#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 -1.97 3.77 0.23 0.00 -1.26 -5.14 105.19 100.82 1t8c n GLY 2 Ca 0.00 -1.17 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 1t8c n GLY 2 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1t8c s PHE 3 N -2.34 2.73 0.00 1.61 -0.71 -1.26 -5.02 117.98 113.00 1t8c s PHE 3 Ca 0.00 1.54 0.00 0.00 -1.04 0.00 0.00 56.93 57.43 1t8c s PHE 3 Cb 0.00 -3.29 0.00 0.00 -1.21 0.00 0.00 43.02 38.52 1t8c s PHE 3 CO 0.00 -1.51 0.00 0.28 -1.34 0.00 0.00 175.22 172.65 1t8c n VAL 4 N -1.11 0.00 -1.29 -2.49 0.31 -1.26 -5.11 118.33 107.38 1t8c n VAL 4 Ca 0.11 0.12 0.16 0.00 -0.01 0.00 0.00 64.34 64.71 1t8c n VAL 4 Cb 0.50 -0.89 -0.08 0.00 -0.91 0.00 0.00 33.84 32.46 1t8c n VAL 4 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1t8c n ASN 6 N -4.11 -4.22 0.00 0.00 2.85 -0.80 -4.90 115.26 104.09 1t8c n ASN 6 Ca -0.07 -0.18 0.07 0.00 -0.11 0.00 0.00 54.58 54.29 1t8c n ASN 6 Cb 0.61 -2.67 0.42 0.00 1.24 0.00 0.00 39.78 39.37 1t8c n ASN 6 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 1t8c n THR 7 N -1.82 0.00 -3.61 -0.44 5.66 -1.25 -4.35 114.28 108.47 1t8c n THR 7 Ca -0.02 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.59 1t8c n THR 7 Cb 0.53 -0.59 -0.07 0.00 -1.55 0.00 0.00 70.33 68.64 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 7.21 0.00 0.00 0.00 0.13 -1.79 -3.47 132.00 134.09 1t8c h PRO 9 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1t8c h PRO 9 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1t8c h PRO 9 CO 0.72 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.58 1t8c n GLU 10 N -3.24 0.00 -0.32 0.86 2.13 -1.26 -4.87 120.64 113.94 1t8c n GLU 10 Ca -0.01 0.00 0.18 0.00 0.66 0.00 0.00 57.16 57.98 1t8c n GLU 10 Cb 0.05 0.00 0.42 0.00 0.27 0.00 0.00 31.44 32.18 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 -7.01 5.31 1.57 -1.94 -3.40 116.57 111.64 1t8c h LYS 11 Ca 0.00 -0.03 -0.50 0.00 -1.87 0.00 0.00 60.65 58.24 1t8c h LYS 11 Cb 0.00 -0.12 0.06 0.00 0.08 0.00 0.00 32.23 32.25 1t8c h LYS 11 CO 0.00 0.36 0.47 -1.58 -0.57 0.00 0.00 179.45 178.13 1t8c s TRP 12 N -5.65 2.87 -0.04 -1.35 0.52 -1.25 -4.06 118.94 109.97 1t8c s TRP 12 Ca -0.10 1.54 -0.00 0.00 0.02 0.00 0.00 56.10 57.56 1t8c s TRP 12 Cb 0.25 -3.36 0.03 0.00 -1.15 0.00 0.00 33.47 29.24 1t8c s TRP 12 CO 0.80 -1.48 0.01 0.42 0.02 0.00 0.00 176.95 176.72 1t8c s ILE 13 N -1.58 0.15 0.12 2.03 -1.09 -0.62 -4.48 121.20 115.72 1t8c s ILE 13 Ca 0.65 0.17 0.05 0.00 -2.23 0.00 0.00 60.65 59.28 1t8c s ILE 13 Cb -0.28 -0.29 -0.04 0.00 -1.58 0.00 0.00 42.46 40.28 1t8c s ILE 13 CO 0.33 0.17 0.06 0.21 -1.23 0.00 0.00 174.94 174.48 1t8c s ASN 14 N 1.42 5.25 0.00 3.58 3.84 -1.26 0.11 114.94 127.87 1t8c s ASN 14 Ca -0.04 -0.16 0.00 0.00 0.21 0.00 0.00 52.86 52.87 1t8c s ASN 14 Cb -0.13 -1.31 0.00 0.00 -0.55 0.00 0.00 41.25 39.27 1t8c s ASN 14 CO -0.03 0.13 0.00 0.49 -2.79 0.00 0.00 177.10 174.90 1t8c n PHE 15 N 0.16 0.00 -0.26 0.43 3.72 0.16 -4.95 117.46 116.72 1t8c n PHE 15 Ca -0.09 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.38 1t8c n PHE 15 Cb 0.53 0.00 0.20 0.00 -0.94 0.00 0.00 39.48 39.27 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 0.29 0.00 -1.08 -0.00 -2.04 -3.39 115.11 108.89 1t8c h GLN 16 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.63 1t8c h GLN 16 Cb 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 27.48 27.41 1t8c h GLN 16 CO 0.00 0.19 0.00 -2.13 -0.00 0.00 0.00 178.83 176.89 1t8c n ARG 17 N -5.13 0.00 -4.30 0.06 0.00 -1.26 -5.14 116.66 100.89 1t8c n ARG 17 Ca 0.15 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.76 1t8c n ARG 17 Cb 0.49 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.87 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 -0.14 0.00 -1.26 -2.72 119.74 118.14 1t8c s LYS 18 Ca 0.00 -1.39 0.06 0.00 0.00 0.00 0.00 55.97 54.65 1t8c s LYS 18 Cb 0.00 -2.15 -0.06 0.00 0.00 0.00 0.00 37.83 35.62 1t8c s LYS 18 CO 0.00 0.38 -0.03 0.00 0.00 0.00 0.00 175.35 175.70 1t8c s TYR 20 N -2.99 1.97 -0.42 0.00 1.51 0.29 -0.67 117.35 117.03 1t8c s TYR 20 Ca 0.32 -0.71 -0.16 0.00 -1.01 0.00 0.00 57.07 55.50 1t8c s TYR 20 Cb 0.05 -1.35 0.03 0.00 -0.11 0.00 0.00 41.96 40.58 1t8c s TYR 20 CO 0.14 -0.29 0.40 -0.47 -1.11 0.00 0.00 175.55 174.21 1t8c s TYR 21 N 0.33 3.19 -0.24 2.71 5.04 0.26 -1.59 117.35 127.05 1t8c s TYR 21 Ca -0.12 -0.49 -0.13 0.00 -2.44 0.00 0.00 57.07 53.89 1t8c s TYR 21 Cb -0.15 -2.83 -0.04 0.00 0.35 0.00 0.00 41.96 39.28 1t8c s TYR 21 CO 0.05 -0.68 0.27 -0.06 -1.34 0.00 0.00 175.55 173.78 1t8c s PHE 22 N 1.97 3.30 0.36 4.97 0.40 -1.26 -0.56 117.98 127.16 1t8c s PHE 22 Ca 0.09 0.33 0.04 0.00 -0.60 0.00 0.00 56.93 56.80 1t8c s PHE 22 Cb -0.18 -2.41 -0.03 0.00 0.51 0.00 0.00 43.02 40.90 1t8c s PHE 22 CO 0.12 -0.05 0.16 0.20 0.70 0.00 0.00 175.22 176.35 1t8c s GLY 23 N 1.30 2.37 0.19 4.36 0.00 0.45 -4.76 107.32 111.24 1t8c s GLY 23 Ca 0.12 -1.57 0.06 0.00 0.00 0.00 0.00 44.72 43.32 1t8c s GLY 23 CO 0.08 -1.69 -0.10 0.54 0.00 0.00 0.00 173.10 171.93 1t8c s LYS 24 N -3.71 1.23 0.00 2.90 3.01 -1.26 -1.26 119.74 120.66 1t8c s LYS 24 Ca 0.31 -1.56 0.00 0.00 -1.01 0.00 0.00 55.97 53.71 1t8c s LYS 24 Cb 0.03 -0.83 0.00 0.00 -1.01 0.00 0.00 37.83 36.02 1t8c s LYS 24 CO 0.18 0.08 0.00 0.41 0.51 0.00 0.00 175.35 176.53 1t8c n GLY 25 N -0.32 0.86 7.00 -3.33 0.00 -0.63 -4.67 105.19 104.10 1t8c n GLY 25 Ca -0.08 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.69 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 0.00 0.00 0.00 2.61 -1.04 -1.26 -4.04 114.28 110.55 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 0.29 -0.64 0.00 0.00 175.07 174.72 1t8c n LYS 27 N -0.97 0.00 -2.76 -2.82 5.02 -1.26 -5.01 118.16 110.36 1t8c n LYS 27 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1t8c n LYS 27 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1t8c n LYS 27 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1t8c n GLN 28 N -2.22 1.19 0.04 1.97 6.02 -1.26 -4.45 117.38 118.68 1t8c n GLN 28 Ca 0.00 -1.07 -0.12 0.00 -0.01 0.00 0.00 57.00 55.79 1t8c n GLN 28 Cb 0.00 0.44 -0.08 0.00 1.02 0.00 0.00 30.24 31.63 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 1.15 -0.04 -0.56 1.08 7.01 -1.88 -2.26 115.95 120.45 1t8c h TRP 29 Ca -0.11 -0.00 0.14 0.00 2.11 0.00 0.00 58.89 61.03 1t8c h TRP 29 Cb 0.37 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 27.42 1t8c h TRP 29 CO 0.00 0.07 0.39 -0.39 -2.79 0.00 0.00 178.44 175.72 1t8c h VAL 30 N -0.14 0.78 -0.05 2.65 -1.51 -1.97 0.21 116.25 116.22 1t8c h VAL 30 Ca -0.00 -0.04 -0.14 0.00 -1.23 0.00 0.00 66.70 65.28 1t8c h VAL 30 Cb 0.13 0.64 -0.01 0.00 -2.13 0.00 0.00 31.29 29.91 1t8c h VAL 30 CO 0.01 0.02 -0.62 0.45 -1.23 0.00 0.00 177.57 176.20 1t8c h HIS 31 N 0.13 0.23 -0.04 5.19 3.86 -1.82 -2.08 115.15 120.61 1t8c h HIS 31 Ca 0.27 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 1t8c h HIS 31 Cb 0.88 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.31 1t8c h HIS 31 CO -0.00 0.74 -0.07 0.00 0.86 0.00 0.00 177.93 179.46 1t8c h ALA 32 N 1.23 0.07 -0.79 2.45 0.00 -0.11 -0.12 119.26 121.99 1t8c h ALA 32 Ca -0.01 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1t8c h ALA 32 Cb 1.12 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1t8c h ALA 32 CO 0.09 -0.10 0.40 0.07 0.00 0.00 0.00 179.25 179.71 1t8c h ARG 33 N -0.37 1.12 -0.20 0.00 -0.00 -1.36 -0.47 114.38 113.09 1t8c h ARG 33 Ca 0.00 -0.14 -0.20 0.00 -0.00 0.00 0.00 59.98 59.64 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 0.84 -0.68 -0.92 -0.00 0.00 0.00 179.97 179.23 1t8c h TYR 34 N 1.12 1.03 -0.46 4.08 5.03 -1.38 -1.17 116.97 125.20 1t8c h TYR 34 Ca 0.28 -0.42 -0.12 0.00 2.58 0.00 0.00 58.73 61.05 1t8c h TYR 34 Cb 0.07 -0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.16 1t8c h TYR 34 CO 0.01 1.24 -0.18 0.00 -1.32 0.00 0.00 178.16 177.91 1t8c h ALA 35 N 0.66 0.80 0.00 1.82 0.00 -0.72 -2.14 119.26 119.68 1t8c h ALA 35 Ca -0.02 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 1t8c h ALA 35 Cb 1.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1t8c h ALA 35 CO 0.14 0.65 -0.53 0.00 0.00 0.00 0.00 179.25 179.51 1t8c h ASP 37 N 0.00 0.00 -0.99 0.00 3.32 -0.99 -0.10 116.42 117.66 1t8c h ASP 37 Ca -0.01 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.09 1t8c h ASP 37 Cb 1.31 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.81 1t8c h ASP 37 CO 0.07 0.19 0.65 -0.78 -1.72 0.00 0.00 179.24 177.64 1t8c h ASP 38 N 0.00 1.06 0.00 6.45 3.58 -1.32 -3.44 116.42 122.76 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 0.91 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.72 1t8c h ASP 38 CO 0.02 0.72 0.00 0.23 -2.88 0.00 0.00 179.24 177.33 1t8c n MET 39 N -4.45 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 0.12 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.63 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 -0.14 0.00 0.00 0.03 -0.58 -0.91 -5.00 120.64 114.04 1t8c n GLU 40 Ca 0.00 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 1t8c n GLU 40 Cb 0.00 -0.65 0.00 0.00 -0.57 0.00 0.00 31.44 30.22 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 -0.26 -0.50 3.36 0.62 0.00 -0.10 -4.81 105.19 103.50 1t8c n GLY 41 Ca 0.00 0.49 -0.10 0.00 0.00 0.00 0.00 46.02 46.41 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 0.59 1.14 -0.33 1.61 0.74 0.27 -4.60 119.66 119.08 1t8c s GLN 42 Ca 0.00 -0.86 -0.29 0.00 0.05 0.00 0.00 55.36 54.26 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 -0.45 1.41 -1.17 -0.55 0.00 0.00 175.29 174.53 1t8c s LEU 43 N -2.86 3.75 0.00 3.68 2.96 -1.26 0.37 118.68 125.32 1t8c s LEU 43 Ca 0.07 1.12 0.00 0.00 -0.22 0.00 0.00 54.13 55.10 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 -1.27 0.16 1.33 -1.32 0.00 0.00 176.35 175.18 1t8c n VAL 44 N 6.63 0.00 -2.97 1.68 0.24 -1.25 -3.43 118.33 119.22 1t8c n VAL 44 Ca 0.16 0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 62.60 1t8c n VAL 44 Cb 0.47 -0.35 0.06 0.00 -1.47 0.00 0.00 33.84 32.55 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 -1.78 -3.06 -4.50 -1.34 2.88 -1.26 -4.53 113.62 100.02 1t8c n SER 45 Ca 0.00 -0.47 -0.52 0.00 -1.33 0.00 0.00 58.87 56.55 1t8c n SER 45 Cb 0.00 -3.91 -0.05 0.00 -0.75 0.00 0.00 64.21 59.50 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 -3.13 0.94 -0.45 2.46 -0.00 -1.26 -4.80 119.36 113.11 1t8c n ILE 46 Ca -0.16 -0.23 0.00 0.00 -0.00 0.00 0.00 62.75 62.35 1t8c n ILE 46 Cb 0.61 -0.33 0.00 0.00 -0.00 0.00 0.00 39.64 39.93 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 1.05 0.00 -4.37 4.28 1.44 -1.26 -4.93 115.22 111.42 1t8c n HIS 47 Ca 0.17 -0.06 -0.33 0.00 -2.01 0.00 0.00 57.72 55.50 1t8c n HIS 47 Cb 0.19 -0.01 -0.16 0.00 0.12 0.00 0.00 29.99 30.14 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 -0.11 3.10 0.53 4.39 0.01 -1.26 -4.87 113.70 115.49 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 -1.45 1.57 0.00 0.21 0.00 0.00 66.02 66.35 1t8c s SER 48 CO 0.00 0.03 1.73 -0.65 0.41 0.00 0.00 173.24 174.77 1t8c h PRO 49 N 7.66 0.03 -0.07 12.44 0.11 -1.97 0.54 132.00 150.74 1t8c h PRO 49 Ca -0.40 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.60 1t8c h PRO 49 Cb 1.16 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.27 1t8c h PRO 49 CO 0.60 0.02 -0.39 1.49 -0.21 0.00 0.00 178.00 179.51 1t8c h GLU 50 N 0.03 0.39 -0.47 1.05 4.81 -1.98 -2.02 114.58 116.39 1t8c h GLU 50 Ca 0.68 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 59.56 1t8c h GLU 50 Cb 2.65 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 32.08 1t8c h GLU 50 CO -0.05 0.96 0.17 0.93 -0.73 0.00 0.00 179.01 180.30 1t8c h GLU 51 N -0.08 0.71 -0.71 1.92 5.08 -0.40 0.48 114.58 121.58 1t8c h GLU 51 Ca -0.03 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 1t8c h GLU 51 Cb 1.04 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 1t8c h GLU 51 CO 0.08 0.66 0.18 -0.56 -1.00 0.00 0.00 179.01 178.37 1t8c h GLN 52 N 0.62 1.13 -0.23 2.33 -0.00 -1.17 -2.11 115.11 115.69 1t8c h GLN 52 Ca 0.15 -0.27 -0.11 0.00 -0.00 0.00 0.00 58.65 58.43 1t8c h GLN 52 Cb 0.23 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.48 27.54 1t8c h GLN 52 CO -0.01 0.99 -0.32 0.22 -0.00 0.00 0.00 178.83 179.71 1t8c h ASP 53 N 1.07 0.48 0.14 0.06 3.58 -1.06 0.09 116.42 120.78 1t8c h ASP 53 Ca 0.22 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 1t8c h ASP 53 Cb 0.36 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.28 1t8c h ASP 53 CO 0.00 0.78 -0.07 -0.26 -2.88 0.00 0.00 179.24 176.81 1t8c h PHE 54 N 0.40 -0.18 -0.04 0.28 0.04 0.59 0.27 116.94 118.29 1t8c h PHE 54 Ca 0.05 -0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.64 1t8c h PHE 54 Cb 0.76 0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.97 1t8c h PHE 54 CO 0.02 -0.11 -0.76 1.37 -0.60 0.00 0.00 178.31 178.24 1t8c h LEU 55 N -0.20 0.33 -0.81 1.54 8.10 -1.38 -1.08 115.31 121.82 1t8c h LEU 55 Ca -0.02 -0.23 -0.00 0.00 0.11 0.00 0.00 57.88 57.74 1t8c h LEU 55 Cb 0.15 -0.10 -0.04 0.00 -0.44 0.00 0.00 40.66 40.23 1t8c h LEU 55 CO 0.03 0.97 0.50 0.74 -4.11 0.00 0.00 178.44 176.57 1t8c h THR 56 N 0.18 1.22 -0.07 0.15 2.02 -0.71 0.69 112.91 116.39 1t8c h THR 56 Ca -0.03 -0.47 -0.19 0.00 0.77 0.00 0.00 66.41 66.49 1t8c h THR 56 Cb 1.33 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1t8c h THR 56 CO 0.12 0.23 -0.76 0.50 0.37 0.00 0.00 175.52 175.98 1t8c h LYS 57 N 1.10 0.40 -0.09 6.66 1.63 -0.40 -2.91 116.57 122.97 1t8c h LYS 57 Ca 0.29 -0.34 -0.07 0.00 -0.85 0.00 0.00 60.65 59.68 1t8c h LYS 57 Cb -0.06 0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 1t8c h LYS 57 CO -0.06 0.99 -0.27 1.25 -3.45 0.00 0.00 179.45 177.91 1t8c h HIS 58 N 0.27 0.17 -1.84 1.91 2.76 -0.24 -3.36 115.15 114.82 1t8c h HIS 58 Ca -0.04 -0.03 -0.65 0.00 -2.20 0.00 0.00 60.37 57.45 1t8c h HIS 58 Cb 1.34 -0.04 -0.14 0.00 1.55 0.00 0.00 27.41 30.11 1t8c h HIS 58 CO 0.05 0.42 1.14 0.00 -1.30 0.00 0.00 177.93 178.24 1t8c s ALA 59 N -4.43 3.11 0.00 5.26 0.00 0.23 -4.92 121.76 121.02 1t8c s ALA 59 Ca -0.04 -2.58 0.00 0.00 0.00 0.00 0.00 51.96 49.34 1t8c s ALA 59 Cb 0.15 -4.26 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1t8c s ALA 59 CO 0.74 -3.24 0.38 0.43 0.00 0.00 0.00 175.76 174.06 1t8c n SER 60 N 7.52 0.00 -0.65 0.00 7.64 -1.26 -4.33 113.62 122.54 1t8c n SER 60 Ca 0.28 0.38 0.07 0.00 1.01 0.00 0.00 58.87 60.62 1t8c n SER 60 Cb 0.50 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.89 1t8c n SER 60 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1t8c n HIS 61 N -0.42 0.63 -3.60 1.43 8.25 -1.26 -4.87 115.22 115.37 1t8c n HIS 61 Ca 0.00 -0.77 -0.29 0.00 -0.26 0.00 0.00 57.72 56.40 1t8c n HIS 61 Cb 0.00 -0.20 -0.15 0.00 1.12 0.00 0.00 29.99 30.76 1t8c n HIS 61 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1t8c s THR 62 N -2.24 0.21 1.12 1.59 -4.23 -1.26 -4.87 115.64 105.96 1t8c s THR 62 Ca 0.33 -0.91 -0.18 0.00 -1.18 0.00 0.00 61.69 59.75 1t8c s THR 62 Cb 0.25 -1.15 0.15 0.00 1.34 0.00 0.00 72.50 73.08 1t8c s THR 62 CO 0.09 -0.68 0.15 0.61 -0.54 0.00 0.00 174.62 174.25 1t8c n GLY 63 N 5.13 -2.59 3.58 3.99 0.00 -1.26 -4.13 105.19 109.90 1t8c n GLY 63 Ca -0.05 -0.86 -0.24 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.96 4.01 -0.14 1.61 0.15 -1.19 -0.88 113.70 115.30 1t8c s SER 64 Ca 0.52 -0.98 -0.04 0.00 0.70 0.00 0.00 55.95 56.16 1t8c s SER 64 Cb -0.10 -0.49 -0.03 0.00 -1.71 0.00 0.00 66.02 63.68 1t8c s SER 64 CO 0.57 -0.11 -0.02 0.26 1.20 0.00 0.00 173.24 175.14 1t8c s TRP 65 N -2.50 3.07 0.36 3.44 0.51 -1.06 -2.91 118.94 119.86 1t8c s TRP 65 Ca 0.32 -0.14 0.08 0.00 -2.12 0.00 0.00 56.10 54.24 1t8c s TRP 65 Cb -0.02 -1.93 -0.04 0.00 -0.81 0.00 0.00 33.47 30.67 1t8c s TRP 65 CO 0.18 0.10 0.20 0.96 -0.51 0.00 0.00 176.95 177.88 1t8c s ILE 66 N 0.08 2.90 -1.07 2.03 -4.36 -1.26 -3.80 121.20 115.73 1t8c s ILE 66 Ca 0.01 -1.61 -0.07 0.00 -0.26 0.00 0.00 60.65 58.71 1t8c s ILE 66 Cb -0.13 -3.01 -0.09 0.00 1.25 0.00 0.00 42.46 40.48 1t8c s ILE 66 CO 0.02 -0.12 2.59 0.61 0.24 0.00 0.00 174.94 178.28 1t8c n GLY 67 N -1.24 3.49 3.07 6.27 0.00 -1.22 -4.62 105.19 110.93 1t8c n GLY 67 Ca -0.02 -1.13 -0.28 0.00 0.00 0.00 0.00 46.02 44.60 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 1.75 -0.04 0.99 1.98 -1.26 -0.83 118.68 121.37 1t8c s LEU 68 Ca 0.54 -0.41 -0.02 0.00 -2.89 0.00 0.00 54.13 51.35 1t8c s LEU 68 Cb 0.16 -1.06 0.03 0.00 0.66 0.00 0.00 46.19 45.98 1t8c s LEU 68 CO -0.04 0.04 0.07 -0.60 -1.89 0.00 0.00 176.35 173.93 1t8c s ARG 69 N 0.81 -0.06 0.39 1.98 3.52 0.11 -3.11 118.95 122.60 1t8c s ARG 69 Ca -0.10 0.37 -0.05 0.00 -0.13 0.00 0.00 55.73 55.82 1t8c s ARG 69 Cb -0.16 -0.44 -0.04 0.00 -1.56 0.00 0.00 34.95 32.75 1t8c s ARG 69 CO 0.01 -0.30 0.67 1.21 -0.81 0.00 0.00 175.30 176.09 1t8c s ASN 70 N 2.01 6.36 0.00 -2.12 2.47 0.83 -0.58 114.94 123.91 1t8c s ASN 70 Ca 0.03 0.81 0.00 0.00 0.42 0.00 0.00 52.86 54.11 1t8c s ASN 70 Cb -0.12 -2.19 0.00 0.00 -1.45 0.00 0.00 41.25 37.49 1t8c s ASN 70 CO -0.03 -0.39 0.00 0.18 -3.72 0.00 0.00 177.10 173.13 1t8c n LEU 71 N -1.67 0.00 0.00 3.21 4.77 -1.06 -4.62 117.00 117.62 1t8c n LEU 71 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1t8c n LEU 71 Cb 0.55 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 1t8c n LEU 71 CO 0.50 0.00 0.00 0.47 -1.33 0.00 0.00 177.39 177.03 1t8c n ASP 72 N 0.00 0.00 0.00 -1.43 8.00 -1.26 -4.90 116.55 116.96 1t8c n ASP 72 Ca 0.00 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.54 1t8c n ASP 72 Cb 0.00 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 1t8c n ASP 72 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1t8c n LEU 73 N -1.11 0.00 0.00 0.64 -0.00 -1.24 -4.48 117.00 110.81 1t8c n LEU 73 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 56.01 56.04 1t8c n LEU 73 Cb 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 43.42 43.61 1t8c n LEU 73 CO 0.00 0.00 0.54 2.29 -0.00 0.00 0.00 177.39 180.22 1t8c n LYS 74 N -0.62 0.82 0.00 1.47 2.85 -1.26 -2.77 118.16 118.64 1t8c n LYS 74 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1t8c n LYS 74 Cb 0.00 -1.12 0.00 0.00 -0.65 0.00 0.00 35.03 33.26 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 0.40 -0.37 3.19 2.58 0.00 -1.26 -5.06 105.19 104.67 1t8c n GLY 75 Ca 0.05 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 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 1.12 0.33 1.61 2.02 -1.26 -5.03 118.70 117.49 1t8c s GLU 76 Ca 0.00 -0.85 -0.12 0.00 0.02 0.00 0.00 54.97 54.02 1t8c s GLU 76 Cb 0.00 -1.18 -0.08 0.00 0.10 0.00 0.00 34.13 32.97 1t8c s GLU 76 CO 0.00 0.30 0.69 -0.59 0.02 0.00 0.00 175.26 175.68 1t8c s PHE 77 N -0.85 3.42 -0.00 1.61 -0.12 -1.26 -2.58 117.98 118.20 1t8c s PHE 77 Ca 0.04 1.05 0.02 0.00 -0.05 0.00 0.00 56.93 57.99 1t8c s PHE 77 Cb -0.08 -2.42 -0.01 0.00 -0.63 0.00 0.00 43.02 39.88 1t8c s PHE 77 CO 0.02 0.07 -0.08 0.42 -0.05 0.00 0.00 175.22 175.60 1t8c s ILE 78 N -2.08 0.62 0.51 -4.49 1.01 0.26 -1.89 121.20 115.14 1t8c s ILE 78 Ca 0.51 -0.40 -0.19 0.00 0.00 0.00 0.00 60.65 60.57 1t8c s ILE 78 Cb -0.10 -0.53 -0.07 0.00 0.01 0.00 0.00 42.46 41.76 1t8c s ILE 78 CO 0.23 0.13 1.04 0.26 0.00 0.00 0.00 174.94 176.61 1t8c s TRP 79 N -0.28 3.00 0.64 3.97 0.51 0.10 0.07 118.94 126.96 1t8c s TRP 79 Ca 0.02 1.56 0.39 0.00 -2.12 0.00 0.00 56.10 55.94 1t8c s TRP 79 Cb -0.04 -3.05 2.18 0.00 -0.81 0.00 0.00 33.47 31.75 1t8c s TRP 79 CO -0.00 -0.89 2.31 -0.24 -0.51 0.00 0.00 176.95 177.61 1t8c h VAL 80 N 1.28 0.19 0.00 4.03 3.04 -1.32 0.44 116.25 123.91 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 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 31.48 1t8c h VAL 80 CO 0.59 0.00 0.00 -0.67 -1.01 0.00 0.00 177.57 176.48 1t8c n ASP 81 N -3.36 0.00 -0.25 3.17 2.03 -1.26 -4.89 116.55 111.99 1t8c n ASP 81 Ca -0.03 0.38 0.00 0.00 0.52 0.00 0.00 54.79 55.67 1t8c n ASP 81 Cb 0.10 -0.46 0.00 0.00 -0.72 0.00 0.00 41.12 40.04 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 1.08 0.90 2.91 0.27 0.00 0.15 -5.10 105.19 105.41 1t8c n GLY 82 Ca 0.07 -0.27 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.33 1.85 0.99 1.61 0.01 -1.21 -4.90 113.70 109.73 1t8c s SER 83 Ca 0.00 -0.25 -0.11 0.00 1.31 0.00 0.00 55.95 56.90 1t8c s SER 83 Cb 0.00 -0.73 0.19 0.00 0.21 0.00 0.00 66.02 65.69 1t8c s SER 83 CO 0.00 -0.09 1.09 -1.38 0.41 0.00 0.00 173.24 173.27 1t8c s HIS 84 N 1.42 1.78 0.13 2.43 -3.43 -1.26 0.01 115.29 116.37 1t8c s HIS 84 Ca -0.01 1.40 -0.34 0.00 -0.80 0.00 0.00 55.06 55.31 1t8c s HIS 84 Cb -0.13 -3.19 -0.17 0.00 -1.43 0.00 0.00 32.58 27.66 1t8c s HIS 84 CO -0.04 -3.02 1.14 0.28 -2.00 0.00 0.00 174.74 171.09 1t8c n VAL 85 N -4.34 0.68 0.00 -5.38 0.31 -0.79 -4.78 118.33 104.03 1t8c n VAL 85 Ca 0.07 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1t8c n VAL 85 Cb 0.54 -0.66 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 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 2.03 0.00 0.03 4.52 8.00 -1.26 -4.94 116.55 124.93 1t8c n ASP 86 Ca 0.17 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.46 1t8c n ASP 86 Cb 0.21 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.17 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 0.52 -2.62 1.24 3.20 -1.91 -3.50 116.97 113.89 1t8c h TYR 87 Ca 0.00 -0.38 0.26 0.00 3.14 0.00 0.00 58.73 61.75 1t8c h TYR 87 Cb 0.00 -0.02 -0.10 0.00 1.54 0.00 0.00 36.73 38.15 1t8c h TYR 87 CO 0.00 1.67 -0.60 -1.13 -1.64 0.00 0.00 178.16 176.46 1t8c n SER 88 N -3.48 -6.08 0.00 -2.11 3.41 -1.26 -4.95 113.62 99.15 1t8c n SER 88 Ca -0.27 0.68 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1t8c n SER 88 Cb 1.06 -3.68 0.00 0.00 -0.26 0.00 0.00 64.21 61.33 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 -4.26 0.74 -2.75 4.04 3.02 -1.26 -5.04 115.26 109.75 1t8c n ASN 89 Ca -0.02 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.43 1t8c n ASN 89 Cb 0.63 0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.82 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 -1.09 -0.34 -1.43 3.10 7.02 -1.26 -4.32 117.44 119.12 1t8c n TRP 90 Ca 0.00 0.18 0.18 0.00 -1.02 0.00 0.00 57.50 56.84 1t8c n TRP 90 Cb 0.08 -0.68 -0.07 0.00 -2.42 0.00 0.00 31.31 28.22 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 -1.81 -3.76 0.22 6.99 0.00 0.40 -4.26 120.51 118.29 1t8c n ALA 91 Ca -0.04 0.69 0.05 0.00 0.00 0.00 0.00 53.44 54.14 1t8c n ALA 91 Cb 0.17 -1.43 0.51 0.00 0.00 0.00 0.00 19.45 18.69 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 -1.40 0.02 0.00 0.00 0.13 -1.86 -3.45 132.00 125.44 1t8c h PRO 92 Ca -0.09 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1t8c h PRO 92 Cb 1.37 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 1t8c h PRO 92 CO 0.05 0.18 0.00 0.41 -0.23 0.00 0.00 178.00 178.41 1t8c n GLY 93 N -1.07 0.44 2.94 1.56 0.00 -1.26 -5.11 105.19 102.70 1t8c n GLY 93 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 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 2.53 -0.14 1.61 2.02 -1.26 -5.07 118.70 118.39 1t8c s GLU 94 Ca 0.00 -3.26 -0.32 0.00 0.02 0.00 0.00 54.97 51.41 1t8c s GLU 94 Cb 0.00 -3.49 -0.09 0.00 0.10 0.00 0.00 34.13 30.65 1t8c s GLU 94 CO 0.00 -1.26 2.05 -2.30 0.02 0.00 0.00 175.26 173.76 1t8c n PRO 95 N 2.15 2.11 -2.29 0.39 -0.02 -1.26 -4.94 135.00 131.14 1t8c n PRO 95 Ca 0.18 0.71 -0.36 0.00 -2.02 0.00 0.00 63.50 62.01 1t8c n PRO 95 Cb 0.35 -2.87 -0.01 0.00 -0.02 0.00 0.00 33.50 30.95 1t8c n PRO 95 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1t8c s THR 96 N 5.87 3.21 0.11 3.45 -1.32 -1.26 -4.96 115.64 120.75 1t8c s THR 96 Ca 0.97 0.84 -0.18 0.00 -1.21 0.00 0.00 61.69 62.11 1t8c s THR 96 Cb -0.56 -3.39 -0.04 0.00 -1.51 0.00 0.00 72.50 67.00 1t8c s THR 96 CO 0.44 -0.08 1.65 0.28 -2.21 0.00 0.00 174.62 174.71 1t8c h SER 97 N 1.71 0.43 -1.52 8.08 0.02 -2.07 -3.34 113.55 116.86 1t8c h SER 97 Ca -0.50 -0.17 -0.68 0.00 -0.84 0.00 0.00 61.79 59.60 1t8c h SER 97 Cb 1.25 -0.11 -0.13 0.00 0.14 0.00 0.00 62.40 63.55 1t8c h SER 97 CO 0.59 0.48 1.61 -0.13 -1.14 0.00 0.00 176.83 178.24 1t8c s ARG 98 N -5.53 3.87 0.14 3.45 1.81 -1.26 -4.93 118.95 116.50 1t8c s ARG 98 Ca -0.13 -1.94 -0.03 0.00 -1.72 0.00 0.00 55.73 51.90 1t8c s ARG 98 Cb 0.09 -5.27 -0.03 0.00 -0.45 0.00 0.00 34.95 29.28 1t8c s ARG 98 CO 0.73 -2.04 0.11 0.45 -0.68 0.00 0.00 175.30 173.88 1t8c s SER 99 N 3.90 0.25 0.00 0.23 0.15 -1.26 -5.17 113.70 111.80 1t8c s SER 99 Ca 0.46 -1.11 0.00 0.00 0.70 0.00 0.00 55.95 56.00 1t8c s SER 99 Cb -0.00 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.64 1t8c s SER 99 CO -0.01 -0.76 0.00 0.00 1.20 0.00 0.00 173.24 173.67 1t8c n GLN 100 N -0.12 0.00 -1.22 5.44 1.13 -1.26 -5.15 117.38 116.20 1t8c n GLN 100 Ca -0.06 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.65 1t8c n GLN 100 Cb 0.63 0.00 0.10 0.00 0.11 0.00 0.00 30.24 31.09 1t8c n GLN 100 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1t8c n GLY 101 N 0.00 -0.41 3.94 1.08 0.00 -1.26 -4.53 105.19 104.01 1t8c n GLY 101 Ca 0.00 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 1t8c n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t8c s GLU 102 N -3.63 2.81 0.00 1.61 2.02 -1.12 0.72 118.70 121.11 1t8c s GLU 102 Ca 0.72 -0.37 0.00 0.00 0.02 0.00 0.00 54.97 55.34 1t8c s GLU 102 Cb -0.32 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.51 1t8c s GLU 102 CO 0.52 -0.61 0.00 -3.47 0.02 0.00 0.00 175.26 171.71 1t8c n ASP 103 N -2.40 0.00 -3.66 -0.19 -0.08 -1.22 -3.69 116.55 105.31 1t8c n ASP 103 Ca 0.05 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.17 1t8c n ASP 103 Cb 0.58 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.97 1t8c n ASP 103 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1t8c s VAL 105 N -1.05 4.40 0.37 0.00 1.01 -1.18 -2.41 120.40 121.53 1t8c s VAL 105 Ca -0.11 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.77 1t8c s VAL 105 Cb -0.03 -2.92 -0.07 0.00 0.00 0.00 0.00 36.38 33.36 1t8c s VAL 105 CO 0.06 0.52 -0.01 0.00 0.00 0.00 0.00 175.10 175.67 1t8c s MET 106 N -0.08 1.96 -0.08 2.72 0.23 0.07 -3.99 119.30 120.13 1t8c s MET 106 Ca 0.04 -1.94 0.03 0.00 -1.03 0.00 0.00 55.69 52.79 1t8c s MET 106 Cb -0.13 -1.76 0.01 0.00 -1.53 0.00 0.00 34.83 31.42 1t8c s MET 106 CO 0.02 0.05 -0.18 1.41 -2.03 0.00 0.00 175.02 174.29 1t8c s MET 107 N -3.69 2.33 0.00 3.16 -2.45 -1.14 0.74 119.30 118.24 1t8c s MET 107 Ca 0.35 -0.63 0.00 0.00 -1.25 0.00 0.00 55.69 54.16 1t8c s MET 107 Cb 0.04 -1.83 0.00 0.00 1.25 0.00 0.00 34.83 34.29 1t8c s MET 107 CO 0.18 0.09 0.00 -2.13 1.05 0.00 0.00 175.02 174.21 1t8c n ARG 108 N 3.70 -0.81 0.00 4.11 0.63 -0.57 -3.15 116.66 120.57 1t8c n ARG 108 Ca -0.21 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.72 1t8c n ARG 108 Cb 0.52 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.43 1t8c n ARG 108 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1t8c n GLY 109 N 0.00 1.12 1.47 5.14 0.00 -1.26 -2.91 105.19 108.75 1t8c n GLY 109 Ca 0.00 0.34 -0.06 0.00 0.00 0.00 0.00 46.02 46.30 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 9.98 4.63 -3.27 1.61 7.64 -1.26 -4.77 113.62 128.18 1t8c n SER 110 Ca 0.00 -2.51 -0.24 0.00 1.01 0.00 0.00 58.87 57.13 1t8c n SER 110 Cb 0.00 -0.86 0.02 0.00 -1.01 0.00 0.00 64.21 62.36 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 0.66 -0.51 0.00 0.23 0.00 -1.15 -4.93 105.19 99.49 1t8c n GLY 111 Ca 0.12 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -4.03 1.47 -4.09 1.61 -4.01 -1.14 -4.77 116.66 101.69 1t8c n ARG 112 Ca -0.05 0.00 -0.22 0.00 -1.04 0.00 0.00 57.85 56.54 1t8c n ARG 112 Cb 0.58 0.00 -0.05 0.00 -3.04 0.00 0.00 32.46 29.95 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 1.38 2.99 -0.07 2.89 0.52 -1.26 -1.51 118.94 123.88 1t8c s TRP 113 Ca 0.00 -0.18 -0.03 0.00 0.02 0.00 0.00 56.10 55.92 1t8c s TRP 113 Cb 0.00 -1.45 0.04 0.00 -1.15 0.00 0.00 33.47 30.91 1t8c s TRP 113 CO 0.00 0.47 0.12 -0.80 0.02 0.00 0.00 176.95 176.76 1t8c s ASN 114 N -3.84 0.77 -0.51 2.95 -0.87 0.23 -0.45 114.94 113.21 1t8c s ASN 114 Ca 0.34 0.23 -0.16 0.00 -1.57 0.00 0.00 52.86 51.71 1t8c s ASN 114 Cb -0.07 0.12 0.10 0.00 -0.02 0.00 0.00 41.25 41.38 1t8c s ASN 114 CO 0.24 -0.23 0.45 -0.62 -2.57 0.00 0.00 177.10 174.37 1t8c s ASP 115 N 2.10 6.17 0.17 -1.22 -1.08 -1.26 -0.75 116.67 120.80 1t8c s ASP 115 Ca 0.02 -1.58 -0.19 0.00 -0.52 0.00 0.00 52.55 50.28 1t8c s ASP 115 Cb -0.12 -2.20 0.04 0.00 -1.46 0.00 0.00 42.92 39.18 1t8c s ASP 115 CO -0.05 -0.77 0.52 0.00 0.52 0.00 0.00 175.17 175.40 1t8c s ALA 116 N 1.63 -1.18 0.48 3.66 0.00 -1.01 -4.73 121.76 120.62 1t8c s ALA 116 Ca 0.04 0.07 -0.19 0.00 0.00 0.00 0.00 51.96 51.88 1t8c s ALA 116 Cb -0.27 0.82 -0.15 0.00 0.00 0.00 0.00 23.12 23.52 1t8c s ALA 116 CO 0.05 -0.75 -0.03 0.34 0.00 0.00 0.00 175.76 175.37 1t8c n PHE 117 N -0.32 -2.55 -1.25 0.00 -0.00 0.22 -2.39 117.46 111.16 1t8c n PHE 117 Ca -0.14 0.49 -0.40 0.00 -0.00 0.00 0.00 57.45 57.40 1t8c n PHE 117 Cb 0.64 -1.73 -0.04 0.00 -0.00 0.00 0.00 39.48 38.35 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 6.47 0.26 -4.77 0.00 2.03 -1.26 -4.84 116.55 114.44 1t8c n ASP 119 Ca 0.51 -0.79 -0.39 0.00 0.52 0.00 0.00 54.79 54.64 1t8c n ASP 119 Cb 0.35 0.09 -0.01 0.00 -0.72 0.00 0.00 41.12 40.83 1t8c n ASP 119 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1t8c s ARG 120 N -0.09 4.02 -0.68 -0.67 1.81 -1.25 -4.99 118.95 117.10 1t8c s ARG 120 Ca 0.00 1.96 -0.10 0.00 -1.72 0.00 0.00 55.73 55.87 1t8c s ARG 120 Cb 0.00 -2.71 0.18 0.00 -0.45 0.00 0.00 34.95 31.97 1t8c s ARG 120 CO 0.00 -0.39 0.57 0.21 -0.68 0.00 0.00 175.30 175.01 1t8c s LYS 121 N -2.27 3.04 0.00 3.54 2.47 -1.26 -4.77 119.74 120.48 1t8c s LYS 121 Ca 0.57 -2.30 0.00 0.00 -1.56 0.00 0.00 55.97 52.68 1t8c s LYS 121 Cb -0.33 -4.12 0.00 0.00 -1.46 0.00 0.00 37.83 31.92 1t8c s LYS 121 CO 0.42 -1.24 0.00 1.28 0.16 0.00 0.00 175.35 175.97 1t8c n LEU 122 N 4.10 0.00 -0.15 5.43 4.32 -1.26 -4.96 117.00 124.48 1t8c n LEU 122 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 1t8c n LEU 122 Cb 0.42 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.22 1t8c n LEU 122 CO 0.37 0.00 0.08 0.61 -1.22 0.00 0.00 177.39 177.22 1t8c n GLY 123 N 5.00 0.73 3.22 -0.72 0.00 -1.21 -4.81 105.19 107.40 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 -0.90 -0.28 4.61 0.00 -0.06 -1.61 121.76 123.52 1t8c s ALA 124 Ca 0.00 1.22 -0.08 0.00 0.00 0.00 0.00 51.96 53.10 1t8c s ALA 124 Cb 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.37 1t8c s ALA 124 CO 0.00 -0.21 0.10 1.67 0.00 0.00 0.00 175.76 177.32 1t8c s TRP 125 N 0.87 3.13 -0.09 0.00 1.48 -0.39 -2.57 118.94 121.38 1t8c s TRP 125 Ca -0.06 -0.60 0.01 0.00 -1.06 0.00 0.00 56.10 54.39 1t8c s TRP 125 Cb -0.06 -2.28 -0.02 0.00 -1.16 0.00 0.00 33.47 29.94 1t8c s TRP 125 CO -0.06 -0.44 -0.10 0.08 -4.06 0.00 0.00 176.95 172.36 1t8c s VAL 126 N 1.59 3.39 0.18 -0.66 1.01 -1.25 -0.41 120.40 124.24 1t8c s VAL 126 Ca 0.05 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1t8c s VAL 126 Cb -0.16 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 1t8c s VAL 126 CO 0.04 0.56 0.04 0.00 0.00 0.00 0.00 175.10 175.74 1t8c s ASP 128 N -3.17 2.25 -0.04 0.00 -4.77 0.16 0.93 116.67 112.02 1t8c s ASP 128 Ca 0.28 -0.47 -0.26 0.00 -3.30 0.00 0.00 52.55 48.80 1t8c s ASP 128 Cb 0.07 -0.19 0.05 0.00 -1.09 0.00 0.00 42.92 41.76 1t8c s ASP 128 CO 0.06 0.15 0.56 -0.60 0.70 0.00 0.00 175.17 176.04 1t8c s ARG 129 N -1.03 0.92 0.29 2.11 6.06 0.16 0.94 118.95 128.41 1t8c s ARG 129 Ca 0.06 0.14 -0.29 0.00 -2.50 0.00 0.00 55.73 53.14 1t8c s ARG 129 Cb -0.08 0.43 -0.10 0.00 0.06 0.00 0.00 34.95 35.26 1t8c s ARG 129 CO 0.01 -0.28 1.35 -0.51 -2.50 0.00 0.00 175.30 173.38 1t8c s LEU 130 N -1.18 4.41 0.24 -0.88 2.01 -1.26 0.08 118.68 122.10 1t8c s LEU 130 Ca -0.11 2.66 -0.28 0.00 0.01 0.00 0.00 54.13 56.40 1t8c s LEU 130 Cb -0.02 -3.64 -0.16 0.00 0.01 0.00 0.00 46.19 42.39 1t8c s LEU 130 CO 0.08 -0.59 0.74 0.00 1.01 0.00 0.00 176.35 177.58 1t8c n ALA 131 N 1.47 -1.68 -2.71 4.21 0.00 -1.10 -4.74 120.51 115.96 1t8c n ALA 131 Ca 0.03 0.41 -0.36 0.00 0.00 0.00 0.00 53.44 53.52 1t8c n ALA 131 Cb 0.41 -1.79 -0.08 0.00 0.00 0.00 0.00 19.45 17.99 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 -1.04 5.33 0.00 0.00 2.01 -1.26 -4.89 115.64 115.79 1t8c s THR 132 Ca 0.62 0.40 0.00 0.00 0.31 0.00 0.00 61.69 63.02 1t8c s THR 132 Cb -0.82 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.11 1t8c s THR 132 CO 0.58 0.38 0.17 0.00 -0.69 0.00 0.00 174.62 175.06 1t8c s THR 134 N 0.00 -0.00 -0.25 0.00 -4.23 -1.26 -4.70 115.64 105.20 1t8c s THR 134 Ca 0.00 0.00 -0.29 0.00 -1.18 0.00 0.00 61.69 60.22 1t8c s THR 134 Cb 0.00 -0.35 -0.02 0.00 1.34 0.00 0.00 72.50 73.47 1t8c s THR 134 CO 0.00 0.00 1.56 -2.16 -0.54 0.00 0.00 174.62 173.48 1t8c s PRO 135 N 0.14 3.78 -0.49 3.99 0.04 -1.26 -4.92 135.00 136.29 1t8c s PRO 135 Ca -0.00 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.31 1t8c s PRO 135 Cb -0.02 -4.02 -0.10 0.00 0.04 0.00 0.00 34.50 30.41 1t8c s PRO 135 CO 0.00 -1.30 2.39 -2.30 0.04 0.00 0.00 177.00 175.83 1t8c n PRO 136 N 7.66 1.06 0.04 0.56 -0.02 -1.26 -4.72 135.00 138.32 1t8c n PRO 136 Ca 0.18 0.14 -0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1t8c n PRO 136 Cb 0.46 -2.97 -0.00 0.00 -0.02 0.00 0.00 33.50 30.97 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 13.39 2.92 -1.92 3.55 0.00 -1.26 -5.08 120.51 132.10 1t8c n ALA 137 Ca 0.41 -0.03 -0.27 0.00 0.00 0.00 0.00 53.44 53.55 1t8c n ALA 137 Cb 0.40 0.21 0.07 0.00 0.00 0.00 0.00 19.45 20.14 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 -5.86 4.73 -0.21 0.00 0.01 -1.26 -5.01 113.70 106.10 1t8c s SER 138 Ca -0.01 0.58 -0.29 0.00 1.31 0.00 0.00 55.95 57.54 1t8c s SER 138 Cb 0.00 -1.18 -0.00 0.00 0.21 0.00 0.00 66.02 65.05 1t8c s SER 138 CO 0.01 -1.69 1.20 -0.70 0.41 0.00 0.00 173.24 172.47 1t8c s GLU 139 N -5.36 4.18 0.00 12.44 2.12 -1.26 -4.96 118.70 125.86 1t8c s GLU 139 Ca 0.61 1.49 0.00 0.00 0.36 0.00 0.00 54.97 57.43 1t8c s GLU 139 Cb -0.11 -3.75 0.00 0.00 0.26 0.00 0.00 34.13 30.53 1t8c s GLU 139 CO 0.46 -0.76 0.00 0.41 -0.54 0.00 0.00 175.26 174.83 1t8c n GLY 140 N 3.66 4.30 5.03 -1.50 0.00 -1.26 -5.03 105.19 110.38 1t8c n GLY 140 Ca 0.13 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 0.00 -4.59 1.61 7.64 -1.26 -4.62 113.62 112.40 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 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1t8c n SER 141 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1t8c s ALA 142 N -1.00 2.65 -2.70 -0.43 0.00 -1.26 -5.28 121.76 113.73 1t8c s ALA 142 Ca 0.00 0.20 0.22 0.00 0.00 0.00 0.00 51.96 52.38 1t8c s ALA 142 Cb 0.00 -4.09 0.17 0.00 0.00 0.00 0.00 23.12 19.20 1t8c s ALA 142 CO 0.00 -2.98 1.19 -1.91 0.00 0.00 0.00 175.76 172.05