#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1syc s LEU 7 N 0.00 4.05 -0.01 -0.35 1.43 -1.26 -5.08 118.68 117.46 1syc s LEU 7 Ca 0.00 0.75 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 1syc s LEU 7 Cb 0.00 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.65 1syc s LEU 7 CO 0.00 -0.20 -0.06 -1.38 0.23 0.00 0.00 176.35 174.94 1syc s HIS 8 N -2.09 0.52 0.15 0.29 -3.43 -1.26 -5.09 115.29 104.38 1syc s HIS 8 Ca 0.44 -0.10 -0.29 0.00 -0.80 0.00 0.00 55.06 54.32 1syc s HIS 8 Cb -0.11 -0.34 -0.07 0.00 -1.43 0.00 0.00 32.58 30.63 1syc s HIS 8 CO 0.30 -0.02 0.91 0.15 -2.00 0.00 0.00 174.74 174.08 1syc s LYS 9 N -0.08 4.70 0.05 -0.38 1.02 -1.26 -4.29 119.74 119.51 1syc s LYS 9 Ca 0.01 1.38 0.07 0.00 0.02 0.00 0.00 55.97 57.46 1syc s LYS 9 Cb -0.03 -3.33 -0.03 0.00 -0.52 0.00 0.00 37.83 33.92 1syc s LYS 9 CO -0.00 0.35 -0.21 -1.21 -0.92 0.00 0.00 175.35 173.37 1syc s GLU 10 N -0.49 1.35 0.63 1.68 2.02 0.95 -4.92 118.70 119.92 1syc s GLU 10 Ca 0.43 -0.96 -0.16 0.00 0.02 0.00 0.00 54.97 54.29 1syc s GLU 10 Cb -0.24 -1.48 -0.02 0.00 0.10 0.00 0.00 34.13 32.50 1syc s GLU 10 CO 0.29 0.37 1.12 -1.25 0.02 0.00 0.00 175.26 175.81 1syc s PRO 11 N -1.26 2.95 0.19 0.39 0.04 -1.26 -0.15 135.00 135.89 1syc s PRO 11 Ca 0.07 1.46 -0.16 0.00 0.04 0.00 0.00 61.00 62.42 1syc s PRO 11 Cb -0.09 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.51 1syc s PRO 11 CO 0.02 -1.14 0.48 0.00 0.04 0.00 0.00 177.00 176.39 1syc s ALA 12 N -2.17 -0.72 -0.02 8.56 0.00 -0.86 -4.64 121.76 121.91 1syc s ALA 12 Ca 0.69 -0.39 0.05 0.00 0.00 0.00 0.00 51.96 52.31 1syc s ALA 12 Cb -0.22 0.86 -0.01 0.00 0.00 0.00 0.00 23.12 23.76 1syc s ALA 12 CO 0.37 -0.78 -0.17 0.99 0.00 0.00 0.00 175.76 176.17 1syc s THR 13 N -3.90 1.37 0.22 0.00 2.01 -0.59 -4.20 115.64 110.55 1syc s THR 13 Ca 0.11 -0.73 -0.30 0.00 0.31 0.00 0.00 61.69 61.09 1syc s THR 13 Cb -0.00 -1.15 -0.09 0.00 0.01 0.00 0.00 72.50 71.27 1syc s THR 13 CO -0.01 0.39 1.34 -0.22 -0.69 0.00 0.00 174.62 175.42 1syc s LEU 14 N -0.31 4.41 -0.12 4.42 2.96 -1.26 0.21 118.68 128.99 1syc s LEU 14 Ca 0.04 2.49 -0.13 0.00 -0.22 0.00 0.00 54.13 56.31 1syc s LEU 14 Cb -0.08 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 1syc s LEU 14 CO -0.00 -0.56 -0.26 -0.38 -1.32 0.00 0.00 176.35 173.83 1syc n ILE 15 N 2.37 1.21 -3.62 6.68 5.41 -0.45 -4.82 119.36 126.13 1syc n ILE 15 Ca 0.06 0.22 -0.12 0.00 1.00 0.00 0.00 62.75 63.91 1syc n ILE 15 Cb 0.42 -2.12 -0.07 0.00 -0.71 0.00 0.00 39.64 37.16 1syc n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1syc s LYS 16 N -2.49 0.67 -0.05 0.38 2.20 -0.65 -5.01 119.74 114.80 1syc s LYS 16 Ca -0.21 0.70 -0.26 0.00 -0.36 0.00 0.00 55.97 55.83 1syc s LYS 16 Cb 0.03 0.33 -0.03 0.00 -1.51 0.00 0.00 37.83 36.64 1syc s LYS 16 CO 0.32 -0.10 0.81 0.00 -0.36 0.00 0.00 175.35 176.02 1syc s ALA 17 N 0.10 3.28 -0.26 3.13 0.00 -1.26 -0.54 121.76 126.21 1syc s ALA 17 Ca 0.01 0.28 -0.07 0.00 0.00 0.00 0.00 51.96 52.18 1syc s ALA 17 Cb -0.04 -3.11 -0.15 0.00 0.00 0.00 0.00 23.12 19.81 1syc s ALA 17 CO -0.02 -0.18 -0.23 -0.89 0.00 0.00 0.00 175.76 174.44 1syc n ILE 18 N 3.88 1.53 -3.80 0.00 5.41 -0.63 -4.94 119.36 120.81 1syc n ILE 18 Ca 0.02 -0.46 -0.10 0.00 1.00 0.00 0.00 62.75 63.21 1syc n ILE 18 Cb 0.51 -1.68 0.01 0.00 -0.71 0.00 0.00 39.64 37.77 1syc n ILE 18 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1syc n ASP 19 N -3.78 -1.84 0.06 4.38 -0.08 -0.92 -4.98 116.55 109.39 1syc n ASP 19 Ca -0.48 -2.52 0.04 0.00 -1.51 0.00 0.00 54.79 50.31 1syc n ASP 19 Cb 0.93 3.13 0.44 0.00 2.34 0.00 0.00 41.12 47.96 1syc n ASP 19 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1syc h GLY 20 N 1.79 0.43 -0.81 0.27 0.00 -1.82 -3.17 103.07 99.76 1syc h GLY 20 Ca -0.29 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1syc h GLY 20 CO 0.37 0.18 -0.26 2.09 0.00 0.00 0.00 176.54 178.92 1syc n ASP 21 N -4.43 1.72 -3.86 0.19 5.75 -1.26 -4.74 116.55 109.92 1syc n ASP 21 Ca 0.01 -1.36 -0.15 0.00 -0.01 0.00 0.00 54.79 53.28 1syc n ASP 21 Cb 0.12 0.38 -0.15 0.00 -1.03 0.00 0.00 41.12 40.44 1syc n ASP 21 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1syc s THR 22 N -1.75 0.15 0.03 2.12 2.01 -1.20 -0.70 115.64 116.31 1syc s THR 22 Ca 0.14 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.16 1syc s THR 22 Cb 0.13 -0.19 -0.02 0.00 0.01 0.00 0.00 72.50 72.42 1syc s THR 22 CO 0.35 0.09 -0.06 0.68 -0.69 0.00 0.00 174.62 174.99 1syc s VAL 23 N 0.49 0.45 -0.20 3.82 -7.23 -0.48 -1.60 120.40 115.64 1syc s VAL 23 Ca -0.05 -0.80 -0.07 0.00 -1.81 0.00 0.00 61.98 59.25 1syc s VAL 23 Cb -0.07 -0.48 -0.04 0.00 0.56 0.00 0.00 36.38 36.35 1syc s VAL 23 CO -0.01 -0.25 0.06 -0.75 -0.31 0.00 0.00 175.10 173.84 1syc s LYS 24 N -1.13 3.87 0.16 4.82 2.20 0.29 0.86 119.74 130.82 1syc s LYS 24 Ca -0.07 -0.39 0.06 0.00 -0.36 0.00 0.00 55.97 55.21 1syc s LYS 24 Cb -0.08 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 32.98 1syc s LYS 24 CO 0.00 0.15 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.51 1syc s LEU 25 N 0.69 2.51 -0.31 5.43 1.43 0.43 -1.34 118.68 127.52 1syc s LEU 25 Ca 0.03 -0.97 -0.16 0.00 -1.03 0.00 0.00 54.13 52.00 1syc s LEU 25 Cb -0.13 -0.52 -0.02 0.00 0.03 0.00 0.00 46.19 45.55 1syc s LEU 25 CO 0.02 -0.23 0.40 -0.32 0.23 0.00 0.00 176.35 176.45 1syc s MET 26 N -3.47 3.79 -0.12 1.70 -2.45 0.13 -0.35 119.30 118.54 1syc s MET 26 Ca 0.17 -0.14 0.01 0.00 -1.25 0.00 0.00 55.69 54.47 1syc s MET 26 Cb -0.00 -3.73 0.02 0.00 1.25 0.00 0.00 34.83 32.36 1syc s MET 26 CO 0.03 -0.43 -0.12 -0.47 1.05 0.00 0.00 175.02 175.09 1syc s TYR 27 N 2.12 1.79 -1.35 4.11 5.04 0.89 -1.54 117.35 128.42 1syc s TYR 27 Ca 0.15 -0.90 -0.11 0.00 -2.44 0.00 0.00 57.07 53.77 1syc s TYR 27 Cb -0.16 -1.36 0.01 0.00 0.35 0.00 0.00 41.96 40.80 1syc s TYR 27 CO 0.11 -0.52 0.45 1.63 -1.34 0.00 0.00 175.55 175.88 1syc n LYS 28 N 4.59 -1.73 0.00 4.97 5.02 -1.26 -1.03 118.16 128.72 1syc n LYS 28 Ca -0.16 0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1syc n LYS 28 Cb 0.50 -3.83 0.00 0.00 -0.02 0.00 0.00 35.03 31.69 1syc n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1syc n GLY 29 N -2.08 2.68 3.18 0.72 0.00 -1.26 -5.02 105.19 103.40 1syc n GLY 29 Ca -0.23 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.67 1syc n GLY 29 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1syc s GLN 30 N -0.13 0.86 0.27 1.61 -2.07 -0.20 -5.09 119.66 114.90 1syc s GLN 30 Ca 0.00 -1.29 -0.29 0.00 -1.82 0.00 0.00 55.36 51.96 1syc s GLN 30 Cb 0.00 -0.35 -0.09 0.00 -1.09 0.00 0.00 33.01 31.48 1syc s GLN 30 CO 0.00 0.02 1.23 -2.14 -1.32 0.00 0.00 175.29 173.08 1syc s PRO 31 N -3.48 4.47 -0.08 9.60 0.02 -1.26 -0.08 135.00 144.18 1syc s PRO 31 Ca 0.10 2.02 -0.18 0.00 0.02 0.00 0.00 61.00 62.96 1syc s PRO 31 Cb 0.02 -3.15 0.04 0.00 0.02 0.00 0.00 34.50 31.43 1syc s PRO 31 CO -0.03 -0.07 0.43 1.41 -0.33 0.00 0.00 177.00 178.42 1syc s MET 32 N -1.13 0.69 -0.13 5.54 1.75 0.53 -4.90 119.30 121.65 1syc s MET 32 Ca 0.50 0.21 -0.13 0.00 -1.25 0.00 0.00 55.69 55.01 1syc s MET 32 Cb -0.36 0.32 -0.05 0.00 2.84 0.00 0.00 34.83 37.58 1syc s MET 32 CO 0.44 -0.16 0.30 0.99 -0.65 0.00 0.00 175.02 175.94 1syc s THR 33 N -0.70 5.28 -0.01 10.11 2.01 -1.26 -0.43 115.64 130.65 1syc s THR 33 Ca -0.08 0.57 0.07 0.00 0.31 0.00 0.00 61.69 62.56 1syc s THR 33 Cb -0.03 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.83 1syc s THR 33 CO 0.04 0.45 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.83 1syc s PHE 34 N 0.02 2.43 -0.18 4.92 0.40 0.25 -0.57 117.98 125.25 1syc s PHE 34 Ca 0.18 -0.35 -0.04 0.00 -0.60 0.00 0.00 56.93 56.11 1syc s PHE 34 Cb -0.14 -1.50 -0.02 0.00 0.51 0.00 0.00 43.02 41.87 1syc s PHE 34 CO 0.06 0.07 -0.02 0.50 0.70 0.00 0.00 175.22 176.53 1syc s ARG 35 N -0.85 3.63 0.18 0.44 6.06 0.53 -1.39 118.95 127.54 1syc s ARG 35 Ca 0.11 -0.53 -0.31 0.00 -2.50 0.00 0.00 55.73 52.50 1syc s ARG 35 Cb -0.10 -3.00 -0.10 0.00 0.06 0.00 0.00 34.95 31.81 1syc s ARG 35 CO 0.01 0.11 1.53 -0.51 -2.50 0.00 0.00 175.30 173.94 1syc s LEU 36 N 0.73 4.37 0.64 -0.88 1.02 0.13 -2.85 118.68 121.84 1syc s LEU 36 Ca -0.01 2.61 -0.16 0.00 0.02 0.00 0.00 54.13 56.59 1syc s LEU 36 Cb -0.14 -3.60 -0.01 0.00 0.02 0.00 0.00 46.19 42.46 1syc s LEU 36 CO 0.02 -0.79 1.14 -0.76 0.02 0.00 0.00 176.35 175.98 1syc s LEU 37 N 0.85 3.49 -1.38 1.79 1.43 -0.12 -3.77 118.68 120.97 1syc s LEU 37 Ca 0.68 2.14 0.00 0.00 -1.03 0.00 0.00 54.13 55.91 1syc s LEU 37 Cb -0.43 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.22 1syc s LEU 37 CO 0.33 -1.63 0.00 0.18 0.23 0.00 0.00 176.35 175.46 1syc n LEU 38 N -2.12 -0.91 -4.13 1.79 4.77 -1.26 -4.93 117.00 110.20 1syc n LEU 38 Ca 0.11 0.32 -0.20 0.00 -0.03 0.00 0.00 56.01 56.22 1syc n LEU 38 Cb 0.51 -2.04 -0.13 0.00 -2.33 0.00 0.00 43.42 39.43 1syc n LEU 38 CO 0.46 -0.71 -0.46 0.68 -1.33 0.00 0.00 177.39 176.03 1syc s VAL 39 N -2.08 1.07 -0.19 4.08 -7.23 -1.25 -0.88 120.40 113.92 1syc s VAL 39 Ca 0.00 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.21 1syc s VAL 39 Cb 0.00 -0.97 0.04 0.00 0.56 0.00 0.00 36.38 36.01 1syc s VAL 39 CO 0.00 0.00 -0.10 -1.81 -0.31 0.00 0.00 175.10 172.88 1syc s ASP 40 N -1.10 3.27 0.15 4.85 1.01 0.19 -4.73 116.67 120.31 1syc s ASP 40 Ca 0.01 -0.83 0.05 0.00 0.71 0.00 0.00 52.55 52.49 1syc s ASP 40 Cb -0.08 -1.20 -0.04 0.00 1.01 0.00 0.00 42.92 42.61 1syc s ASP 40 CO 0.01 -0.14 0.11 0.42 0.21 0.00 0.00 175.17 175.78 1syc s THR 41 N 1.42 4.40 0.29 -1.27 -4.23 -1.26 -0.72 115.64 114.27 1syc s THR 41 Ca -0.00 -1.06 -0.30 0.00 -1.18 0.00 0.00 61.69 59.15 1syc s THR 41 Cb -0.16 -3.22 -0.11 0.00 1.34 0.00 0.00 72.50 70.36 1syc s THR 41 CO -0.08 -0.06 1.52 -2.16 -0.54 0.00 0.00 174.62 173.30 1syc s PRO 42 N -2.93 4.18 0.38 3.99 0.04 -1.26 -4.95 135.00 134.44 1syc s PRO 42 Ca 0.30 2.47 -0.09 0.00 0.04 0.00 0.00 61.00 63.72 1syc s PRO 42 Cb -0.10 -3.05 -0.06 0.00 0.04 0.00 0.00 34.50 31.32 1syc s PRO 42 CO 0.22 -0.53 0.72 -1.21 0.04 0.00 0.00 177.00 176.24 1syc s GLU 43 N -0.64 3.76 -0.07 4.56 0.41 -1.26 -4.19 118.70 121.26 1syc s GLU 43 Ca 0.60 0.38 0.10 0.00 -0.41 0.00 0.00 54.97 55.64 1syc s GLU 43 Cb -0.45 -2.45 0.21 0.00 -1.78 0.00 0.00 34.13 29.66 1syc s GLU 43 CO 0.48 0.03 1.14 0.25 -0.49 0.00 0.00 175.26 176.67 1syc n THR 44 N -1.18 1.47 0.00 3.63 -2.24 -1.26 -1.46 114.28 113.24 1syc n THR 44 Ca 0.02 -1.54 0.00 0.00 -2.27 0.00 0.00 64.05 60.25 1syc n THR 44 Cb 0.54 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 1syc n THR 44 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1syc n LYS 45 N -0.67 0.00 -1.68 -0.78 3.00 -1.14 -4.72 118.16 112.18 1syc n LYS 45 Ca 0.10 0.00 -0.44 0.00 -0.00 0.00 0.00 58.31 57.97 1syc n LYS 45 Cb 0.49 -0.46 -0.02 0.00 0.00 0.00 0.00 35.03 35.04 1syc n LYS 45 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1syc n HIS 46 N -2.53 2.18 0.27 5.64 8.25 -1.23 -4.82 115.22 122.98 1syc n HIS 46 Ca 0.00 0.48 0.02 0.00 -0.26 0.00 0.00 57.72 57.97 1syc n HIS 46 Cb 0.28 -2.44 0.14 0.00 1.12 0.00 0.00 29.99 29.09 1syc n HIS 46 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1syc n PRO 47 N 1.45 0.11 -3.92 -0.41 -0.04 -1.26 -0.73 135.00 130.20 1syc n PRO 47 Ca 0.09 0.12 -0.35 0.00 -0.04 0.00 0.00 63.50 63.33 1syc n PRO 47 Cb 0.33 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.15 1syc n PRO 47 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1syc s LYS 48 N -2.30 2.47 0.00 0.54 -2.85 -1.26 -4.50 119.74 111.84 1syc s LYS 48 Ca 0.06 -1.24 0.00 0.00 -1.00 0.00 0.00 55.97 53.80 1syc s LYS 48 Cb 0.03 -3.15 0.00 0.00 -2.06 0.00 0.00 37.83 32.66 1syc s LYS 48 CO 0.07 -0.59 0.00 1.63 0.10 0.00 0.00 175.35 176.55 1syc n LYS 49 N 4.62 0.00 0.00 1.78 5.02 -1.25 -4.90 118.16 123.43 1syc n LYS 49 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 1syc n LYS 49 Cb 0.44 -0.01 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 1syc n LYS 49 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1syc n GLY 50 N -0.04 1.66 2.87 0.72 0.00 0.09 -4.52 105.19 105.97 1syc n GLY 50 Ca 0.00 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1syc n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1syc s VAL 51 N 0.00 1.42 0.58 1.61 1.01 -1.26 -2.87 120.40 120.90 1syc s VAL 51 Ca 0.00 -1.59 -0.18 0.00 0.00 0.00 0.00 61.98 60.21 1syc s VAL 51 Cb 0.00 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1syc s VAL 51 CO 0.00 -0.49 1.13 -1.61 0.00 0.00 0.00 175.10 174.13 1syc s GLU 52 N 1.37 3.14 0.31 2.72 2.02 -0.53 -4.94 118.70 122.79 1syc s GLU 52 Ca 0.06 1.58 -0.29 0.00 0.02 0.00 0.00 54.97 56.33 1syc s GLU 52 Cb -0.18 -1.98 -0.11 0.00 0.10 0.00 0.00 34.13 31.96 1syc s GLU 52 CO -0.15 -1.01 1.54 0.21 0.02 0.00 0.00 175.26 175.87 1syc s LYS 53 N -3.52 4.14 0.00 1.61 2.20 -1.26 -1.06 119.74 121.85 1syc s LYS 53 Ca 0.72 2.54 0.00 0.00 -0.36 0.00 0.00 55.97 58.87 1syc s LYS 53 Cb -0.24 -3.02 0.00 0.00 -1.51 0.00 0.00 37.83 33.06 1syc s LYS 53 CO 0.32 -0.57 0.00 0.66 -0.36 0.00 0.00 175.35 175.40 1syc n TYR 54 N 1.70 0.00 0.20 4.03 4.01 -1.26 -4.78 117.16 121.06 1syc n TYR 54 Ca 0.06 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.64 1syc n TYR 54 Cb 0.38 -0.15 -0.08 0.00 -0.31 0.00 0.00 39.34 39.19 1syc n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1syc h GLY 55 N 0.00 -0.94 1.08 2.72 0.00 -1.26 0.65 103.07 105.32 1syc h GLY 55 Ca 0.00 0.49 0.02 0.00 0.00 0.00 0.00 47.33 47.84 1syc h GLY 55 CO 0.00 -0.31 0.58 -2.55 0.00 0.00 0.00 176.54 174.26 1syc h PRO 56 N -0.78 1.11 -0.42 4.80 0.11 -1.86 -0.87 132.00 134.09 1syc h PRO 56 Ca -0.02 -0.07 -0.10 0.00 0.11 0.00 0.00 66.00 65.93 1syc h PRO 56 Cb 0.72 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1syc h PRO 56 CO -0.13 0.73 -0.11 0.93 -0.21 0.00 0.00 178.00 179.21 1syc h GLU 57 N 1.14 0.82 -0.62 1.05 3.07 -1.82 -1.03 114.58 117.19 1syc h GLU 57 Ca 0.33 -0.32 -0.04 0.00 -0.50 0.00 0.00 59.36 58.83 1syc h GLU 57 Cb -0.06 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 27.78 1syc h GLU 57 CO -0.09 0.94 0.22 0.00 -1.40 0.00 0.00 179.01 178.69 1syc h ALA 58 N 0.85 0.81 -0.15 3.43 0.00 -0.55 0.39 119.26 124.04 1syc h ALA 58 Ca 0.11 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1syc h ALA 58 Cb 0.65 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1syc h ALA 58 CO 0.04 0.45 0.09 0.77 0.00 0.00 0.00 179.25 180.61 1syc h SER 59 N 0.88 0.14 -0.33 0.00 0.02 -1.05 0.60 113.55 113.82 1syc h SER 59 Ca 0.20 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.07 1syc h SER 59 Cb 0.25 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1syc h SER 59 CO -0.01 0.11 -0.09 0.00 -1.14 0.00 0.00 176.83 175.70 1syc h ALA 60 N 1.07 1.05 0.85 3.77 0.00 -0.79 -0.83 119.26 124.38 1syc h ALA 60 Ca 0.06 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1syc h ALA 60 Cb -0.00 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.62 1syc h ALA 60 CO -0.03 0.58 -0.41 0.35 0.00 0.00 0.00 179.25 179.74 1syc h PHE 61 N 0.69 -1.06 -0.50 0.00 3.04 0.34 0.51 116.94 119.96 1syc h PHE 61 Ca 0.12 -0.03 0.10 0.00 3.98 0.00 0.00 57.97 62.14 1syc h PHE 61 Cb 0.55 0.35 -0.08 0.00 2.56 0.00 0.00 35.95 39.33 1syc h PHE 61 CO 0.03 -0.66 0.01 1.15 -2.02 0.00 0.00 178.31 176.82 1syc h THR 62 N -1.16 0.62 -0.25 4.41 2.02 -0.78 -1.92 112.91 115.85 1syc h THR 62 Ca -0.12 -0.04 0.04 0.00 0.77 0.00 0.00 66.41 67.06 1syc h THR 62 Cb 0.88 0.48 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 1syc h THR 62 CO 0.19 0.02 0.01 0.50 0.37 0.00 0.00 175.52 176.62 1syc h LYS 63 N 0.13 0.09 -0.58 6.66 3.64 -1.11 -1.07 116.57 124.34 1syc h LYS 63 Ca 0.25 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.64 1syc h LYS 63 Cb 0.38 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1syc h LYS 63 CO -0.41 0.06 0.37 -0.22 -2.27 0.00 0.00 179.45 176.98 1syc h LYS 64 N 0.09 0.73 -0.37 1.90 3.64 -0.54 0.56 116.57 122.57 1syc h LYS 64 Ca 0.12 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1syc h LYS 64 Cb 0.14 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1syc h LYS 64 CO -0.19 0.48 0.20 1.98 -2.27 0.00 0.00 179.45 179.66 1syc h MET 65 N 0.75 0.52 0.00 1.90 4.05 -1.03 -1.59 114.93 119.54 1syc h MET 65 Ca 0.22 -0.06 -0.20 0.00 -0.28 0.00 0.00 59.70 59.38 1syc h MET 65 Cb -0.04 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 30.63 1syc h MET 65 CO -0.07 0.43 -0.98 -0.39 0.23 0.00 0.00 176.91 176.13 1syc h VAL 66 N 0.47 1.47 -0.02 -5.77 -1.51 -1.00 -3.17 116.25 106.72 1syc h VAL 66 Ca 0.13 -3.12 -0.13 0.00 -1.23 0.00 0.00 66.70 62.34 1syc h VAL 66 Cb 0.06 2.72 -0.02 0.00 -2.13 0.00 0.00 31.29 31.93 1syc h VAL 66 CO -0.02 0.84 -0.61 -0.33 -1.23 0.00 0.00 177.57 176.22 1syc h GLU 67 N 0.00 0.08 -0.03 5.19 5.08 -0.75 -3.14 114.58 121.01 1syc h GLU 67 Ca -0.04 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1syc h GLU 67 Cb 1.72 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.98 1syc h GLU 67 CO 0.11 0.67 0.00 0.09 -1.00 0.00 0.00 179.01 178.88 1syc n ASN 68 N -3.83 2.27 -4.79 1.42 5.03 -0.61 -4.94 115.26 109.81 1syc n ASN 68 Ca -0.02 -1.76 -0.36 0.00 0.87 0.00 0.00 54.58 53.32 1syc n ASN 68 Cb 0.61 -0.01 -0.05 0.00 -1.02 0.00 0.00 39.78 39.32 1syc n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1syc s ALA 69 N -1.98 3.09 -0.12 5.41 0.00 -1.19 -4.94 121.76 122.04 1syc s ALA 69 Ca 0.33 0.64 0.16 0.00 0.00 0.00 0.00 51.96 53.10 1syc s ALA 69 Cb 0.20 -3.25 -0.13 0.00 0.00 0.00 0.00 23.12 19.95 1syc s ALA 69 CO 0.32 -0.13 0.87 1.57 0.00 0.00 0.00 175.76 178.39 1syc h LYS 70 N 2.52 0.00 -3.72 0.00 2.10 -1.92 -3.46 116.57 112.09 1syc h LYS 70 Ca -0.48 0.00 -0.30 0.00 -2.00 0.00 0.00 60.65 57.87 1syc h LYS 70 Cb 1.21 0.00 -0.32 0.00 -0.90 0.00 0.00 32.23 32.22 1syc h LYS 70 CO 0.62 0.32 -0.74 0.15 -2.00 0.00 0.00 179.45 177.81 1syc s LYS 71 N -2.91 0.14 -0.06 0.07 1.02 -1.26 -5.03 119.74 111.71 1syc s LYS 71 Ca -0.02 0.06 0.05 0.00 0.02 0.00 0.00 55.97 56.08 1syc s LYS 71 Cb 0.09 -0.28 -0.02 0.00 -0.52 0.00 0.00 37.83 37.09 1syc s LYS 71 CO 0.81 -0.09 -0.21 0.42 -0.92 0.00 0.00 175.35 175.36 1syc s ILE 72 N 0.67 2.48 0.04 2.17 1.01 -1.26 -0.66 121.20 125.64 1syc s ILE 72 Ca -0.06 -0.92 0.04 0.00 0.00 0.00 0.00 60.65 59.70 1syc s ILE 72 Cb -0.09 -1.94 -0.02 0.00 0.01 0.00 0.00 42.46 40.42 1syc s ILE 72 CO -0.02 0.57 -0.11 -1.61 0.00 0.00 0.00 174.94 173.77 1syc s GLU 73 N -0.33 0.74 0.00 2.79 2.02 -0.09 -2.03 118.70 121.80 1syc s GLU 73 Ca 0.02 -0.71 0.06 0.00 0.02 0.00 0.00 54.97 54.36 1syc s GLU 73 Cb -0.13 -0.69 -0.03 0.00 0.10 0.00 0.00 34.13 33.39 1syc s GLU 73 CO 0.02 0.16 -0.19 0.14 0.02 0.00 0.00 175.26 175.41 1syc s VAL 74 N -0.95 2.68 -0.20 2.63 -7.23 0.79 -0.03 120.40 118.09 1syc s VAL 74 Ca -0.02 -1.04 -0.02 0.00 -1.81 0.00 0.00 61.98 59.09 1syc s VAL 74 Cb -0.08 -2.06 0.06 0.00 0.56 0.00 0.00 36.38 34.86 1syc s VAL 74 CO 0.01 0.47 0.02 -0.70 -0.31 0.00 0.00 175.10 174.59 1syc s GLU 75 N -1.04 0.80 0.55 4.82 2.12 0.33 -0.04 118.70 126.25 1syc s GLU 75 Ca 0.13 -0.49 -0.16 0.00 0.36 0.00 0.00 54.97 54.81 1syc s GLU 75 Cb -0.10 -2.14 -0.06 0.00 0.26 0.00 0.00 34.13 32.08 1syc s GLU 75 CO 0.02 -0.62 1.01 -0.06 -0.54 0.00 0.00 175.26 175.07 1syc s PHE 76 N 1.79 3.33 0.03 5.30 0.08 -1.26 -0.83 117.98 126.42 1syc s PHE 76 Ca -0.01 1.46 0.00 0.00 0.12 0.00 0.00 56.93 58.50 1syc s PHE 76 Cb -0.17 -2.85 0.01 0.00 -0.57 0.00 0.00 43.02 39.43 1syc s PHE 76 CO -0.08 -0.63 0.05 -3.47 -0.10 0.00 0.00 175.22 170.99 1syc n ASP 77 N -1.84 0.08 -0.14 1.36 -0.08 -1.26 -4.61 116.55 110.05 1syc n ASP 77 Ca 0.07 -1.06 0.13 0.00 -1.51 0.00 0.00 54.79 52.42 1syc n ASP 77 Cb 0.54 -0.03 0.33 0.00 2.34 0.00 0.00 41.12 44.30 1syc n ASP 77 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1syc n LYS 78 N -1.08 0.48 0.00 -0.67 2.85 -1.26 -4.90 118.16 113.58 1syc n LYS 78 Ca 0.01 -0.28 0.00 0.00 -1.05 0.00 0.00 58.31 56.99 1syc n LYS 78 Cb 0.03 -1.49 0.00 0.00 -0.65 0.00 0.00 35.03 32.91 1syc n LYS 78 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1syc n GLY 79 N 1.41 1.43 3.75 2.58 0.00 -1.26 -4.95 105.19 108.15 1syc n GLY 79 Ca 0.09 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 1syc n GLY 79 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1syc n GLN 80 N 0.00 2.55 0.00 1.61 6.02 -1.06 -4.93 117.38 121.59 1syc n GLN 80 Ca 0.00 0.90 0.11 0.00 -0.01 0.00 0.00 57.00 58.00 1syc n GLN 80 Cb 0.00 -2.61 -0.03 0.00 1.02 0.00 0.00 30.24 28.62 1syc n GLN 80 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1syc n ARG 81 N 0.90 0.12 -4.12 -1.09 1.74 -1.26 -4.81 116.66 108.15 1syc n ARG 81 Ca 0.04 -0.02 -0.15 0.00 -0.77 0.00 0.00 57.85 56.95 1syc n ARG 81 Cb 0.38 -1.52 -0.12 0.00 -1.02 0.00 0.00 32.46 30.17 1syc n ARG 81 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1syc s THR 82 N -3.09 0.75 0.59 0.55 -4.23 -1.26 -0.48 115.64 108.48 1syc s THR 82 Ca 0.06 -1.11 -0.03 0.00 -1.18 0.00 0.00 61.69 59.44 1syc s THR 82 Cb 0.16 -0.77 0.12 0.00 1.34 0.00 0.00 72.50 73.35 1syc s THR 82 CO 0.83 -0.28 0.80 -0.90 -0.54 0.00 0.00 174.62 174.53 1syc n ASP 83 N 1.50 0.79 0.13 3.99 5.68 0.15 -4.93 116.55 123.87 1syc n ASP 83 Ca -0.21 -1.73 0.12 0.00 -0.50 0.00 0.00 54.79 52.46 1syc n ASP 83 Cb 0.55 -0.55 0.50 0.00 -1.14 0.00 0.00 41.12 40.47 1syc n ASP 83 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1syc n LYS 84 N -2.55 0.19 -0.01 0.11 2.85 -1.26 -1.68 118.16 115.80 1syc n LYS 84 Ca 0.12 0.44 0.13 0.00 -1.05 0.00 0.00 58.31 57.96 1syc n LYS 84 Cb 0.44 -1.87 0.39 0.00 -0.65 0.00 0.00 35.03 33.33 1syc n LYS 84 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1syc n TYR 85 N -2.23 0.03 -0.64 5.58 4.01 -1.26 -4.94 117.16 117.71 1syc n TYR 85 Ca 0.02 -0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1syc n TYR 85 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 1syc n TYR 85 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1syc n GLY 86 N 1.23 0.73 3.77 2.72 0.00 -0.68 -5.04 105.19 107.92 1syc n GLY 86 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1syc n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1syc s ARG 87 N -0.36 4.67 0.29 1.61 0.52 -1.26 -4.74 118.95 119.68 1syc s ARG 87 Ca 0.00 1.31 -0.29 0.00 -0.52 0.00 0.00 55.73 56.23 1syc s ARG 87 Cb 0.00 -3.14 -0.09 0.00 0.52 0.00 0.00 34.95 32.24 1syc s ARG 87 CO 0.00 0.47 1.06 0.20 0.02 0.00 0.00 175.30 177.05 1syc s GLY 88 N -1.30 3.02 -0.36 -3.53 0.00 0.27 -0.68 107.32 104.74 1syc s GLY 88 Ca 0.42 0.81 -0.09 0.00 0.00 0.00 0.00 44.72 45.86 1syc s GLY 88 CO 0.28 1.38 0.17 1.08 0.00 0.00 0.00 173.10 176.01 1syc s LEU 89 N -1.59 4.60 0.28 0.66 1.43 0.37 -0.35 118.68 124.08 1syc s LEU 89 Ca 0.46 -1.10 -0.13 0.00 -1.03 0.00 0.00 54.13 52.33 1syc s LEU 89 Cb -0.29 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 43.97 1syc s LEU 89 CO 0.37 -0.38 0.55 0.00 0.23 0.00 0.00 176.35 177.12 1syc s ALA 90 N 1.48 -0.34 -0.12 4.21 0.00 -1.13 -4.37 121.76 121.49 1syc s ALA 90 Ca 0.01 -0.84 -0.16 0.00 0.00 0.00 0.00 51.96 50.97 1syc s ALA 90 Cb -0.20 1.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.89 1syc s ALA 90 CO 0.05 -0.89 0.39 0.71 0.00 0.00 0.00 175.76 176.02 1syc s TYR 91 N -3.74 3.52 -0.09 0.00 2.02 -0.01 -0.95 117.35 118.10 1syc s TYR 91 Ca 0.21 0.78 -0.00 0.00 -0.37 0.00 0.00 57.07 57.68 1syc s TYR 91 Cb -0.02 -2.43 -0.03 0.00 -0.40 0.00 0.00 41.96 39.08 1syc s TYR 91 CO 0.10 0.25 -0.05 0.42 -1.57 0.00 0.00 175.55 174.70 1syc s ILE 92 N 0.36 3.84 -0.07 2.71 1.01 -1.26 -0.51 121.20 127.28 1syc s ILE 92 Ca 0.22 -0.42 0.04 0.00 0.00 0.00 0.00 60.65 60.50 1syc s ILE 92 Cb -0.14 -2.60 -0.01 0.00 0.01 0.00 0.00 42.46 39.71 1syc s ILE 92 CO 0.08 0.58 -0.20 -0.31 0.00 0.00 0.00 174.94 175.09 1syc s TYR 93 N -0.60 2.57 -0.23 3.97 1.51 0.95 -0.37 117.35 125.15 1syc s TYR 93 Ca 0.09 -0.58 0.02 0.00 -1.01 0.00 0.00 57.07 55.59 1syc s TYR 93 Cb -0.12 -1.65 0.04 0.00 -0.11 0.00 0.00 41.96 40.13 1syc s TYR 93 CO 0.02 -0.13 -0.13 0.00 -1.11 0.00 0.00 175.55 174.20 1syc s ALA 94 N -0.20 2.50 -1.40 3.71 0.00 0.36 -0.91 121.76 125.83 1syc s ALA 94 Ca -0.02 -1.55 -0.02 0.00 0.00 0.00 0.00 51.96 50.37 1syc s ALA 94 Cb -0.13 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.54 1syc s ALA 94 CO 0.03 -0.87 0.59 -0.25 0.00 0.00 0.00 175.76 175.26 1syc n ASP 95 N 4.52 -1.17 0.00 0.00 8.00 0.16 -0.79 116.55 127.28 1syc n ASP 95 Ca -0.17 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.41 1syc n ASP 95 Cb 0.45 -3.48 0.00 0.00 -0.02 0.00 0.00 41.12 38.07 1syc n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1syc n GLY 96 N -1.77 0.96 3.75 0.44 0.00 -1.26 -5.00 105.19 102.30 1syc n GLY 96 Ca -0.26 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.40 1syc n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1syc s LYS 97 N -0.26 4.14 -0.06 1.61 -0.14 0.03 -5.03 119.74 120.02 1syc s LYS 97 Ca 0.00 0.02 -0.30 0.00 -1.36 0.00 0.00 55.97 54.33 1syc s LYS 97 Cb 0.00 -3.39 -0.04 0.00 -1.68 0.00 0.00 37.83 32.73 1syc s LYS 97 CO 0.00 0.34 1.31 1.41 -0.76 0.00 0.00 175.35 177.65 1syc s MET 98 N 0.19 4.29 0.26 1.68 -2.45 -1.26 -0.49 119.30 121.53 1syc s MET 98 Ca 0.15 1.80 -0.02 0.00 -1.25 0.00 0.00 55.69 56.37 1syc s MET 98 Cb -0.13 -3.64 0.35 0.00 1.25 0.00 0.00 34.83 32.66 1syc s MET 98 CO 0.03 -0.58 1.77 0.28 1.05 0.00 0.00 175.02 177.58 1syc h VAL 99 N 5.13 1.24 -0.10 10.11 2.07 -1.07 -2.06 116.25 131.57 1syc h VAL 99 Ca -0.34 -0.97 0.04 0.00 0.82 0.00 0.00 66.70 66.25 1syc h VAL 99 Cb 1.15 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 1syc h VAL 99 CO 0.91 0.34 -0.17 0.78 0.02 0.00 0.00 177.57 179.45 1syc h ASN 100 N 0.75 -0.53 -0.43 0.57 4.21 -1.91 -1.36 115.58 116.87 1syc h ASN 100 Ca 0.15 0.09 -0.05 0.00 1.21 0.00 0.00 56.30 57.70 1syc h ASN 100 Cb 0.42 0.24 -0.02 0.00 -1.12 0.00 0.00 38.32 37.85 1syc h ASN 100 CO 0.02 -0.23 0.08 -0.08 -1.29 0.00 0.00 177.43 175.93 1syc h GLU 101 N -0.24 0.71 -0.85 0.81 4.22 -1.88 -2.63 114.58 114.72 1syc h GLU 101 Ca 0.09 -0.19 0.06 0.00 0.08 0.00 0.00 59.36 59.40 1syc h GLU 101 Cb 0.36 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 1syc h GLU 101 CO -0.24 0.74 0.52 0.00 -2.18 0.00 0.00 179.01 177.85 1syc h ALA 102 N 0.94 1.16 -0.24 2.92 0.00 -1.15 0.53 119.26 123.43 1syc h ALA 102 Ca 0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1syc h ALA 102 Cb 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1syc h ALA 102 CO 0.01 0.26 0.08 -0.07 0.00 0.00 0.00 179.25 179.53 1syc h LEU 103 N 0.95 0.34 -0.13 0.00 3.38 -1.17 -1.14 115.31 117.54 1syc h LEU 103 Ca 0.37 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1syc h LEU 103 Cb 0.17 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1syc h LEU 103 CO -0.17 0.45 0.05 0.58 0.09 0.00 0.00 178.44 179.44 1syc h VAL 104 N 0.22 1.14 -0.47 1.22 2.07 -0.92 0.10 116.25 119.62 1syc h VAL 104 Ca 0.08 -0.43 0.02 0.00 0.82 0.00 0.00 66.70 67.19 1syc h VAL 104 Cb 0.22 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1syc h VAL 104 CO -0.00 0.13 0.31 -0.09 0.02 0.00 0.00 177.57 177.94 1syc h ARG 105 N 0.06 0.56 -0.01 1.57 9.65 0.22 -1.64 114.38 124.79 1syc h ARG 105 Ca 0.04 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1syc h ARG 105 Cb 0.16 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.61 1syc h ARG 105 CO -0.00 0.37 0.00 0.94 2.80 0.00 0.00 179.97 184.08 1syc n GLN 106 N -4.47 1.15 -1.87 0.20 -0.06 -0.45 -4.34 117.38 107.53 1syc n GLN 106 Ca 0.04 -0.22 -0.09 0.00 -2.00 0.00 0.00 57.00 54.74 1syc n GLN 106 Cb 0.10 -1.43 -0.01 0.00 -4.06 0.00 0.00 30.24 24.83 1syc n GLN 106 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1syc n GLY 107 N 0.97 0.35 0.88 1.69 0.00 -0.62 -4.49 105.19 103.97 1syc n GLY 107 Ca 0.20 -0.57 0.08 0.00 0.00 0.00 0.00 46.02 45.73 1syc n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1syc n LEU 108 N -1.15 3.16 -3.48 0.99 4.77 0.33 -1.03 117.00 120.59 1syc n LEU 108 Ca -0.10 -1.81 -0.15 0.00 -0.03 0.00 0.00 56.01 53.93 1syc n LEU 108 Cb 0.48 -0.27 -0.04 0.00 -2.33 0.00 0.00 43.42 41.26 1syc n LEU 108 CO 0.12 0.76 0.45 0.00 -1.33 0.00 0.00 177.39 177.39 1syc s ALA 109 N -1.07 -1.71 0.22 -1.18 0.00 -1.21 -4.36 121.76 112.45 1syc s ALA 109 Ca 0.31 0.98 0.06 0.00 0.00 0.00 0.00 51.96 53.31 1syc s ALA 109 Cb 0.17 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.60 1syc s ALA 109 CO 0.22 -0.55 0.19 0.15 0.00 0.00 0.00 175.76 175.78 1syc s LYS 110 N -2.32 2.96 -0.02 0.00 1.02 0.10 -4.48 119.74 117.00 1syc s LYS 110 Ca -0.05 -0.97 -0.29 0.00 0.02 0.00 0.00 55.97 54.69 1syc s LYS 110 Cb -0.00 -2.62 -0.03 0.00 -0.52 0.00 0.00 37.83 34.66 1syc s LYS 110 CO -0.01 0.43 0.94 0.08 -0.92 0.00 0.00 175.35 175.87 1syc s VAL 111 N -1.99 4.89 0.65 3.17 1.01 -1.26 -0.64 120.40 126.23 1syc s VAL 111 Ca 0.32 1.96 -0.09 0.00 0.00 0.00 0.00 61.98 64.17 1syc s VAL 111 Cb -0.09 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 32.03 1syc s VAL 111 CO 0.25 0.16 0.99 0.00 0.00 0.00 0.00 175.10 176.51 1syc s ALA 112 N 1.05 3.11 0.58 5.51 0.00 -0.06 -4.86 121.76 127.09 1syc s ALA 112 Ca 0.49 -0.53 -0.18 0.00 0.00 0.00 0.00 51.96 51.75 1syc s ALA 112 Cb -0.20 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 1syc s ALA 112 CO 0.26 -0.96 1.12 0.71 0.00 0.00 0.00 175.76 176.89 1syc s TYR 113 N -3.17 2.65 0.56 0.00 2.02 -1.26 -4.85 117.35 113.31 1syc s TYR 113 Ca 0.56 1.55 -0.21 0.00 -0.37 0.00 0.00 57.07 58.60 1syc s TYR 113 Cb -0.11 -3.25 -0.04 0.00 -0.40 0.00 0.00 41.96 38.16 1syc s TYR 113 CO 0.48 -1.61 1.32 0.08 -1.57 0.00 0.00 175.55 174.25 1syc s VAL 114 N -1.97 2.17 -0.19 0.71 1.01 -1.26 -4.84 120.40 116.03 1syc s VAL 114 Ca 0.71 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.82 1syc s VAL 114 Cb -0.23 -3.06 0.04 0.00 0.00 0.00 0.00 36.38 33.13 1syc s VAL 114 CO 0.32 -0.01 -0.13 -0.47 0.00 0.00 0.00 175.10 174.81 1syc s TYR 115 N -1.35 2.48 -1.20 5.22 5.04 -1.26 -4.89 117.35 121.38 1syc s TYR 115 Ca 0.74 -1.57 -0.26 0.00 -2.44 0.00 0.00 57.07 53.54 1syc s TYR 115 Cb -0.38 -1.69 0.04 0.00 0.35 0.00 0.00 41.96 40.27 1syc s TYR 115 CO 0.44 -0.75 0.49 1.63 -1.34 0.00 0.00 175.55 176.02 1syc n LYS 116 N 4.67 -0.41 -0.97 4.97 4.76 -1.26 -1.38 118.16 128.56 1syc n LYS 116 Ca -0.16 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.31 1syc n LYS 116 Cb 0.47 -2.45 0.00 0.00 -1.84 0.00 0.00 35.03 31.21 1syc n LYS 116 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1syc n GLY 117 N -2.14 0.90 3.51 0.72 0.00 -1.26 -2.55 105.19 104.37 1syc n GLY 117 Ca -0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1syc n GLY 117 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1syc s ASN 118 N -2.83 6.87 -0.01 1.61 0.01 -0.48 -3.99 114.94 116.13 1syc s ASN 118 Ca 0.00 -2.51 0.01 0.00 -0.71 0.00 0.00 52.86 49.65 1syc s ASN 118 Cb 0.00 -2.47 0.02 0.00 0.41 0.00 0.00 41.25 39.20 1syc s ASN 118 CO 0.00 -1.01 0.81 -0.46 -1.51 0.00 0.00 177.10 174.93 1syc n ASN 119 N 6.97 1.12 -0.23 -1.22 0.23 -1.26 -4.30 115.26 116.56 1syc n ASN 119 Ca 0.38 -1.66 -0.01 0.00 -0.53 0.00 0.00 54.58 52.76 1syc n ASN 119 Cb 0.46 -0.03 0.06 0.00 -2.08 0.00 0.00 39.78 38.19 1syc n ASN 119 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1syc h THR 120 N 1.54 0.28 -0.59 5.53 2.02 -2.02 -1.76 112.91 117.90 1syc h THR 120 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1syc h THR 120 Cb 0.77 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1syc h THR 120 CO 0.00 0.00 0.00 1.41 0.37 0.00 0.00 175.52 177.30 1syc n HIS 121 N -5.46 1.68 -0.24 3.16 8.25 -1.26 -4.60 115.22 116.74 1syc n HIS 121 Ca 0.08 -0.67 -0.03 0.00 -0.26 0.00 0.00 57.72 56.84 1syc n HIS 121 Cb 0.36 -0.35 0.09 0.00 1.12 0.00 0.00 29.99 31.20 1syc n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1syc h GLU 122 N 3.88 0.76 -0.37 -0.41 4.81 -1.67 -0.20 114.58 121.38 1syc h GLU 122 Ca 0.00 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1syc h GLU 122 Cb 1.66 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.85 1syc h GLU 122 CO 0.33 0.50 0.11 1.96 -0.73 0.00 0.00 179.01 181.18 1syc h GLN 123 N 0.78 0.57 -0.45 1.92 1.08 -1.81 0.15 115.11 117.35 1syc h GLN 123 Ca 0.29 -0.13 0.04 0.00 -1.45 0.00 0.00 58.65 57.40 1syc h GLN 123 Cb 0.10 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.40 1syc h GLN 123 CO -0.14 0.59 0.21 1.25 -0.95 0.00 0.00 178.83 179.80 1syc h HIS 124 N 0.45 0.39 -0.41 2.96 2.76 -1.83 -0.57 115.15 118.89 1syc h HIS 124 Ca 0.12 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.21 1syc h HIS 124 Cb 0.26 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 1syc h HIS 124 CO 0.01 0.19 -0.16 -0.07 -1.30 0.00 0.00 177.93 176.60 1syc h LEU 125 N 0.43 0.77 -0.83 0.26 3.38 -0.62 -2.39 115.31 116.31 1syc h LEU 125 Ca 0.20 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1syc h LEU 125 Cb 0.12 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1syc h LEU 125 CO -0.15 0.94 0.55 0.03 0.09 0.00 0.00 178.44 179.89 1syc h ARG 126 N 0.69 1.08 -0.48 1.13 2.47 -0.10 0.12 114.38 119.30 1syc h ARG 126 Ca 0.11 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1syc h ARG 126 Cb 0.65 -0.24 -0.02 0.00 -1.65 0.00 0.00 29.97 28.70 1syc h ARG 126 CO 0.05 0.71 0.28 0.87 0.56 0.00 0.00 179.97 182.44 1syc h LYS 127 N 1.11 0.65 -0.73 0.04 1.57 -0.74 -1.49 116.57 116.98 1syc h LYS 127 Ca 0.31 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.97 1syc h LYS 127 Cb -0.11 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.03 1syc h LYS 127 CO -0.07 0.49 0.24 0.77 -0.57 0.00 0.00 179.45 180.30 1syc h SER 128 N 0.63 1.05 -0.63 0.86 0.02 -0.92 -1.93 113.55 112.64 1syc h SER 128 Ca 0.17 -0.19 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1syc h SER 128 Cb 0.01 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 1syc h SER 128 CO -0.03 0.97 0.28 -0.08 -1.14 0.00 0.00 176.83 176.83 1syc h GLU 129 N 1.08 0.93 -0.53 3.45 4.81 -0.36 -1.12 114.58 122.84 1syc h GLU 129 Ca 0.24 -0.15 0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1syc h GLU 129 Cb 0.29 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 1syc h GLU 129 CO -0.01 0.76 0.27 0.00 -0.73 0.00 0.00 179.01 179.30 1syc h ALA 130 N 1.12 0.68 -0.34 2.92 0.00 -0.95 0.39 119.26 123.07 1syc h ALA 130 Ca 0.21 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1syc h ALA 130 Cb 0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1syc h ALA 130 CO -0.02 -0.08 0.14 0.37 0.00 0.00 0.00 179.25 179.67 1syc h GLN 131 N 0.52 0.51 -0.53 0.00 5.75 -1.02 0.97 115.11 121.31 1syc h GLN 131 Ca 0.23 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.64 1syc h GLN 131 Cb 0.14 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.58 1syc h GLN 131 CO -0.16 0.49 0.30 0.00 -2.65 0.00 0.00 178.83 176.81 1syc h ALA 132 N 0.99 1.53 -0.21 3.38 0.00 -0.65 -0.82 119.26 123.48 1syc h ALA 132 Ca 0.12 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1syc h ALA 132 Cb 0.17 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1syc h ALA 132 CO -0.01 0.40 -0.05 -0.22 0.00 0.00 0.00 179.25 179.37 1syc h LYS 133 N 0.73 0.39 -0.18 0.00 3.64 -0.38 -1.60 116.57 119.16 1syc h LYS 133 Ca 0.19 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1syc h LYS 133 Cb 0.00 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1syc h LYS 133 CO -0.03 0.64 0.08 -0.22 -2.27 0.00 0.00 179.45 177.64 1syc h LYS 134 N 0.12 0.25 -0.03 1.90 3.64 -0.11 0.05 116.57 122.40 1syc h LYS 134 Ca 0.05 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1syc h LYS 134 Cb 0.49 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1syc h LYS 134 CO 0.02 0.21 0.00 0.39 -2.27 0.00 0.00 179.45 177.80 1syc n GLU 135 N -4.46 1.57 -3.93 1.90 1.02 -0.38 -4.93 120.64 111.43 1syc n GLU 135 Ca -0.00 -0.83 -0.28 0.00 -0.02 0.00 0.00 57.16 56.03 1syc n GLU 135 Cb 0.11 -1.47 0.01 0.00 -0.02 0.00 0.00 31.44 30.07 1syc n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1syc n LYS 136 N 0.01 -4.44 -3.13 3.49 5.02 0.00 -4.92 118.16 114.20 1syc n LYS 136 Ca 0.19 0.52 -0.39 0.00 -2.02 0.00 0.00 58.31 56.61 1syc n LYS 136 Cb 0.31 -5.12 -0.06 0.00 -0.02 0.00 0.00 35.03 30.15 1syc n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1syc s LEU 137 N -7.06 4.51 0.00 -0.35 1.43 -0.85 -3.39 118.68 112.98 1syc s LEU 137 Ca 0.36 1.38 0.00 0.00 -1.03 0.00 0.00 54.13 54.84 1syc s LEU 137 Cb -0.18 -3.07 0.00 0.00 0.03 0.00 0.00 46.19 42.97 1syc s LEU 137 CO 0.86 0.18 0.00 0.59 0.23 0.00 0.00 176.35 178.21 1syc n ASN 138 N 2.05 0.00 -0.34 2.29 3.02 -1.26 0.63 115.26 121.64 1syc n ASN 138 Ca -0.07 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.62 1syc n ASN 138 Cb 0.50 0.00 0.34 0.00 -0.61 0.00 0.00 39.78 40.01 1syc n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1syc h ILE 139 N 0.00 0.71 -0.03 2.41 2.04 -1.40 0.70 117.51 121.94 1syc h ILE 139 Ca 0.00 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1syc h ILE 139 Cb 0.00 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.00 1syc h ILE 139 CO 0.00 0.13 0.00 0.79 0.00 0.00 0.00 178.15 179.07 1syc n TRP 140 N -4.73 0.03 1.81 1.37 7.02 0.20 -5.13 117.44 118.02 1syc n TRP 140 Ca 0.23 -0.02 0.15 0.00 -1.02 0.00 0.00 57.50 56.84 1syc n TRP 140 Cb 0.59 0.00 0.79 0.00 -2.42 0.00 0.00 31.31 30.26 1syc n TRP 140 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54