#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 0.74 3.71 0.46 0.00 -1.26 -5.14 105.19 103.71 1t8c n GLY 2 Ca 0.00 -1.57 -0.29 0.00 0.00 0.00 0.00 46.02 44.16 1t8c n GLY 2 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1t8c s PHE 3 N -1.64 2.26 0.04 1.61 5.36 -1.26 -4.96 117.98 119.38 1t8c s PHE 3 Ca 0.00 1.03 -0.30 0.00 -0.96 0.00 0.00 56.93 56.69 1t8c s PHE 3 Cb 0.00 -3.26 -0.07 0.00 -0.34 0.00 0.00 43.02 39.36 1t8c s PHE 3 CO 0.00 -2.64 1.45 0.08 -1.46 0.00 0.00 175.22 172.65 1t8c s VAL 4 N -3.03 3.49 -0.37 3.12 1.01 -1.26 -4.98 120.40 118.39 1t8c s VAL 4 Ca 0.64 0.94 0.01 0.00 0.00 0.00 0.00 61.98 63.58 1t8c s VAL 4 Cb -0.18 -3.60 0.15 0.00 0.00 0.00 0.00 36.38 32.75 1t8c s VAL 4 CO 0.56 0.01 0.27 0.00 0.00 0.00 0.00 175.10 175.95 1t8c s ASN 6 N 0.90 -0.50 0.00 0.00 2.47 -1.25 -5.01 114.94 111.54 1t8c s ASN 6 Ca 0.21 -0.47 0.03 0.00 0.42 0.00 0.00 52.86 53.05 1t8c s ASN 6 Cb -0.16 0.65 0.01 0.00 -1.45 0.00 0.00 41.25 40.31 1t8c s ASN 6 CO -0.04 -0.03 0.44 1.07 -3.72 0.00 0.00 177.10 174.81 1t8c n THR 7 N 3.07 0.00 -3.76 -5.21 5.66 -1.26 -4.86 114.28 107.93 1t8c n THR 7 Ca 0.10 -0.48 -0.33 0.00 -3.05 0.00 0.00 64.05 60.29 1t8c n THR 7 Cb 0.63 1.04 -0.09 0.00 -1.55 0.00 0.00 70.33 70.36 1t8c n THR 7 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1t8c n PRO 9 N 2.50 0.00 0.00 0.00 -0.04 -1.26 -4.84 135.00 131.35 1t8c n PRO 9 Ca 0.17 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 1t8c n PRO 9 Cb 0.36 -0.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.93 1t8c n PRO 9 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1t8c n GLU 10 N -1.19 0.00 -0.32 0.54 2.13 -1.26 -4.83 120.64 115.70 1t8c n GLU 10 Ca 0.00 0.00 0.18 0.00 0.66 0.00 0.00 57.16 58.00 1t8c n GLU 10 Cb 0.00 0.00 0.43 0.00 0.27 0.00 0.00 31.44 32.14 1t8c n GLU 10 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1t8c h LYS 11 N 0.00 0.54 -6.84 5.31 1.57 -1.94 -3.40 116.57 111.81 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 0.53 -1.58 -0.57 0.00 0.00 179.45 178.18 1t8c s TRP 12 N -5.65 3.39 -0.06 -1.35 0.52 -1.25 -3.87 118.94 110.66 1t8c s TRP 12 Ca -0.10 1.60 0.00 0.00 0.02 0.00 0.00 56.10 57.63 1t8c s TRP 12 Cb 0.25 -3.41 0.02 0.00 -1.15 0.00 0.00 33.47 29.18 1t8c s TRP 12 CO 0.80 -0.99 -0.04 0.42 0.02 0.00 0.00 176.95 177.15 1t8c s ILE 13 N -1.17 0.60 0.12 2.03 -1.09 -0.62 -4.37 121.20 116.70 1t8c s ILE 13 Ca 0.47 -0.11 0.05 0.00 -2.23 0.00 0.00 60.65 58.82 1t8c s ILE 13 Cb -0.34 -0.65 -0.04 0.00 -1.58 0.00 0.00 42.46 39.85 1t8c s ILE 13 CO 0.45 0.26 0.07 0.21 -1.23 0.00 0.00 174.94 174.70 1t8c s ASN 14 N 1.27 5.33 0.00 3.58 3.84 -1.26 0.98 114.94 128.68 1t8c s ASN 14 Ca -0.05 -0.13 0.00 0.00 0.21 0.00 0.00 52.86 52.89 1t8c s ASN 14 Cb -0.14 -1.36 0.00 0.00 -0.55 0.00 0.00 41.25 39.21 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 0.16 0.00 -0.25 0.43 3.72 0.16 -4.95 117.46 116.74 1t8c n PHE 15 Ca -0.09 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.36 1t8c n PHE 15 Cb 0.53 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 39.25 1t8c n PHE 15 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1t8c h GLN 16 N 0.00 0.31 0.00 -1.08 1.08 -2.04 -3.40 115.11 109.98 1t8c h GLN 16 Ca 0.00 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1t8c h GLN 16 Cb 0.00 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 1t8c h GLN 16 CO 0.00 0.20 0.00 2.89 -0.95 0.00 0.00 178.83 180.97 1t8c n ARG 17 N -5.11 0.00 -4.29 1.46 0.00 -1.26 -5.14 116.66 102.32 1t8c n ARG 17 Ca 0.14 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.75 1t8c n ARG 17 Cb 0.44 0.00 -0.08 0.00 -0.00 0.00 0.00 32.46 32.82 1t8c n ARG 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1t8c s LYS 18 N 0.00 2.21 0.31 2.89 -2.85 -1.26 -3.26 119.74 117.78 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 -2.16 -0.06 0.00 -2.06 0.00 0.00 37.83 33.55 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 -2.97 2.00 -0.43 0.00 1.51 0.28 -1.07 117.35 116.67 1t8c s TYR 20 Ca 0.32 -0.69 -0.17 0.00 -1.01 0.00 0.00 57.07 55.53 1t8c s TYR 20 Cb 0.05 -1.36 0.03 0.00 -0.11 0.00 0.00 41.96 40.57 1t8c s TYR 20 CO 0.14 -0.26 0.40 -0.47 -1.11 0.00 0.00 175.55 174.24 1t8c s TYR 21 N 0.22 3.19 -0.26 2.71 5.04 0.26 -1.59 117.35 126.93 1t8c s TYR 21 Ca -0.10 -0.50 -0.13 0.00 -2.44 0.00 0.00 57.07 53.90 1t8c s TYR 21 Cb -0.15 -2.86 -0.04 0.00 0.35 0.00 0.00 41.96 39.26 1t8c s TYR 21 CO 0.05 -0.70 0.26 -0.06 -1.34 0.00 0.00 175.55 173.76 1t8c s PHE 22 N 1.98 3.27 0.30 4.97 0.40 -1.25 -0.41 117.98 127.23 1t8c s PHE 22 Ca 0.09 0.30 0.03 0.00 -0.60 0.00 0.00 56.93 56.75 1t8c s PHE 22 Cb -0.18 -2.43 -0.04 0.00 0.51 0.00 0.00 43.02 40.88 1t8c s PHE 22 CO 0.12 -0.10 0.15 0.20 0.70 0.00 0.00 175.22 176.29 1t8c s GLY 23 N 1.45 2.00 0.03 4.36 0.00 0.62 -4.75 107.32 111.04 1t8c s GLY 23 Ca 0.11 -1.77 -0.01 0.00 0.00 0.00 0.00 44.72 43.05 1t8c s GLY 23 CO 0.09 -1.58 -0.00 1.25 0.00 0.00 0.00 173.10 172.85 1t8c s LYS 24 N -3.85 0.43 0.00 2.90 2.20 -1.26 -0.69 119.74 119.47 1t8c s LYS 24 Ca 0.36 -0.77 0.00 0.00 -0.36 0.00 0.00 55.97 55.20 1t8c s LYS 24 Cb 0.05 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.53 1t8c s LYS 24 CO 0.17 -0.08 0.00 0.41 -0.36 0.00 0.00 175.35 175.49 1t8c n GLY 25 N 1.11 -1.05 0.00 5.54 0.00 -0.04 -4.83 105.19 105.93 1t8c n GLY 25 Ca -0.21 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1t8c n GLY 25 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1t8c n THR 26 N -0.06 0.00 0.00 2.61 -1.04 -1.26 -4.91 114.28 109.62 1t8c n THR 26 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1t8c n THR 26 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1t8c n THR 26 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1t8c n LYS 27 N 0.00 0.00 -2.21 -2.82 4.81 -1.26 -4.98 118.16 111.70 1t8c n LYS 27 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.42 1t8c n LYS 27 Cb 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.04 1t8c n LYS 27 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1t8c n GLN 28 N 0.00 1.60 0.01 1.64 6.02 -1.26 -4.80 117.38 120.58 1t8c n GLN 28 Ca 0.00 -0.29 -0.11 0.00 -0.01 0.00 0.00 57.00 56.60 1t8c n GLN 28 Cb 0.00 0.10 -0.05 0.00 1.02 0.00 0.00 30.24 31.31 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 1.03 -0.05 -0.56 1.08 7.01 -1.99 -1.41 115.95 121.07 1t8c h TRP 29 Ca -0.03 0.01 0.14 0.00 2.11 0.00 0.00 58.89 61.11 1t8c h TRP 29 Cb 0.10 0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.17 1t8c h TRP 29 CO 0.00 -0.04 0.39 -0.39 -2.79 0.00 0.00 178.44 175.61 1t8c h VAL 30 N -0.00 0.78 -0.05 2.65 -1.51 -1.97 0.20 116.25 116.35 1t8c h VAL 30 Ca 0.04 -0.05 -0.15 0.00 -1.23 0.00 0.00 66.70 65.31 1t8c h VAL 30 Cb 0.06 0.63 -0.01 0.00 -2.13 0.00 0.00 31.29 29.84 1t8c h VAL 30 CO -0.09 0.03 -0.63 -0.74 -1.23 0.00 0.00 177.57 174.91 1t8c h HIS 31 N 0.14 0.27 -0.05 5.19 2.76 -1.67 -1.94 115.15 119.85 1t8c h HIS 31 Ca 0.27 -0.11 -0.03 0.00 -2.20 0.00 0.00 60.37 58.30 1t8c h HIS 31 Cb 0.87 -0.05 -0.00 0.00 1.55 0.00 0.00 27.41 29.78 1t8c h HIS 31 CO -0.00 0.78 -0.08 0.00 -1.30 0.00 0.00 177.93 177.33 1t8c h ALA 32 N 1.20 0.07 -0.80 5.26 0.00 0.04 0.14 119.26 125.18 1t8c h ALA 32 Ca -0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1t8c h ALA 32 Cb 1.14 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 1t8c h ALA 32 CO 0.10 -0.09 0.38 0.07 0.00 0.00 0.00 179.25 179.71 1t8c h ARG 33 N -0.35 1.14 -0.17 0.00 -0.00 -1.34 -0.73 114.38 112.93 1t8c h ARG 33 Ca 0.00 -0.16 -0.19 0.00 -0.00 0.00 0.00 59.98 59.63 1t8c h ARG 33 Cb 0.63 -0.21 0.00 0.00 -0.00 0.00 0.00 29.97 30.39 1t8c h ARG 33 CO 0.02 0.88 -0.68 -0.92 -0.00 0.00 0.00 179.97 179.27 1t8c h TYR 34 N 1.14 0.89 -0.44 4.08 5.03 -1.36 -1.23 116.97 125.08 1t8c h TYR 34 Ca 0.28 -0.36 -0.13 0.00 2.58 0.00 0.00 58.73 61.10 1t8c h TYR 34 Cb 0.11 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.23 1t8c h TYR 34 CO 0.01 1.16 -0.24 0.00 -1.32 0.00 0.00 178.16 177.77 1t8c h ALA 35 N 0.75 0.74 0.00 1.82 0.00 -0.67 -2.12 119.26 119.79 1t8c h ALA 35 Ca -0.02 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 1t8c h ALA 35 Cb 1.27 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1t8c h ALA 35 CO 0.13 0.66 -0.53 0.00 0.00 0.00 0.00 179.25 179.52 1t8c h ASP 37 N 0.00 0.00 -0.99 0.00 3.58 -1.03 0.49 116.42 118.48 1t8c h ASP 37 Ca -0.01 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.49 1t8c h ASP 37 Cb 1.32 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.31 1t8c h ASP 37 CO 0.07 0.22 0.64 -0.78 -2.88 0.00 0.00 179.24 176.51 1t8c h ASP 38 N 0.00 1.06 0.00 2.28 1.82 -1.32 -3.44 116.42 116.82 1t8c h ASP 38 Ca -0.00 -0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1t8c h ASP 38 Cb 0.93 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.71 1t8c h ASP 38 CO 0.03 0.71 0.00 0.23 -1.61 0.00 0.00 179.24 178.60 1t8c n MET 39 N -4.46 0.00 0.00 0.28 2.81 -1.22 -5.07 117.12 109.47 1t8c n MET 39 Ca 0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 1t8c n MET 39 Cb 0.13 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.64 1t8c n MET 39 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1t8c n GLU 40 N -0.16 0.00 0.00 0.03 -0.58 -0.91 -5.00 120.64 114.02 1t8c n GLU 40 Ca 0.00 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 1t8c n GLU 40 Cb 0.00 -0.59 0.00 0.00 -0.57 0.00 0.00 31.44 30.28 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 -0.15 -0.06 3.36 0.62 0.00 0.11 -4.82 105.19 104.25 1t8c n GLY 41 Ca 0.00 0.38 -0.10 0.00 0.00 0.00 0.00 46.02 46.30 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 0.80 1.13 -0.33 1.61 0.74 0.27 -4.53 119.66 119.35 1t8c s GLN 42 Ca 0.00 -0.87 -0.29 0.00 0.05 0.00 0.00 55.36 54.25 1t8c s GLN 42 Cb 0.00 0.45 -0.00 0.00 1.10 0.00 0.00 33.01 34.56 1t8c s GLN 42 CO 0.00 -0.44 1.42 -1.17 -0.55 0.00 0.00 175.29 174.55 1t8c s LEU 43 N -2.86 3.75 0.00 3.68 2.96 -1.26 0.35 118.68 125.29 1t8c s LEU 43 Ca 0.08 1.14 0.00 0.00 -0.22 0.00 0.00 54.13 55.12 1t8c s LEU 43 Cb 0.02 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.17 1t8c s LEU 43 CO -0.07 -1.28 0.11 1.33 -1.32 0.00 0.00 176.35 175.12 1t8c n VAL 44 N 6.64 0.00 -3.09 1.68 0.24 -1.25 -3.42 118.33 119.12 1t8c n VAL 44 Ca 0.16 0.17 -0.13 0.00 -2.04 0.00 0.00 64.34 62.50 1t8c n VAL 44 Cb 0.47 -0.23 0.07 0.00 -1.47 0.00 0.00 33.84 32.68 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 -1.86 -2.25 -4.45 -1.34 2.88 -1.26 -4.56 113.62 100.78 1t8c n SER 45 Ca 0.00 -0.48 -0.51 0.00 -1.33 0.00 0.00 58.87 56.55 1t8c n SER 45 Cb 0.00 -4.08 -0.04 0.00 -0.75 0.00 0.00 64.21 59.34 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 -3.38 1.36 -0.46 2.46 -0.00 -1.26 -4.80 119.36 113.28 1t8c n ILE 46 Ca -0.21 -0.34 0.00 0.00 -0.00 0.00 0.00 62.75 62.20 1t8c n ILE 46 Cb 0.63 -0.14 0.00 0.00 -0.00 0.00 0.00 39.64 40.13 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 0.55 0.00 -4.40 4.28 1.44 -1.26 -4.93 115.22 110.90 1t8c n HIS 47 Ca 0.18 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.56 1t8c n HIS 47 Cb 0.21 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.16 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 -0.00 3.13 0.55 4.39 0.01 -1.26 -4.89 113.70 115.63 1t8c s SER 48 Ca 0.00 -0.62 0.39 0.00 1.31 0.00 0.00 55.95 57.03 1t8c s SER 48 Cb 0.00 -1.46 1.57 0.00 0.21 0.00 0.00 66.02 66.33 1t8c s SER 48 CO 0.00 0.04 1.73 -0.65 0.41 0.00 0.00 173.24 174.78 1t8c h PRO 49 N 7.62 0.00 -0.07 12.44 0.11 -1.98 0.50 132.00 150.63 1t8c h PRO 49 Ca -0.39 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.63 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 0.60 0.00 -0.32 1.49 -0.21 0.00 0.00 178.00 179.55 1t8c h GLU 50 N 0.00 0.34 -0.47 1.05 4.81 -1.98 -1.80 114.58 116.53 1t8c h GLU 50 Ca 0.63 -0.27 -0.04 0.00 -0.13 0.00 0.00 59.36 59.55 1t8c h GLU 50 Cb 2.60 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 32.01 1t8c h GLU 50 CO -0.01 0.92 0.15 0.93 -0.73 0.00 0.00 179.01 180.27 1t8c h GLU 51 N -0.16 0.73 -0.73 1.92 5.08 -0.49 0.44 114.58 121.37 1t8c h GLU 51 Ca -0.02 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 1t8c h GLU 51 Cb 0.97 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.09 1t8c h GLU 51 CO 0.07 0.69 0.22 -0.56 -1.00 0.00 0.00 179.01 178.43 1t8c h GLN 52 N 0.62 1.14 -0.22 2.33 -0.00 -1.15 -2.05 115.11 115.79 1t8c h GLN 52 Ca 0.15 -0.25 -0.12 0.00 -0.00 0.00 0.00 58.65 58.44 1t8c h GLN 52 Cb 0.26 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.48 27.57 1t8c h GLN 52 CO -0.01 0.98 -0.36 0.22 -0.00 0.00 0.00 178.83 179.67 1t8c h ASP 53 N 1.09 0.49 0.10 0.06 3.58 -1.03 -0.32 116.42 120.40 1t8c h ASP 53 Ca 0.24 -0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 1t8c h ASP 53 Cb 0.31 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 41.23 1t8c h ASP 53 CO -0.01 0.81 -0.06 -0.26 -2.88 0.00 0.00 179.24 176.84 1t8c h PHE 54 N 0.40 -0.16 -0.04 0.28 0.04 0.53 0.18 116.94 118.17 1t8c h PHE 54 Ca 0.04 -0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.64 1t8c h PHE 54 Cb 0.81 0.06 -0.01 0.00 2.20 0.00 0.00 35.95 39.01 1t8c h PHE 54 CO 0.03 -0.10 -0.74 1.37 -0.60 0.00 0.00 178.31 178.27 1t8c h LEU 55 N -0.16 0.29 -0.79 1.54 8.10 -1.37 -1.27 115.31 121.65 1t8c h LEU 55 Ca -0.01 -0.20 -0.00 0.00 0.11 0.00 0.00 57.88 57.78 1t8c h LEU 55 Cb 0.14 -0.09 -0.04 0.00 -0.44 0.00 0.00 40.66 40.23 1t8c h LEU 55 CO 0.01 0.93 0.48 0.74 -4.11 0.00 0.00 178.44 176.49 1t8c h THR 56 N 0.16 1.22 -0.06 0.15 2.02 -0.76 0.84 112.91 116.48 1t8c h THR 56 Ca -0.03 -0.47 -0.19 0.00 0.77 0.00 0.00 66.41 66.50 1t8c h THR 56 Cb 1.30 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1t8c h THR 56 CO 0.11 0.23 -0.77 0.11 0.37 0.00 0.00 175.52 175.57 1t8c h LYS 57 N 1.08 0.40 -0.02 6.66 1.57 -0.57 -2.97 116.57 122.72 1t8c h LYS 57 Ca 0.28 -0.35 -0.09 0.00 -1.87 0.00 0.00 60.65 58.62 1t8c h LYS 57 Cb -0.06 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1t8c h LYS 57 CO -0.05 1.00 -0.43 1.25 -0.57 0.00 0.00 179.45 180.65 1t8c h HIS 58 N 0.27 0.05 -0.97 -1.35 2.76 -0.38 -3.37 115.15 112.16 1t8c h HIS 58 Ca -0.04 -0.01 -0.59 0.00 -2.20 0.00 0.00 60.37 57.52 1t8c h HIS 58 Cb 1.36 -0.01 -0.09 0.00 1.55 0.00 0.00 27.41 30.22 1t8c h HIS 58 CO 0.05 0.47 1.66 0.00 -1.30 0.00 0.00 177.93 178.81 1t8c s ALA 59 N -4.07 2.80 -0.18 5.26 0.00 0.28 -4.74 121.76 121.11 1t8c s ALA 59 Ca -0.03 -2.42 -0.17 0.00 0.00 0.00 0.00 51.96 49.33 1t8c s ALA 59 Cb 0.14 -4.58 -0.14 0.00 0.00 0.00 0.00 23.12 18.54 1t8c s ALA 59 CO 0.74 -3.68 0.10 0.77 0.00 0.00 0.00 175.76 173.69 1t8c h SER 60 N 9.15 0.00 0.12 0.00 0.02 -1.82 -3.41 113.55 117.61 1t8c h SER 60 Ca 0.28 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1t8c h SER 60 Cb 0.96 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.50 1t8c h SER 60 CO 1.41 1.23 -0.06 -0.74 -1.14 0.00 0.00 176.83 177.54 1t8c h HIS 61 N -1.00 -0.14 -3.62 3.45 2.76 -1.97 -3.47 115.15 111.16 1t8c h HIS 61 Ca -0.23 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 57.87 1t8c h HIS 61 Cb 1.03 0.05 -0.13 0.00 1.55 0.00 0.00 27.41 29.91 1t8c h HIS 61 CO 0.00 0.14 -0.20 0.95 -1.30 0.00 0.00 177.93 177.52 1t8c s THR 62 N -5.05 0.08 1.45 6.26 -4.23 -1.26 -4.97 115.64 107.92 1t8c s THR 62 Ca -0.15 -0.98 -0.23 0.00 -1.18 0.00 0.00 61.69 59.15 1t8c s THR 62 Cb 0.03 -1.44 0.37 0.00 1.34 0.00 0.00 72.50 72.80 1t8c s THR 62 CO 0.63 -0.38 0.87 0.61 -0.54 0.00 0.00 174.62 175.81 1t8c n GLY 63 N -0.19 -3.76 3.58 3.99 0.00 -1.25 -4.45 105.19 103.11 1t8c n GLY 63 Ca -0.13 -1.65 -0.24 0.00 0.00 0.00 0.00 46.02 44.00 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 -3.00 4.04 -0.16 1.61 0.15 -1.23 -1.90 113.70 113.22 1t8c s SER 64 Ca 0.67 -0.95 -0.06 0.00 0.70 0.00 0.00 55.95 56.31 1t8c s SER 64 Cb -0.13 -0.52 -0.04 0.00 -1.71 0.00 0.00 66.02 63.63 1t8c s SER 64 CO 0.57 -0.10 0.04 0.26 1.20 0.00 0.00 173.24 175.20 1t8c s TRP 65 N -2.48 3.21 0.37 3.44 0.51 -1.11 -3.25 118.94 119.63 1t8c s TRP 65 Ca 0.32 0.05 0.08 0.00 -2.12 0.00 0.00 56.10 54.43 1t8c s TRP 65 Cb -0.03 -1.99 -0.04 0.00 -0.81 0.00 0.00 33.47 30.60 1t8c s TRP 65 CO 0.18 0.21 0.19 0.96 -0.51 0.00 0.00 176.95 177.98 1t8c s ILE 66 N 0.05 2.84 -0.66 2.03 -4.36 -1.26 -3.88 121.20 115.97 1t8c s ILE 66 Ca 0.04 -1.63 -0.06 0.00 -0.26 0.00 0.00 60.65 58.74 1t8c s ILE 66 Cb -0.12 -3.00 -0.13 0.00 1.25 0.00 0.00 42.46 40.45 1t8c s ILE 66 CO 0.01 -0.12 2.70 0.61 0.24 0.00 0.00 174.94 178.38 1t8c n GLY 67 N -1.23 3.12 3.08 6.27 0.00 -1.22 -4.63 105.19 110.57 1t8c n GLY 67 Ca -0.02 -1.04 -0.28 0.00 0.00 0.00 0.00 46.02 44.68 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 0.07 1.77 -0.05 0.99 1.98 -1.26 -1.62 118.68 120.56 1t8c s LEU 68 Ca 0.53 -0.41 -0.01 0.00 -2.89 0.00 0.00 54.13 51.34 1t8c s LEU 68 Cb 0.19 -1.06 0.03 0.00 0.66 0.00 0.00 46.19 46.01 1t8c s LEU 68 CO -0.02 0.05 0.03 -0.60 -1.89 0.00 0.00 176.35 173.92 1t8c s ARG 69 N 0.74 0.20 -0.06 1.98 3.00 0.90 -3.37 118.95 122.34 1t8c s ARG 69 Ca -0.12 0.25 -0.12 0.00 -1.00 0.00 0.00 55.73 54.75 1t8c s ARG 69 Cb -0.16 -0.66 -0.05 0.00 0.00 0.00 0.00 34.95 34.08 1t8c s ARG 69 CO 0.03 -0.30 0.29 1.21 0.00 0.00 0.00 175.30 176.53 1t8c s ASN 70 N 1.97 6.61 0.10 -2.12 2.47 0.75 -0.81 114.94 123.91 1t8c s ASN 70 Ca 0.03 0.73 -0.31 0.00 0.42 0.00 0.00 52.86 53.73 1t8c s ASN 70 Cb -0.12 -2.17 -0.08 0.00 -1.45 0.00 0.00 41.25 37.43 1t8c s ASN 70 CO -0.04 0.34 1.42 -0.76 -3.72 0.00 0.00 177.10 174.34 1t8c s LEU 71 N -0.92 4.36 0.00 3.21 1.02 -1.06 -4.35 118.68 120.94 1t8c s LEU 71 Ca 0.20 2.33 0.00 0.00 0.02 0.00 0.00 54.13 56.67 1t8c s LEU 71 Cb -0.14 -3.58 0.00 0.00 0.02 0.00 0.00 46.19 42.48 1t8c s LEU 71 CO 0.09 -0.69 0.00 0.47 0.02 0.00 0.00 176.35 176.24 1t8c n ASP 72 N 4.24 0.00 0.00 2.29 9.92 -1.26 -2.85 116.55 128.89 1t8c n ASP 72 Ca 0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.38 1t8c n ASP 72 Cb 0.42 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.90 1t8c n ASP 72 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1t8c n LEU 73 N 0.00 0.00 -1.19 0.64 -0.00 -1.22 -4.39 117.00 110.84 1t8c n LEU 73 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.12 1t8c n LEU 73 Cb 0.00 0.00 0.26 0.00 -0.00 0.00 0.00 43.42 43.68 1t8c n LEU 73 CO 0.00 0.00 0.72 2.29 -0.00 0.00 0.00 177.39 180.40 1t8c n LYS 74 N -1.32 2.59 0.00 1.47 2.85 -1.26 -3.04 118.16 119.45 1t8c n LYS 74 Ca 0.00 -2.42 0.00 0.00 -1.05 0.00 0.00 58.31 54.84 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 1.48 0.88 3.22 2.58 0.00 -1.13 -5.09 105.19 107.12 1t8c n GLY 75 Ca 0.21 -0.89 -0.22 0.00 0.00 0.00 0.00 46.02 45.11 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 0.03 1.11 0.12 1.61 2.02 -1.26 -4.91 118.70 117.42 1t8c s GLU 76 Ca 0.00 -0.94 -0.30 0.00 0.02 0.00 0.00 54.97 53.75 1t8c s GLU 76 Cb 0.00 -1.21 -0.07 0.00 0.10 0.00 0.00 34.13 32.95 1t8c s GLU 76 CO 0.00 0.30 1.19 -0.59 0.02 0.00 0.00 175.26 176.17 1t8c s PHE 77 N -0.97 3.46 0.00 1.61 -0.12 -1.26 -2.56 117.98 118.14 1t8c s PHE 77 Ca 0.04 1.39 0.04 0.00 -0.05 0.00 0.00 56.93 58.34 1t8c s PHE 77 Cb -0.09 -3.40 -0.01 0.00 -0.63 0.00 0.00 43.02 38.88 1t8c s PHE 77 CO 0.02 -1.16 -0.11 0.42 -0.05 0.00 0.00 175.22 174.34 1t8c s ILE 78 N 0.46 0.88 0.51 -4.49 1.01 0.01 -3.10 121.20 116.48 1t8c s ILE 78 Ca 0.55 -0.60 -0.20 0.00 0.00 0.00 0.00 60.65 60.41 1t8c s ILE 78 Cb -0.31 -0.76 -0.07 0.00 0.01 0.00 0.00 42.46 41.33 1t8c s ILE 78 CO 0.33 0.16 1.06 0.26 0.00 0.00 0.00 174.94 176.74 1t8c s TRP 79 N -0.43 2.93 0.61 3.97 0.52 0.07 -0.07 118.94 126.54 1t8c s TRP 79 Ca 0.03 1.56 0.33 0.00 0.02 0.00 0.00 56.10 58.04 1t8c s TRP 79 Cb -0.05 -3.10 1.95 0.00 -1.15 0.00 0.00 33.47 31.12 1t8c s TRP 79 CO -0.00 -1.00 2.27 -0.24 0.02 0.00 0.00 176.95 178.00 1t8c h VAL 80 N 1.37 0.40 0.00 4.03 3.04 -1.62 0.31 116.25 123.77 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 1.23 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 31.49 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 -3.66 0.00 -0.38 3.17 2.03 -1.26 -4.88 116.55 111.56 1t8c n ASP 81 Ca -0.03 -0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.19 1t8c n ASP 81 Cb 0.10 -0.28 0.00 0.00 -0.72 0.00 0.00 41.12 40.22 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 0.92 0.89 2.75 0.27 0.00 0.11 -5.09 105.19 105.04 1t8c n GLY 82 Ca 0.12 -0.42 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.59 0.73 0.67 1.61 0.01 -1.21 -4.92 113.70 108.00 1t8c s SER 83 Ca 0.00 0.15 -0.17 0.00 1.31 0.00 0.00 55.95 57.24 1t8c s SER 83 Cb 0.00 0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.20 1t8c s SER 83 CO 0.00 -0.22 0.75 1.41 0.41 0.00 0.00 173.24 175.59 1t8c n HIS 84 N 5.00 0.00 -1.55 2.43 8.25 -1.26 -0.75 115.22 127.33 1t8c n HIS 84 Ca -0.10 0.40 -0.34 0.00 -0.26 0.00 0.00 57.72 57.41 1t8c n HIS 84 Cb 0.50 -2.02 0.08 0.00 1.12 0.00 0.00 29.99 29.67 1t8c n HIS 84 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1t8c s VAL 85 N -1.76 2.50 0.00 1.59 1.01 -1.18 -4.76 120.40 117.80 1t8c s VAL 85 Ca 0.71 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1t8c s VAL 85 Cb -0.38 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1t8c s VAL 85 CO 0.52 -0.13 0.00 0.47 0.00 0.00 0.00 175.10 175.97 1t8c n ASP 86 N -2.54 0.00 0.02 3.32 8.00 -1.26 -4.92 116.55 119.17 1t8c n ASP 86 Ca 0.13 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.42 1t8c n ASP 86 Cb 0.50 -0.09 -0.14 0.00 -0.02 0.00 0.00 41.12 41.37 1t8c n ASP 86 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1t8c h TYR 87 N 0.00 0.47 -3.31 1.24 3.20 -1.95 -3.51 116.97 113.12 1t8c h TYR 87 Ca 0.00 -0.34 0.34 0.00 3.14 0.00 0.00 58.73 61.87 1t8c h TYR 87 Cb 0.00 -0.02 -0.16 0.00 1.54 0.00 0.00 36.73 38.09 1t8c h TYR 87 CO 0.00 1.47 -1.02 -1.13 -1.64 0.00 0.00 178.16 175.84 1t8c n SER 88 N -4.00 -7.75 0.00 -2.11 3.41 -1.26 -4.93 113.62 96.98 1t8c n SER 88 Ca -0.21 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.56 1t8c n SER 88 Cb 0.87 -4.65 0.00 0.00 -0.26 0.00 0.00 64.21 60.18 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 -4.31 2.09 0.00 4.04 3.02 -1.26 -5.09 115.26 113.75 1t8c n ASN 89 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 1t8c n ASN 89 Cb 0.66 0.35 0.00 0.00 -0.61 0.00 0.00 39.78 40.18 1t8c n ASN 89 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1t8c n TRP 90 N -0.78 0.00 -1.67 3.10 7.02 -1.26 -4.55 117.44 119.29 1t8c n TRP 90 Ca 0.00 0.00 -0.48 0.00 -1.02 0.00 0.00 57.50 56.00 1t8c n TRP 90 Cb 0.06 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 28.91 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 0.73 0.88 1.02 6.99 0.00 0.17 -4.84 120.51 125.45 1t8c n ALA 91 Ca 0.00 0.36 0.02 0.00 0.00 0.00 0.00 53.44 53.82 1t8c n ALA 91 Cb 0.00 -2.40 0.08 0.00 0.00 0.00 0.00 19.45 17.12 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 5.18 1.59 0.00 0.00 -0.04 -1.26 -3.85 135.00 136.61 1t8c n PRO 92 Ca 0.21 -0.59 0.15 0.00 -0.04 0.00 0.00 63.50 63.22 1t8c n PRO 92 Cb 0.28 -1.42 0.75 0.00 -0.04 0.00 0.00 33.50 33.07 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 0.40 -0.87 2.52 0.55 0.00 -1.26 -4.37 105.19 102.16 1t8c n GLY 93 Ca 0.05 -0.25 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 1t8c n GLY 93 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1t8c n GLU 94 N -0.85 0.35 -0.03 1.61 2.13 -1.25 -5.01 120.64 117.59 1t8c n GLU 94 Ca 0.19 -2.73 -0.13 0.00 0.66 0.00 0.00 57.16 55.15 1t8c n GLU 94 Cb 0.22 -1.57 -0.08 0.00 0.27 0.00 0.00 31.44 30.28 1t8c n GLU 94 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1t8c h PRO 95 N 5.30 0.18 -6.16 5.31 0.13 -1.87 -3.44 132.00 131.45 1t8c h PRO 95 Ca 0.18 -0.09 -0.58 0.00 -0.87 0.00 0.00 66.00 64.63 1t8c h PRO 95 Cb 0.98 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.07 1t8c h PRO 95 CO 0.24 0.59 -0.14 0.95 -0.23 0.00 0.00 178.00 179.41 1t8c s THR 96 N -4.40 4.93 -0.20 1.56 -4.23 -1.26 -5.08 115.64 106.95 1t8c s THR 96 Ca -0.15 0.86 -0.23 0.00 -1.18 0.00 0.00 61.69 60.99 1t8c s THR 96 Cb 0.04 -3.75 0.06 0.00 1.34 0.00 0.00 72.50 70.19 1t8c s THR 96 CO 0.71 0.43 0.63 -0.94 -0.54 0.00 0.00 174.62 174.92 1t8c s SER 97 N -1.37 -0.64 0.00 3.99 1.04 -1.26 -5.03 113.70 110.43 1t8c s SER 97 Ca 0.30 1.16 0.26 0.00 0.48 0.00 0.00 55.95 58.15 1t8c s SER 97 Cb -0.16 1.16 0.70 0.00 0.10 0.00 0.00 66.02 67.82 1t8c s SER 97 CO 0.17 -0.28 1.54 0.54 0.98 0.00 0.00 173.24 176.19 1t8c n ARG 98 N 2.44 1.41 -4.89 4.02 5.12 -1.26 -4.83 116.66 118.67 1t8c n ARG 98 Ca -0.15 -0.93 -0.32 0.00 -1.93 0.00 0.00 57.85 54.52 1t8c n ARG 98 Cb 0.56 -1.48 -0.16 0.00 -1.16 0.00 0.00 32.46 30.21 1t8c n ARG 98 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1t8c s SER 99 N -2.24 3.29 -0.37 0.55 1.04 -1.26 -5.00 113.70 109.71 1t8c s SER 99 Ca 0.29 -0.53 0.07 0.00 0.48 0.00 0.00 55.95 56.26 1t8c s SER 99 Cb 0.20 -1.47 0.67 0.00 0.10 0.00 0.00 66.02 65.53 1t8c s SER 99 CO 0.42 0.12 1.80 0.00 0.98 0.00 0.00 173.24 176.57 1t8c n GLN 100 N 3.78 2.77 -2.51 4.02 10.64 -1.26 -4.97 117.38 129.85 1t8c n GLN 100 Ca -0.19 -3.06 -0.42 0.00 -1.83 0.00 0.00 57.00 51.49 1t8c n GLN 100 Cb 0.52 -2.13 -0.03 0.00 -0.86 0.00 0.00 30.24 27.74 1t8c n GLN 100 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 1t8c s GLY 101 N -1.40 2.18 -0.28 2.61 0.00 -1.26 -4.05 107.32 105.12 1t8c s GLY 101 Ca 0.54 0.58 0.01 0.00 0.00 0.00 0.00 44.72 45.85 1t8c s GLY 101 CO 0.10 2.14 0.44 -0.54 0.00 0.00 0.00 173.10 175.24 1t8c s GLU 102 N 2.10 0.43 0.00 2.90 2.02 -1.17 -1.51 118.70 123.47 1t8c s GLU 102 Ca 0.54 0.41 0.00 0.00 0.02 0.00 0.00 54.97 55.94 1t8c s GLU 102 Cb -0.24 -0.21 0.00 0.00 0.10 0.00 0.00 34.13 33.79 1t8c s GLU 102 CO 0.22 -0.86 0.00 -3.47 0.02 0.00 0.00 175.26 171.17 1t8c n ASP 103 N 5.37 3.15 -3.60 -0.19 2.03 -1.25 -3.38 116.55 118.70 1t8c n ASP 103 Ca -0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 1t8c n ASP 103 Cb 0.50 0.57 -0.05 0.00 -0.72 0.00 0.00 41.12 41.43 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 -3.33 3.93 0.37 0.00 1.01 -1.22 -2.25 120.40 118.92 1t8c s VAL 105 Ca -0.00 -0.37 0.08 0.00 0.00 0.00 0.00 61.98 61.69 1t8c s VAL 105 Cb 0.01 -2.67 -0.06 0.00 0.00 0.00 0.00 36.38 33.65 1t8c s VAL 105 CO -0.09 0.55 -0.00 0.00 0.00 0.00 0.00 175.10 175.56 1t8c s MET 106 N -0.29 1.98 -0.08 2.72 0.23 0.68 -4.13 119.30 120.41 1t8c s MET 106 Ca 0.05 -1.92 0.03 0.00 -1.03 0.00 0.00 55.69 52.82 1t8c s MET 106 Cb -0.13 -1.78 0.01 0.00 -1.53 0.00 0.00 34.83 31.40 1t8c s MET 106 CO 0.02 0.06 -0.17 1.41 -2.03 0.00 0.00 175.02 174.31 1t8c s MET 107 N -3.70 2.29 0.00 3.16 -2.45 -1.20 0.12 119.30 117.51 1t8c s MET 107 Ca 0.35 -0.61 0.00 0.00 -1.25 0.00 0.00 55.69 54.18 1t8c s MET 107 Cb 0.04 -1.81 0.00 0.00 1.25 0.00 0.00 34.83 34.31 1t8c s MET 107 CO 0.18 0.08 0.00 2.89 1.05 0.00 0.00 175.02 179.22 1t8c n ARG 108 N 3.73 0.00 0.00 4.11 1.85 -0.50 -3.49 116.66 122.37 1t8c n ARG 108 Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.64 1t8c n ARG 108 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 1t8c n ARG 108 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1t8c n GLY 109 N 0.00 1.19 1.29 2.89 0.00 -1.26 -2.31 105.19 106.99 1t8c n GLY 109 Ca 0.00 0.35 -0.06 0.00 0.00 0.00 0.00 46.02 46.31 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 10.83 3.15 -1.83 1.61 7.64 -1.26 -4.78 113.62 128.98 1t8c n SER 110 Ca 0.00 -2.39 -0.15 0.00 1.01 0.00 0.00 58.87 57.33 1t8c n SER 110 Cb 0.00 -0.58 -0.00 0.00 -1.01 0.00 0.00 64.21 62.62 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 0.09 -0.25 0.00 0.23 0.00 -0.98 -4.98 105.19 99.31 1t8c n GLY 111 Ca 0.15 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.58 2.39 -4.07 1.61 1.85 -1.03 -4.70 116.66 110.13 1t8c n ARG 112 Ca -0.17 0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 56.46 1t8c n ARG 112 Cb 0.63 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.99 1t8c n ARG 112 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1t8c s TRP 113 N 1.91 2.95 -0.06 2.89 0.52 -1.26 -1.40 118.94 124.49 1t8c s TRP 113 Ca 0.00 -0.20 -0.03 0.00 0.02 0.00 0.00 56.10 55.89 1t8c s TRP 113 Cb 0.00 -1.49 0.04 0.00 -1.15 0.00 0.00 33.47 30.87 1t8c s TRP 113 CO 0.00 0.44 0.10 1.21 0.02 0.00 0.00 176.95 178.72 1t8c s ASN 114 N -3.85 0.87 -0.63 2.95 3.84 0.32 0.43 114.94 118.86 1t8c s ASN 114 Ca 0.35 0.19 -0.16 0.00 0.21 0.00 0.00 52.86 53.45 1t8c s ASN 114 Cb -0.07 0.05 0.15 0.00 -0.55 0.00 0.00 41.25 40.83 1t8c s ASN 114 CO 0.24 -0.24 0.63 -0.62 -2.79 0.00 0.00 177.10 174.32 1t8c s ASP 115 N 2.13 6.34 0.16 -4.21 -1.08 -1.26 -0.23 116.67 118.52 1t8c s ASP 115 Ca 0.03 -1.94 -0.21 0.00 -0.52 0.00 0.00 52.55 49.91 1t8c s ASP 115 Cb -0.12 -2.23 0.05 0.00 -1.46 0.00 0.00 42.92 39.16 1t8c s ASP 115 CO -0.04 -0.85 0.55 0.00 0.52 0.00 0.00 175.17 175.35 1t8c s ALA 116 N 1.51 -1.33 -0.04 3.66 0.00 -0.95 -4.79 121.76 119.82 1t8c s ALA 116 Ca 0.09 0.22 -0.39 0.00 0.00 0.00 0.00 51.96 51.88 1t8c s ALA 116 Cb -0.23 0.84 -0.18 0.00 0.00 0.00 0.00 23.12 23.54 1t8c s ALA 116 CO 0.00 -0.76 1.28 0.34 0.00 0.00 0.00 175.76 176.63 1t8c n PHE 117 N -0.34 1.21 -2.11 0.00 -0.00 -0.57 -3.14 117.46 112.51 1t8c n PHE 117 Ca -0.15 0.86 -0.38 0.00 -0.00 0.00 0.00 57.45 57.78 1t8c n PHE 117 Cb 0.64 -2.23 -0.03 0.00 -0.00 0.00 0.00 39.48 37.86 1t8c n PHE 117 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1t8c n ASP 119 N 10.15 6.33 -2.77 0.00 2.03 -1.26 -4.75 116.55 126.28 1t8c n ASP 119 Ca 0.48 -3.74 -0.03 0.00 0.52 0.00 0.00 54.79 52.02 1t8c n ASP 119 Cb 0.45 -0.88 -0.02 0.00 -0.72 0.00 0.00 41.12 39.94 1t8c n ASP 119 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1t8c n ARG 120 N -0.31 -3.41 0.00 -0.67 3.00 -1.26 -5.00 116.66 109.01 1t8c n ARG 120 Ca 0.44 2.69 0.00 0.00 -0.00 0.00 0.00 57.85 60.99 1t8c n ARG 120 Cb 0.35 -4.04 0.00 0.00 0.00 0.00 0.00 32.46 28.77 1t8c n ARG 120 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1t8c n LYS 121 N 1.60 2.91 -0.28 -0.14 3.00 -1.26 -5.11 118.16 118.88 1t8c n LYS 121 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.09 1t8c n LYS 121 Cb 0.38 -0.30 0.00 0.00 0.00 0.00 0.00 35.03 35.11 1t8c n LYS 121 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1t8c n LEU 122 N -0.16 0.00 -0.07 3.14 4.32 -1.26 -4.77 117.00 118.21 1t8c n LEU 122 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1t8c n LEU 122 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1t8c n LEU 122 CO 0.00 -0.02 0.03 0.61 -1.22 0.00 0.00 177.39 176.79 1t8c n GLY 123 N 5.00 0.82 3.09 -0.72 0.00 -1.24 -4.88 105.19 107.26 1t8c n GLY 123 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 1.15 -0.25 4.61 0.00 -0.80 -0.86 121.76 125.62 1t8c s ALA 124 Ca 0.00 -0.57 -0.05 0.00 0.00 0.00 0.00 51.96 51.33 1t8c s ALA 124 Cb 0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.80 1t8c s ALA 124 CO 0.00 0.26 0.02 1.67 0.00 0.00 0.00 175.76 177.71 1t8c s TRP 125 N -0.22 3.06 -0.09 0.00 1.48 0.13 -2.73 118.94 120.56 1t8c s TRP 125 Ca 0.03 -0.89 0.01 0.00 -1.06 0.00 0.00 56.10 54.19 1t8c s TRP 125 Cb -0.06 -2.18 -0.02 0.00 -1.16 0.00 0.00 33.47 30.04 1t8c s TRP 125 CO -0.00 -0.53 -0.11 0.08 -4.06 0.00 0.00 176.95 172.33 1t8c s VAL 126 N 1.50 3.32 0.17 -0.66 1.01 -1.25 -0.27 120.40 124.22 1t8c s VAL 126 Ca 0.04 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.44 1t8c s VAL 126 Cb -0.16 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 1t8c s VAL 126 CO -0.00 0.56 0.02 0.00 0.00 0.00 0.00 175.10 175.68 1t8c s ASP 128 N -3.15 2.13 0.29 0.00 -4.77 0.15 0.93 116.67 112.25 1t8c s ASP 128 Ca 0.25 -0.45 -0.17 0.00 -3.30 0.00 0.00 52.55 48.88 1t8c s ASP 128 Cb 0.07 -0.18 0.02 0.00 -1.09 0.00 0.00 42.92 41.73 1t8c s ASP 128 CO 0.04 0.14 0.64 0.00 0.70 0.00 0.00 175.17 176.69 1t8c s ARG 129 N -0.98 1.78 0.10 2.11 1.04 -0.23 0.97 118.95 123.73 1t8c s ARG 129 Ca 0.06 -1.17 -0.25 0.00 -1.04 0.00 0.00 55.73 53.33 1t8c s ARG 129 Cb -0.08 0.56 -0.07 0.00 -2.04 0.00 0.00 34.95 33.33 1t8c s ARG 129 CO 0.01 -0.79 0.77 -0.51 -0.04 0.00 0.00 175.30 174.73 1t8c s LEU 130 N -2.98 4.51 1.13 -1.89 2.01 -1.26 -0.02 118.68 120.18 1t8c s LEU 130 Ca 0.16 1.53 -0.18 0.00 0.01 0.00 0.00 54.13 55.64 1t8c s LEU 130 Cb -0.04 -3.25 0.14 0.00 0.01 0.00 0.00 46.19 43.05 1t8c s LEU 130 CO 0.09 0.10 0.12 0.00 1.01 0.00 0.00 176.35 177.67 1t8c n ALA 131 N 2.28 -3.91 -2.87 4.21 0.00 -1.20 -4.78 120.51 114.24 1t8c n ALA 131 Ca -0.04 -1.31 -0.44 0.00 0.00 0.00 0.00 53.44 51.65 1t8c n ALA 131 Cb 0.50 -1.51 -0.06 0.00 0.00 0.00 0.00 19.45 18.38 1t8c n ALA 131 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1t8c s THR 132 N -2.23 4.86 0.00 0.00 2.01 -1.26 -4.52 115.64 114.50 1t8c s THR 132 Ca 0.56 -0.65 0.00 0.00 0.31 0.00 0.00 61.69 61.91 1t8c s THR 132 Cb -0.12 -4.36 0.00 0.00 0.01 0.00 0.00 72.50 68.03 1t8c s THR 132 CO 0.64 -0.90 0.00 0.00 -0.69 0.00 0.00 174.62 173.66 1t8c n THR 134 N 0.00 0.00 -0.23 0.00 -2.24 -1.26 -4.93 114.28 105.62 1t8c n THR 134 Ca 0.00 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 1t8c n THR 134 Cb 0.00 0.00 0.12 0.00 -2.10 0.00 0.00 70.33 68.35 1t8c n THR 134 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1t8c h PRO 135 N 0.00 0.11 -6.73 -0.78 0.11 -1.93 -3.40 132.00 119.38 1t8c h PRO 135 Ca 0.00 -0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.54 1t8c h PRO 135 Cb 0.00 -0.02 0.10 0.00 0.11 0.00 0.00 31.00 31.18 1t8c h PRO 135 CO 0.00 0.07 0.63 -2.30 -0.21 0.00 0.00 178.00 176.19 1t8c n PRO 136 N -5.31 2.26 -3.78 1.05 -0.02 -1.26 -2.16 135.00 125.78 1t8c n PRO 136 Ca 0.11 0.80 -0.28 0.00 -2.02 0.00 0.00 63.50 62.11 1t8c n PRO 136 Cb 0.40 -2.45 0.05 0.00 -0.02 0.00 0.00 33.50 31.48 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 1.08 -1.30 0.10 3.55 0.00 -1.26 -4.78 120.51 117.90 1t8c n ALA 137 Ca 0.07 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1t8c n ALA 137 Cb 0.35 -4.94 0.00 0.00 0.00 0.00 0.00 19.45 14.86 1t8c n ALA 137 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1t8c n SER 138 N -2.92 -0.98 -3.76 0.00 7.64 -0.92 -5.05 113.62 107.64 1t8c n SER 138 Ca 0.03 0.37 -0.27 0.00 1.01 0.00 0.00 58.87 60.01 1t8c n SER 138 Cb 0.54 1.07 0.05 0.00 -1.01 0.00 0.00 64.21 64.86 1t8c n SER 138 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1t8c n GLU 139 N -3.05 -6.59 -2.77 1.43 1.02 -0.97 -4.92 120.64 104.80 1t8c n GLU 139 Ca 0.00 0.70 -0.43 0.00 -0.02 0.00 0.00 57.16 57.42 1t8c n GLU 139 Cb 0.00 -5.66 -0.03 0.00 -0.02 0.00 0.00 31.44 25.73 1t8c n GLU 139 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1t8c s GLY 140 N -3.39 1.63 0.10 0.62 0.00 -1.26 -4.76 107.32 100.26 1t8c s GLY 140 Ca 0.59 -0.18 0.00 0.00 0.00 0.00 0.00 44.72 45.12 1t8c s GLY 140 CO 0.78 2.05 0.00 1.44 0.00 0.00 0.00 173.10 177.37 1t8c n SER 141 N 6.53 -0.21 -1.75 1.64 7.64 -1.26 -4.89 113.62 121.32 1t8c n SER 141 Ca 0.09 0.18 -0.10 0.00 1.01 0.00 0.00 58.87 60.04 1t8c n SER 141 Cb 0.47 0.30 0.23 0.00 -1.01 0.00 0.00 64.21 64.21 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 -2.82 4.71 -1.44 -0.43 0.00 -1.26 -5.36 120.51 113.90 1t8c n ALA 142 Ca 0.00 -2.74 0.00 0.00 0.00 0.00 0.00 53.44 50.70 1t8c n ALA 142 Cb 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1t8c n ALA 142 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59