 121 N 1.75 0.50 0.00 5.56 1.02 -1.26 -4.95 119.74 122.37 1t8c s LYS 121 Ca 0.00 1.26 0.00 0.00 0.02 0.00 0.00 55.97 57.25 1t8c s LYS 121 Cb 0.00 0.56 0.00 0.00 -0.52 0.00 0.00 37.83 37.87 1t8c s LYS 121 CO 0.00 -0.21 0.00 1.28 -0.92 0.00 0.00 175.35 175.50 1t8c n LEU 122 N 5.21 0.00 -0.76 3.17 4.32 -1.26 -4.98 117.00 122.70 1t8c n LEU 122 Ca -0.13 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.82 1t8c n LEU 122 Cb 0.51 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.27 1t8c n LEU 122 CO -0.02 0.00 0.27 0.61 -1.22 0.00 0.00 177.39 177.03 1t8c n GLY 123 N 5.00 0.50 3.06 -0.72 0.00 -1.25 -4.53 105.19 107.26 1t8c n GLY 123 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.56 -0.50 4.61 0.00 -1.11 -1.71 121.76 122.49 1t8c s ALA 124 Ca 0.00 0.94 -0.16 0.00 0.00 0.00 0.00 51.96 52.73 1t8c s ALA 124 Cb 0.00 -0.59 0.08 0.00 0.00 0.00 0.00 23.12 22.61 1t8c s ALA 124 CO 0.00 -0.18 0.48 -1.58 0.00 0.00 0.00 175.76 174.47 1t8c s TRP 125 N 1.06 3.19 -0.13 0.00 0.52 0.55 -3.16 118.94 120.98 1t8c s TRP 125 Ca -0.08 -0.93 -0.01 0.00 0.02 0.00 0.00 56.10 55.11 1t8c s TRP 125 Cb -0.09 -3.40 -0.02 0.00 -1.15 0.00 0.00 33.47 28.81 1t8c s TRP 125 CO -0.07 -0.91 -0.11 0.08 0.02 0.00 0.00 176.95 175.96 1t8c s VAL 126 N 1.88 3.20 0.18 4.03 1.01 -1.26 -0.22 120.40 129.22 1t8c s VAL 126 Ca 0.06 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1t8c s VAL 126 Cb -0.24 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1t8c s VAL 126 CO 0.07 0.52 0.06 0.00 0.00 0.00 0.00 175.10 175.75 1t8c s ASP 128 N -3.16 2.25 0.14 0.00 2.15 0.16 0.10 116.67 118.31 1t8c s ASP 128 Ca 0.30 -0.44 -0.21 0.00 0.43 0.00 0.00 52.55 52.63 1t8c s ASP 128 Cb 0.07 -0.21 0.06 0.00 -0.30 0.00 0.00 42.92 42.54 1t8c s ASP 128 CO 0.07 0.17 0.55 -0.60 -0.17 0.00 0.00 175.17 175.19 1t8c s ARG 129 N -0.86 1.20 0.30 4.34 3.00 0.29 0.12 118.95 127.35 1t8c s ARG 129 Ca 0.07 -0.49 -0.29 0.00 -1.00 0.00 0.00 55.73 54.02 1t8c s ARG 129 Cb -0.08 0.55 -0.10 0.00 0.00 0.00 0.00 34.95 35.32 1t8c s ARG 129 CO 0.01 -0.50 1.34 -0.51 0.00 0.00 0.00 175.30 175.63 1t8c s LEU 130 N -2.66 4.42 0.00 -0.88 2.01 -1.26 0.44 118.68 120.75 1t8c s LEU 130 Ca 0.01 2.67 0.00 0.00 0.01 0.00 0.00 54.13 56.82 1t8c s LEU 130 Cb -0.00 -3.64 0.02 0.00 0.01 0.00 0.00 46.19 42.57 1t8c s LEU 130 CO -0.11 -0.58 0.64 0.00 1.01 0.00 0.00 176.35 177.31 1t8c n ALA 131 N 1.27 1.39 -2.70 4.21 0.00 -1.23 -4.56 120.51 118.89 1t8c n ALA 131 Ca 0.02 -0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.08 1t8c n ALA 131 Cb 0.41 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 1t8c n ALA 131 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1t8c s THR 132 N -2.25 5.24 -2.18 0.00 -4.23 -1.26 -3.13 115.64 107.83 1t8c s THR 132 Ca 0.00 0.69 0.21 0.00 -1.18 0.00 0.00 61.69 61.42 1t8c s THR 132 Cb 0.00 -3.71 0.52 0.00 1.34 0.00 0.00 72.50 70.66 1t8c s THR 132 CO 0.00 0.31 1.67 0.00 -0.54 0.00 0.00 174.62 176.07 1t8c s THR 134 N -1.90 0.73 -0.18 0.00 -1.32 -1.26 -5.12 115.64 106.59 1t8c s THR 134 Ca 0.32 -0.23 -0.29 0.00 -1.21 0.00 0.00 61.69 60.28 1t8c s THR 134 Cb 0.16 -0.72 -0.02 0.00 -1.51 0.00 0.00 72.50 70.41 1t8c s THR 134 CO 0.26 0.27 1.45 -2.16 -2.21 0.00 0.00 174.62 172.23 1t8c s PRO 135 N 0.87 4.04 0.00 7.08 0.04 -1.26 -4.89 135.00 140.88 1t8c s PRO 135 Ca -0.12 1.69 0.18 0.00 0.04 0.00 0.00 61.00 62.80 1t8c s PRO 135 Cb -0.15 -3.91 0.93 0.00 0.04 0.00 0.00 34.50 31.41 1t8c s PRO 135 CO 0.01 -0.98 1.52 -0.35 0.04 0.00 0.00 177.00 177.23 1t8c n PRO 136 N 7.15 0.31 0.00 0.56 -0.04 -1.26 -4.99 135.00 136.74 1t8c n PRO 136 Ca 0.16 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1t8c n PRO 136 Cb 0.45 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1t8c n PRO 136 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t8c n ALA 137 N -1.23 0.00 -1.46 0.55 0.00 -1.26 -4.80 120.51 112.31 1t8c n ALA 137 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.24 1t8c n ALA 137 Cb 0.12 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.69 1t8c n ALA 137 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1t8c s SER 138 N -4.00 4.05 0.41 0.00 0.01 -1.26 -4.98 113.70 107.93 1t8c s SER 138 Ca 0.00 1.29 0.00 0.00 1.31 0.00 0.00 55.95 58.55 1t8c s SER 138 Cb 0.00 -1.98 0.00 0.00 0.21 0.00 0.00 66.02 64.25 1t8c s SER 138 CO 0.00 -2.25 0.00 1.21 0.41 0.00 0.00 173.24 172.61 1t8c n GLU 139 N -3.61 0.00 0.00 12.44 0.00 -1.26 -5.04 120.64 123.17 1t8c n GLU 139 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.23 1t8c n GLU 139 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.01 1t8c n GLU 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1t8c n GLY 140 N -0.85 0.01 5.08 8.31 0.00 -1.26 -5.07 105.19 111.41 1t8c n GLY 140 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1t8c n GLY 140 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1t8c n SER 141 N -0.77 0.00 -3.89 1.61 7.64 -1.26 -3.64 113.62 113.31 1t8c n SER 141 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1t8c n SER 141 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 1t8c n SER 141 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1t8c n ALA 142 N 6.01 5.45 1.45 -0.43 0.00 -1.26 -5.28 120.51 126.45 1t8c n ALA 142 Ca 0.00 -4.66 0.14 0.00 0.00 0.00 0.00 53.44 48.92 1t8c n ALA 142 Cb 0.00 -2.45 0.48 0.00 0.00 0.00 0.00 19.45 17.48 1t8c n ALA 142 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89