#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tk8 s ILE 4 N 0.00 4.44 -0.19 -0.18 1.01 -1.26 -4.66 121.20 120.35 1tk8 s ILE 4 Ca 0.00 1.67 -0.19 0.00 0.00 0.00 0.00 60.65 62.13 1tk8 s ILE 4 Cb 0.00 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.32 1tk8 s ILE 4 CO 0.00 0.50 0.53 -0.63 0.00 0.00 0.00 174.94 175.35 1tk8 s ILE 5 N -0.99 5.10 -0.54 2.92 1.01 -0.02 -4.98 121.20 123.69 1tk8 s ILE 5 Ca 0.36 0.99 -0.19 0.00 0.00 0.00 0.00 60.65 61.81 1tk8 s ILE 5 Cb -0.23 -3.86 0.08 0.00 0.01 0.00 0.00 42.46 38.47 1tk8 s ILE 5 CO 0.25 0.18 0.64 -1.00 0.00 0.00 0.00 174.94 175.01 1tk8 s HIS 6 N 1.58 3.05 0.80 3.97 3.76 -1.26 -1.11 115.29 126.07 1tk8 s HIS 6 Ca 0.25 -0.77 -0.12 0.00 -0.15 0.00 0.00 55.06 54.28 1tk8 s HIS 6 Cb -0.15 -3.72 0.07 0.00 1.11 0.00 0.00 32.58 29.89 1tk8 s HIS 6 CO 0.10 -1.12 1.13 -0.51 -0.85 0.00 0.00 174.74 173.48 1tk8 s LEU 7 N 2.55 2.54 0.09 0.89 1.43 -0.52 -4.98 118.68 120.68 1tk8 s LEU 7 Ca 0.12 1.05 -0.05 0.00 -1.03 0.00 0.00 54.13 54.23 1tk8 s LEU 7 Cb -0.22 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.35 1tk8 s LEU 7 CO 0.09 -1.90 0.10 0.42 0.23 0.00 0.00 176.35 175.29 1tk8 s THR 8 N -3.35 0.16 0.19 5.49 -4.23 -1.26 -4.72 115.64 107.92 1tk8 s THR 8 Ca 0.61 -1.55 -0.12 0.00 -1.18 0.00 0.00 61.69 59.45 1tk8 s THR 8 Cb -0.13 -1.57 0.10 0.00 1.34 0.00 0.00 72.50 72.24 1tk8 s THR 8 CO 0.52 -0.71 1.76 0.44 -0.54 0.00 0.00 174.62 176.09 1tk8 h ASP 9 N 2.89 0.25 0.82 3.99 3.32 -1.91 -1.05 116.42 124.72 1tk8 h ASP 9 Ca -0.34 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 1tk8 h ASP 9 Cb 1.18 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1tk8 h ASP 9 CO 0.59 0.17 -0.18 0.44 -1.72 0.00 0.00 179.24 178.54 1tk8 h ASP 10 N 0.41 0.00 -0.01 6.45 3.32 -2.01 -3.12 116.42 121.46 1tk8 h ASP 10 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1tk8 h ASP 10 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1tk8 h ASP 10 CO -0.24 0.18 -0.52 -1.54 -1.72 0.00 0.00 179.24 175.40 1tk8 n SER 11 N -3.39 1.59 -0.35 6.45 3.41 -0.98 -4.51 113.62 115.83 1tk8 n SER 11 Ca -0.00 -1.29 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 1tk8 n SER 11 Cb 0.38 0.61 0.14 0.00 -0.26 0.00 0.00 64.21 65.07 1tk8 n SER 11 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1tk8 h PHE 12 N 1.59 1.15 0.27 7.33 3.04 -1.14 -0.29 116.94 128.89 1tk8 h PHE 12 Ca 0.00 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 1tk8 h PHE 12 Cb 0.60 -0.38 -0.00 0.00 2.56 0.00 0.00 35.95 38.73 1tk8 h PHE 12 CO 0.00 0.63 -0.15 0.22 -2.02 0.00 0.00 178.31 176.99 1tk8 h ASP 13 N 1.16 -0.38 1.24 0.41 1.82 -1.79 -0.64 116.42 118.24 1tk8 h ASP 13 Ca 0.39 0.02 -0.16 0.00 -0.39 0.00 0.00 57.03 56.89 1tk8 h ASP 13 Cb 0.06 0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 1tk8 h ASP 13 CO -0.14 -0.25 -0.76 0.71 -1.61 0.00 0.00 179.24 177.18 1tk8 h THR 14 N -0.40 1.26 0.00 2.25 1.35 -1.83 -1.90 112.91 113.64 1tk8 h THR 14 Ca -0.03 -2.80 -0.19 0.00 -0.55 0.00 0.00 66.41 62.85 1tk8 h THR 14 Cb 0.33 2.62 -0.02 0.00 -1.73 0.00 0.00 68.15 69.35 1tk8 h THR 14 CO 0.04 0.72 -0.87 0.44 -0.25 0.00 0.00 175.52 175.60 1tk8 h ASP 15 N 0.00 0.06 0.00 5.36 3.32 -1.02 -3.32 116.42 120.82 1tk8 h ASP 15 Ca -0.01 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1tk8 h ASP 15 Cb 1.58 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.11 1tk8 h ASP 15 CO 0.10 0.90 -0.33 0.52 -1.72 0.00 0.00 179.24 178.71 1tk8 n VAL 16 N -3.55 1.05 0.14 -1.35 0.31 -0.25 -4.20 118.33 110.48 1tk8 n VAL 16 Ca -0.01 0.28 0.06 0.00 -0.01 0.00 0.00 64.34 64.65 1tk8 n VAL 16 Cb 0.82 -1.76 0.29 0.00 -0.91 0.00 0.00 33.84 32.28 1tk8 n VAL 16 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1tk8 n LEU 17 N -3.59 0.26 -0.02 7.52 4.77 -0.74 -2.15 117.00 123.05 1tk8 n LEU 17 Ca -0.05 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1tk8 n LEU 17 Cb 0.17 -0.63 0.01 0.00 -2.33 0.00 0.00 43.42 40.64 1tk8 n LEU 17 CO 0.07 -0.65 0.38 0.29 -1.33 0.00 0.00 177.39 176.15 1tk8 n LYS 18 N -1.84 1.47 0.02 3.23 5.02 -1.07 -2.81 118.16 122.18 1tk8 n LYS 18 Ca 0.00 -1.07 0.14 0.00 -2.02 0.00 0.00 58.31 55.37 1tk8 n LYS 18 Cb 0.05 -0.77 0.60 0.00 -0.02 0.00 0.00 35.03 34.89 1tk8 n LYS 18 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1tk8 h ALA 19 N 0.00 2.21 -5.78 7.82 0.00 -1.53 -3.47 119.26 118.51 1tk8 h ALA 19 Ca 0.00 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 1tk8 h ALA 19 Cb 0.78 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 18.65 1tk8 h ALA 19 CO 0.00 -0.32 -0.71 -0.25 0.00 0.00 0.00 179.25 177.97 1tk8 n ASP 20 N -4.45 -6.37 0.00 0.00 9.92 -1.26 -4.96 116.55 109.44 1tk8 n ASP 20 Ca 0.07 -0.69 0.00 0.00 -0.53 0.00 0.00 54.79 53.65 1tk8 n ASP 20 Cb 0.41 -4.39 0.00 0.00 -0.64 0.00 0.00 41.12 36.50 1tk8 n ASP 20 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1tk8 n GLY 21 N -1.53 -0.89 3.67 0.44 0.00 -1.26 -5.03 105.19 100.60 1tk8 n GLY 21 Ca -0.08 -1.15 -0.40 0.00 0.00 0.00 0.00 46.02 44.39 1tk8 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tk8 s ALA 22 N -2.00 3.50 -0.13 4.61 0.00 -1.26 -4.24 121.76 122.24 1tk8 s ALA 22 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.80 1tk8 s ALA 22 Cb 0.00 -2.97 0.02 0.00 0.00 0.00 0.00 23.12 20.16 1tk8 s ALA 22 CO 0.00 -0.46 -0.17 0.42 0.00 0.00 0.00 175.76 175.56 1tk8 s ILE 23 N 1.67 1.69 -0.38 0.00 -1.09 -0.17 -0.76 121.20 122.16 1tk8 s ILE 23 Ca 0.31 -0.74 -0.14 0.00 -2.23 0.00 0.00 60.65 57.85 1tk8 s ILE 23 Cb -0.16 -1.54 0.00 0.00 -1.58 0.00 0.00 42.46 39.18 1tk8 s ILE 23 CO 0.12 0.48 0.27 -0.22 -1.23 0.00 0.00 174.94 174.36 1tk8 s LEU 24 N 1.13 4.82 -0.15 2.97 2.96 0.83 0.78 118.68 132.01 1tk8 s LEU 24 Ca -0.02 -0.66 -0.08 0.00 -0.22 0.00 0.00 54.13 53.14 1tk8 s LEU 24 Cb -0.14 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.35 1tk8 s LEU 24 CO -0.05 -0.34 0.13 -0.69 -1.32 0.00 0.00 176.35 174.07 1tk8 s VAL 25 N 1.70 5.40 -0.24 1.68 1.01 0.13 0.07 120.40 130.15 1tk8 s VAL 25 Ca 0.06 0.18 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 1tk8 s VAL 25 Cb -0.18 -3.40 0.03 0.00 0.00 0.00 0.00 36.38 32.83 1tk8 s VAL 25 CO 0.10 0.54 -0.08 -0.62 0.00 0.00 0.00 175.10 175.04 1tk8 s ASP 26 N -0.42 4.18 -0.31 3.32 2.15 0.76 -0.94 116.67 125.41 1tk8 s ASP 26 Ca 0.12 -0.87 -0.18 0.00 0.43 0.00 0.00 52.55 52.04 1tk8 s ASP 26 Cb -0.12 -1.63 -0.01 0.00 -0.30 0.00 0.00 42.92 40.86 1tk8 s ASP 26 CO 0.01 -0.11 0.53 -0.36 -0.17 0.00 0.00 175.17 175.07 1tk8 s PHE 27 N 1.31 3.21 0.38 -5.34 0.40 -0.50 -0.69 117.98 116.74 1tk8 s PHE 27 Ca 0.00 0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.78 1tk8 s PHE 27 Cb -0.16 -2.88 -0.02 0.00 0.51 0.00 0.00 43.02 40.47 1tk8 s PHE 27 CO -0.06 -0.45 0.21 -2.67 0.70 0.00 0.00 175.22 172.96 1tk8 n TRP 28 N 5.71 -0.29 -3.72 0.36 4.27 -0.96 -2.38 117.44 120.43 1tk8 n TRP 28 Ca -0.04 -2.73 -0.14 0.00 -3.89 0.00 0.00 57.50 50.70 1tk8 n TRP 28 Cb 0.49 0.13 -0.09 0.00 -1.36 0.00 0.00 31.31 30.49 1tk8 n TRP 28 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1tk8 s ALA 29 N -3.23 -1.00 0.28 -1.67 0.00 -1.26 -1.59 121.76 113.29 1tk8 s ALA 29 Ca 0.30 0.72 0.37 0.00 0.00 0.00 0.00 51.96 53.34 1tk8 s ALA 29 Cb 0.01 -0.16 1.68 0.00 0.00 0.00 0.00 23.12 24.66 1tk8 s ALA 29 CO 0.21 -0.26 2.10 1.49 0.00 0.00 0.00 175.76 179.30 1tk8 h GLU 30 N 4.22 0.00 -0.53 0.00 4.57 -2.00 -2.94 114.58 117.90 1tk8 h GLU 30 Ca -0.28 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.90 1tk8 h GLU 30 Cb 1.17 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 1tk8 h GLU 30 CO 0.35 0.01 0.00 -2.67 -1.18 0.00 0.00 179.01 175.52 1tk8 n TRP 31 N -3.12 0.73 -3.92 0.92 4.27 -1.26 -4.90 117.44 110.17 1tk8 n TRP 31 Ca -0.01 -0.35 -0.35 0.00 -3.89 0.00 0.00 57.50 52.90 1tk8 n TRP 31 Cb 0.24 -0.02 -0.10 0.00 -1.36 0.00 0.00 31.31 30.06 1tk8 n TRP 31 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1tk8 h GLY 33 N 6.93 -0.76 1.05 0.00 0.00 -1.90 -2.83 103.07 105.56 1tk8 h GLY 33 Ca -0.37 0.28 0.10 0.00 0.00 0.00 0.00 47.33 47.34 1tk8 h GLY 33 CO 0.69 -0.28 0.39 -2.55 0.00 0.00 0.00 176.54 174.79 1tk8 h PRO 34 N -0.89 0.34 -0.71 4.80 0.11 -1.95 -1.77 132.00 131.93 1tk8 h PRO 34 Ca -0.07 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.97 1tk8 h PRO 34 Cb 0.62 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.62 1tk8 h PRO 34 CO 0.12 0.22 0.28 0.00 -0.21 0.00 0.00 178.00 178.42 1tk8 h LYS 36 N 1.02 0.00 0.22 0.00 3.64 -1.09 -2.65 116.57 117.72 1tk8 h LYS 36 Ca 0.24 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 1tk8 h LYS 36 Cb 0.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1tk8 h LYS 36 CO -0.02 0.30 -0.11 0.52 -2.27 0.00 0.00 179.45 177.87 1tk8 h MET 37 N 0.00 -0.29 0.00 1.90 2.86 -1.00 -3.29 114.93 115.11 1tk8 h MET 37 Ca -0.00 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1tk8 h MET 37 Cb 0.64 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.36 1tk8 h MET 37 CO 0.04 0.07 0.00 0.97 1.06 0.00 0.00 176.91 179.05 1tk8 h ILE 38 N -0.73 0.00 0.26 -1.22 2.10 -1.38 -3.34 117.51 113.20 1tk8 h ILE 38 Ca -0.03 -0.43 0.00 0.00 1.08 0.00 0.00 64.86 65.48 1tk8 h ILE 38 Cb 0.49 1.32 -0.04 0.00 -1.09 0.00 0.00 36.82 37.51 1tk8 h ILE 38 CO 0.05 0.00 -0.49 0.00 -1.08 0.00 0.00 178.15 176.63 1tk8 h ALA 39 N 2.16 -0.98 -0.97 0.18 0.00 -1.54 -1.31 119.26 116.80 1tk8 h ALA 39 Ca 0.00 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 54.97 1tk8 h ALA 39 Cb 0.51 0.79 -0.09 0.00 0.00 0.00 0.00 17.79 19.00 1tk8 h ALA 39 CO 0.00 -1.11 0.61 -1.35 0.00 0.00 0.00 179.25 177.40 1tk8 h PRO 40 N -0.82 0.64 -0.12 0.00 0.11 -1.77 0.62 132.00 130.66 1tk8 h PRO 40 Ca -0.02 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.00 1tk8 h PRO 40 Cb 0.78 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 1tk8 h PRO 40 CO -0.20 0.42 -0.19 0.82 -0.21 0.00 0.00 178.00 178.65 1tk8 h ILE 41 N 0.65 1.20 -0.01 4.15 1.08 -1.55 -2.40 117.51 120.63 1tk8 h ILE 41 Ca 0.53 -0.90 -0.15 0.00 -0.39 0.00 0.00 64.86 63.95 1tk8 h ILE 41 Cb 0.97 1.32 -0.02 0.00 -3.07 0.00 0.00 36.82 36.01 1tk8 h ILE 41 CO -0.29 0.28 -0.70 -0.07 -0.69 0.00 0.00 178.15 176.67 1tk8 h LEU 42 N 0.19 0.04 0.10 1.44 3.38 0.22 -2.09 115.31 118.59 1tk8 h LEU 42 Ca 0.04 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tk8 h LEU 42 Cb 0.45 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1tk8 h LEU 42 CO 0.03 0.73 -0.05 0.44 0.09 0.00 0.00 178.44 179.68 1tk8 h ASP 43 N 0.02 -0.11 -0.38 -0.43 3.32 -1.06 0.32 116.42 118.10 1tk8 h ASP 43 Ca -0.01 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1tk8 h ASP 43 Cb 1.23 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.80 1tk8 h ASP 43 CO 0.09 0.07 0.25 -0.33 -1.72 0.00 0.00 179.24 177.60 1tk8 h GLU 44 N -0.30 0.51 -0.44 3.56 5.08 -1.51 -2.77 114.58 118.71 1tk8 h GLU 44 Ca -0.01 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.35 1tk8 h GLU 44 Cb 0.25 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1tk8 h GLU 44 CO 0.02 0.36 0.18 0.82 -1.00 0.00 0.00 179.01 179.40 1tk8 h ILE 45 N 0.51 0.91 -0.82 3.13 1.08 -1.23 -2.23 117.51 118.87 1tk8 h ILE 45 Ca 0.14 -0.13 0.20 0.00 -0.39 0.00 0.00 64.86 64.68 1tk8 h ILE 45 Cb -0.03 0.50 -0.13 0.00 -3.07 0.00 0.00 36.82 34.09 1tk8 h ILE 45 CO -0.03 0.07 0.20 0.00 -0.69 0.00 0.00 178.15 177.70 1tk8 h ALA 46 N 1.26 1.12 -0.93 1.87 0.00 -0.64 -1.09 119.26 120.84 1tk8 h ALA 46 Ca 0.20 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1tk8 h ALA 46 Cb 0.15 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1tk8 h ALA 46 CO -0.17 -0.40 0.00 -0.25 0.00 0.00 0.00 179.25 178.43 1tk8 n ASP 47 N -5.20 0.00 -0.44 0.00 9.92 -0.88 -2.43 116.55 117.52 1tk8 n ASP 47 Ca 0.18 0.69 0.38 0.00 -0.53 0.00 0.00 54.79 55.50 1tk8 n ASP 47 Cb 0.58 -0.34 0.64 0.00 -0.64 0.00 0.00 41.12 41.35 1tk8 n ASP 47 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1tk8 n GLU 48 N -1.53 -0.04 -0.62 -1.24 1.02 -0.98 0.11 120.64 117.36 1tk8 n GLU 48 Ca 0.00 1.20 0.09 0.00 -0.02 0.00 0.00 57.16 58.43 1tk8 n GLU 48 Cb 0.00 -2.35 0.35 0.00 -0.02 0.00 0.00 31.44 29.42 1tk8 n GLU 48 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1tk8 n TYR 49 N -4.65 1.48 -1.89 -0.32 4.02 -0.43 -4.96 117.16 110.42 1tk8 n TYR 49 Ca 0.38 -0.64 -0.42 0.00 -0.01 0.00 0.00 57.90 57.21 1tk8 n TYR 49 Cb 1.47 -0.27 -0.03 0.00 -0.02 0.00 0.00 39.34 40.49 1tk8 n TYR 49 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 1tk8 s GLN 50 N -1.99 4.18 0.00 -0.72 0.74 0.30 -1.51 119.66 120.66 1tk8 s GLN 50 Ca 0.50 2.37 0.00 0.00 0.05 0.00 0.00 55.36 58.28 1tk8 s GLN 50 Cb 0.33 -3.77 0.00 0.00 1.10 0.00 0.00 33.01 30.67 1tk8 s GLN 50 CO 0.22 -0.80 0.00 0.41 -0.55 0.00 0.00 175.29 174.57 1tk8 n GLY 51 N 4.13 3.29 0.32 2.59 0.00 -1.26 -4.82 105.19 109.44 1tk8 n GLY 51 Ca 0.17 -1.07 0.05 0.00 0.00 0.00 0.00 46.02 45.18 1tk8 n GLY 51 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1tk8 n LYS 52 N 0.00 1.48 -3.66 1.61 2.85 -1.02 -5.01 118.16 114.41 1tk8 n LYS 52 Ca 0.00 -0.84 -0.14 0.00 -1.05 0.00 0.00 58.31 56.29 1tk8 n LYS 52 Cb 0.00 -1.15 -0.08 0.00 -0.65 0.00 0.00 35.03 33.15 1tk8 n LYS 52 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 1tk8 s LEU 53 N -1.39 -0.39 -0.13 -5.58 2.96 -0.57 -4.44 118.68 109.15 1tk8 s LEU 53 Ca 0.11 1.24 0.00 0.00 -0.22 0.00 0.00 54.13 55.26 1tk8 s LEU 53 Cb 0.09 2.15 -0.01 0.00 0.50 0.00 0.00 46.19 48.91 1tk8 s LEU 53 CO 0.22 -0.23 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.00 1tk8 s THR 54 N 0.29 2.97 -0.25 3.68 2.01 0.06 -4.31 115.64 120.10 1tk8 s THR 54 Ca -0.00 -0.69 -0.10 0.00 0.31 0.00 0.00 61.69 61.20 1tk8 s THR 54 Cb -0.04 -2.24 -0.05 0.00 0.01 0.00 0.00 72.50 70.17 1tk8 s THR 54 CO 0.01 0.53 0.16 -0.69 -0.69 0.00 0.00 174.62 173.94 1tk8 s VAL 55 N 0.38 5.31 0.06 3.82 1.01 -1.26 -0.12 120.40 129.59 1tk8 s VAL 55 Ca -0.11 0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.10 1tk8 s VAL 55 Cb -0.16 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1tk8 s VAL 55 CO 0.06 0.33 -0.19 0.00 0.00 0.00 0.00 175.10 175.30 1tk8 s ALA 56 N 1.19 1.62 -0.02 5.51 0.00 0.11 -0.85 121.76 129.32 1tk8 s ALA 56 Ca 0.07 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 51.04 1tk8 s ALA 56 Cb -0.14 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 1tk8 s ALA 56 CO 0.06 0.34 -0.22 0.15 0.00 0.00 0.00 175.76 176.08 1tk8 s LYS 57 N -1.42 1.84 -0.17 0.00 1.02 -0.27 -0.17 119.74 120.57 1tk8 s LYS 57 Ca 0.05 -0.79 -0.01 0.00 0.02 0.00 0.00 55.97 55.25 1tk8 s LYS 57 Cb -0.09 -1.75 0.05 0.00 -0.52 0.00 0.00 37.83 35.52 1tk8 s LYS 57 CO 0.02 0.46 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.71 1tk8 s LEU 58 N -0.47 1.53 -0.49 3.17 2.96 0.13 -1.43 118.68 124.08 1tk8 s LEU 58 Ca 0.07 -0.71 -0.29 0.00 -0.22 0.00 0.00 54.13 52.99 1tk8 s LEU 58 Cb -0.09 -0.83 0.03 0.00 0.50 0.00 0.00 46.19 45.80 1tk8 s LEU 58 CO -0.00 -0.22 1.13 0.21 -1.32 0.00 0.00 176.35 176.15 1tk8 s ASN 59 N 1.69 6.61 0.25 3.68 3.84 -1.26 -2.26 114.94 127.48 1tk8 s ASN 59 Ca -0.00 0.41 0.16 0.00 0.21 0.00 0.00 52.86 53.64 1tk8 s ASN 59 Cb -0.16 -2.54 0.90 0.00 -0.55 0.00 0.00 41.25 38.89 1tk8 s ASN 59 CO -0.07 -1.26 1.50 2.30 -2.79 0.00 0.00 177.10 176.77 1tk8 n ILE 60 N 6.81 1.24 -0.08 -5.21 -5.35 -0.62 -0.89 119.36 115.26 1tk8 n ILE 60 Ca 0.11 0.69 -0.18 0.00 -0.27 0.00 0.00 62.75 63.10 1tk8 n ILE 60 Cb 0.49 -1.69 -0.12 0.00 -1.74 0.00 0.00 39.64 36.58 1tk8 n ILE 60 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1tk8 h ASP 61 N 0.00 0.04 0.42 7.28 3.32 -1.91 -3.23 116.42 122.34 1tk8 h ASP 61 Ca 0.00 -0.76 -0.11 0.00 0.02 0.00 0.00 57.03 56.18 1tk8 h ASP 61 Cb 0.02 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1tk8 h ASP 61 CO 0.00 1.28 -0.50 1.56 -1.72 0.00 0.00 179.24 179.86 1tk8 h GLN 62 N -0.93 0.09 -3.23 3.56 4.20 -1.85 -3.37 115.11 113.57 1tk8 h GLN 62 Ca -0.19 -0.05 -0.61 0.00 0.06 0.00 0.00 58.65 57.86 1tk8 h GLN 62 Cb 1.21 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.60 1tk8 h GLN 62 CO -0.09 0.58 -0.74 -0.80 -0.67 0.00 0.00 178.83 177.11 1tk8 s ASN 63 N -6.89 3.82 0.00 1.46 0.01 -0.07 -4.92 114.94 108.35 1tk8 s ASN 63 Ca -0.03 -2.37 0.27 0.00 -0.71 0.00 0.00 52.86 50.02 1tk8 s ASN 63 Cb 0.13 -1.05 0.87 0.00 0.41 0.00 0.00 41.25 41.62 1tk8 s ASN 63 CO 0.76 -0.31 1.64 -0.81 -1.51 0.00 0.00 177.10 176.87 1tk8 n PRO 64 N 3.88 0.76 0.08 -0.60 -0.04 -1.22 -4.18 135.00 133.68 1tk8 n PRO 64 Ca 0.06 -0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.12 1tk8 n PRO 64 Cb 0.37 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.29 1tk8 n PRO 64 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1tk8 h GLY 65 N 4.94 0.00 0.12 0.55 0.00 -1.93 -3.41 103.07 103.34 1tk8 h GLY 65 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1tk8 h GLY 65 CO 0.00 0.00 -0.03 -0.84 0.00 0.00 0.00 176.54 175.67 1tk8 h THR 66 N 0.00 0.85 -0.80 4.70 2.02 -1.93 -3.39 112.91 114.35 1tk8 h THR 66 Ca -0.09 -1.47 0.19 0.00 0.77 0.00 0.00 66.41 65.82 1tk8 h THR 66 Cb 1.53 1.54 -0.14 0.00 -1.74 0.00 0.00 68.15 69.35 1tk8 h THR 66 CO 0.06 0.27 0.09 0.00 0.37 0.00 0.00 175.52 176.30 1tk8 h ALA 67 N -0.47 0.96 -0.99 6.16 0.00 -1.83 -1.73 119.26 121.36 1tk8 h ALA 67 Ca -0.01 0.24 0.19 0.00 0.00 0.00 0.00 54.91 55.33 1tk8 h ALA 67 Cb 0.50 0.38 -0.10 0.00 0.00 0.00 0.00 17.79 18.57 1tk8 h ALA 67 CO 0.01 -0.43 0.61 -1.35 0.00 0.00 0.00 179.25 178.10 1tk8 h PRO 68 N 0.14 0.69 0.00 0.00 0.11 -1.80 0.19 132.00 131.33 1tk8 h PRO 68 Ca 0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.53 1tk8 h PRO 68 Cb 0.86 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1tk8 h PRO 68 CO -0.66 0.46 0.00 0.87 -0.21 0.00 0.00 178.00 178.45 1tk8 h LYS 69 N 0.71 0.00 -0.34 1.05 1.57 -1.52 -1.95 116.57 116.08 1tk8 h LYS 69 Ca 0.56 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 1tk8 h LYS 69 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1tk8 h LYS 69 CO -0.34 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.20 1tk8 n TYR 70 N -2.56 0.56 -3.72 -1.35 4.01 0.64 -4.99 117.16 109.75 1tk8 n TYR 70 Ca -0.01 -0.56 -0.27 0.00 -0.16 0.00 0.00 57.90 56.91 1tk8 n TYR 70 Cb 0.13 -0.07 0.05 0.00 -0.31 0.00 0.00 39.34 39.14 1tk8 n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tk8 n GLY 71 N 0.39 -0.53 3.70 2.72 0.00 -0.74 -4.90 105.19 105.83 1tk8 n GLY 71 Ca 0.13 0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 1tk8 n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tk8 s ILE 72 N -3.30 2.37 0.00 -0.61 -1.09 -1.21 -4.84 121.20 112.52 1tk8 s ILE 72 Ca 0.61 0.01 0.00 0.00 -2.23 0.00 0.00 60.65 59.05 1tk8 s ILE 72 Cb -0.29 -3.01 0.00 0.00 -1.58 0.00 0.00 42.46 37.58 1tk8 s ILE 72 CO 0.76 0.00 0.11 -1.14 -1.23 0.00 0.00 174.94 173.43 1tk8 n ARG 73 N 5.24 3.32 -3.65 2.79 0.00 -1.26 -4.95 116.66 118.14 1tk8 n ARG 73 Ca 0.17 -0.11 -0.14 0.00 -0.00 0.00 0.00 57.85 57.78 1tk8 n ARG 73 Cb 0.37 -0.51 -0.07 0.00 0.00 0.00 0.00 32.46 32.26 1tk8 n ARG 73 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1tk8 s GLY 74 N -0.50 -0.31 0.04 5.14 0.00 -1.26 -5.17 107.32 105.26 1tk8 s GLY 74 Ca 0.00 0.49 0.04 0.00 0.00 0.00 0.00 44.72 45.25 1tk8 s GLY 74 CO 0.00 0.23 -0.11 -0.26 0.00 0.00 0.00 173.10 172.96 1tk8 s ILE 75 N -2.03 0.84 0.23 0.90 -4.36 -1.26 -3.75 121.20 111.77 1tk8 s ILE 75 Ca -0.08 -1.03 -0.30 0.00 -0.26 0.00 0.00 60.65 58.98 1tk8 s ILE 75 Cb -0.02 -0.82 -0.09 0.00 1.25 0.00 0.00 42.46 42.79 1tk8 s ILE 75 CO 0.01 -0.18 1.02 -2.16 0.24 0.00 0.00 174.94 173.87 1tk8 s PRO 76 N -1.35 4.73 -0.16 0.37 0.04 -1.26 -4.72 135.00 132.65 1tk8 s PRO 76 Ca -0.03 1.64 -0.05 0.00 0.04 0.00 0.00 61.00 62.59 1tk8 s PRO 76 Cb -0.09 -3.26 -0.04 0.00 0.04 0.00 0.00 34.50 31.16 1tk8 s PRO 76 CO 0.01 0.32 0.02 0.99 0.04 0.00 0.00 177.00 178.38 1tk8 s THR 77 N -0.93 4.44 -0.37 1.26 2.01 -1.00 -1.40 115.64 119.65 1tk8 s THR 77 Ca 0.44 -0.16 -0.06 0.00 0.31 0.00 0.00 61.69 62.22 1tk8 s THR 77 Cb -0.28 -2.97 0.07 0.00 0.01 0.00 0.00 72.50 69.32 1tk8 s THR 77 CO 0.36 0.50 0.16 -0.76 -0.69 0.00 0.00 174.62 174.18 1tk8 s LEU 78 N 0.16 4.70 -0.26 4.42 1.43 0.44 -1.41 118.68 128.17 1tk8 s LEU 78 Ca 0.02 -1.43 -0.08 0.00 -1.03 0.00 0.00 54.13 51.61 1tk8 s LEU 78 Cb -0.13 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 1tk8 s LEU 78 CO 0.01 -0.43 0.09 -0.76 0.23 0.00 0.00 176.35 175.50 1tk8 s LEU 79 N 1.34 3.55 -0.41 1.79 1.02 -0.12 -1.47 118.68 124.39 1tk8 s LEU 79 Ca 0.01 -0.22 -0.17 0.00 0.02 0.00 0.00 54.13 53.77 1tk8 s LEU 79 Cb -0.21 -1.95 0.02 0.00 0.02 0.00 0.00 46.19 44.07 1tk8 s LEU 79 CO 0.01 -0.05 0.44 -0.22 0.02 0.00 0.00 176.35 176.55 1tk8 s LEU 80 N 1.63 4.81 0.07 1.79 0.20 0.11 0.17 118.68 127.46 1tk8 s LEU 80 Ca 0.06 -0.62 -0.03 0.00 0.69 0.00 0.00 54.13 54.23 1tk8 s LEU 80 Cb -0.15 -2.40 -0.05 0.00 -0.43 0.00 0.00 46.19 43.16 1tk8 s LEU 80 CO 0.05 -0.57 0.28 -0.36 -0.29 0.00 0.00 176.35 175.46 1tk8 s PHE 81 N 2.15 3.52 -0.25 5.38 0.40 0.23 -0.23 117.98 129.19 1tk8 s PHE 81 Ca 0.12 0.44 -0.04 0.00 -0.60 0.00 0.00 56.93 56.86 1tk8 s PHE 81 Cb -0.17 -1.90 0.13 0.00 0.51 0.00 0.00 43.02 41.59 1tk8 s PHE 81 CO 0.14 0.55 0.43 0.21 0.70 0.00 0.00 175.22 177.25 1tk8 s LYS 82 N -2.34 0.39 -1.08 0.44 2.47 -0.74 -1.00 119.74 117.88 1tk8 s LYS 82 Ca 0.35 0.76 -0.05 0.00 -1.56 0.00 0.00 55.97 55.47 1tk8 s LYS 82 Cb -0.13 -0.08 -0.06 0.00 -1.46 0.00 0.00 37.83 36.11 1tk8 s LYS 82 CO 0.23 -0.54 0.93 0.09 0.16 0.00 0.00 175.35 176.23 1tk8 n ASN 83 N 5.38 -5.77 -0.36 1.43 4.13 -1.26 -3.31 115.26 115.50 1tk8 n ASN 83 Ca -0.05 -0.69 -0.05 0.00 1.68 0.00 0.00 54.58 55.48 1tk8 n ASN 83 Cb 0.50 -5.20 -0.02 0.00 -1.54 0.00 0.00 39.78 33.52 1tk8 n ASN 83 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1tk8 n GLY 84 N -1.21 0.53 3.03 7.41 0.00 -1.12 -4.98 105.19 108.85 1tk8 n GLY 84 Ca -0.11 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 1tk8 n GLY 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tk8 s GLU 85 N -2.17 0.41 -0.18 1.61 2.02 -1.21 -4.90 118.70 114.27 1tk8 s GLU 85 Ca 0.00 -0.64 -0.29 0.00 0.02 0.00 0.00 54.97 54.06 1tk8 s GLU 85 Cb 0.00 0.15 -0.03 0.00 0.10 0.00 0.00 34.13 34.35 1tk8 s GLU 85 CO 0.00 -0.08 1.58 0.08 0.02 0.00 0.00 175.26 176.86 1tk8 s VAL 86 N -1.80 3.74 -0.08 2.63 1.01 -1.26 -1.78 120.40 122.85 1tk8 s VAL 86 Ca -0.12 0.85 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 1tk8 s VAL 86 Cb -0.07 -3.69 -0.26 0.00 0.00 0.00 0.00 36.38 32.36 1tk8 s VAL 86 CO -0.02 -0.23 0.51 0.00 0.00 0.00 0.00 175.10 175.36 1tk8 h ALA 87 N 10.22 0.48 -2.09 5.51 0.00 -0.94 -3.48 119.26 128.95 1tk8 h ALA 87 Ca -0.34 -1.36 -0.07 0.00 0.00 0.00 0.00 54.91 53.14 1tk8 h ALA 87 Cb 1.15 0.59 -0.19 0.00 0.00 0.00 0.00 17.79 19.34 1tk8 h ALA 87 CO 0.99 1.34 0.11 0.00 0.00 0.00 0.00 179.25 181.68 1tk8 s ALA 88 N -2.58 -1.61 -0.00 0.00 0.00 -1.17 -5.02 121.76 111.38 1tk8 s ALA 88 Ca -0.16 1.25 0.01 0.00 0.00 0.00 0.00 51.96 53.06 1tk8 s ALA 88 Cb 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 23.05 1tk8 s ALA 88 CO 0.80 -0.35 -0.04 0.95 0.00 0.00 0.00 175.76 177.12 1tk8 s THR 89 N -1.01 0.29 -0.04 0.00 -4.23 -1.26 -0.71 115.64 108.68 1tk8 s THR 89 Ca -0.10 -0.17 -0.01 0.00 -1.18 0.00 0.00 61.69 60.23 1tk8 s THR 89 Cb -0.01 -0.25 0.03 0.00 1.34 0.00 0.00 72.50 73.61 1tk8 s THR 89 CO 0.08 0.08 0.09 -0.75 -0.54 0.00 0.00 174.62 173.58 1tk8 s LYS 90 N -0.10 0.02 -0.22 3.99 2.47 -0.54 -5.00 119.74 120.36 1tk8 s LYS 90 Ca 0.01 0.29 -0.05 0.00 -1.56 0.00 0.00 55.97 54.66 1tk8 s LYS 90 Cb -0.02 -0.22 -0.02 0.00 -1.46 0.00 0.00 37.83 36.12 1tk8 s LYS 90 CO -0.00 -0.17 -0.00 0.08 0.16 0.00 0.00 175.35 175.41 1tk8 s VAL 91 N 1.17 3.77 0.00 4.02 1.01 -1.26 -0.42 120.40 128.69 1tk8 s VAL 91 Ca -0.09 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.53 1tk8 s VAL 91 Cb -0.12 -2.72 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1tk8 s VAL 91 CO -0.04 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.07 1tk8 n GLY 92 N 4.64 4.30 3.03 4.51 0.00 -0.50 -4.96 105.19 116.21 1tk8 n GLY 92 Ca -0.17 -1.53 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 1tk8 n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tk8 n ALA 93 N -1.88 4.43 -0.60 4.61 0.00 -1.26 -4.78 120.51 121.02 1tk8 n ALA 93 Ca 0.00 -3.69 -0.30 0.00 0.00 0.00 0.00 53.44 49.45 1tk8 n ALA 93 Cb 0.00 -3.57 0.20 0.00 0.00 0.00 0.00 19.45 16.08 1tk8 n ALA 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tk8 s LEU 94 N 2.97 2.08 0.45 0.00 1.43 -1.26 -4.91 118.68 119.44 1tk8 s LEU 94 Ca 0.52 1.97 0.03 0.00 -1.03 0.00 0.00 54.13 55.62 1tk8 s LEU 94 Cb 0.11 -4.16 0.01 0.00 0.03 0.00 0.00 46.19 42.18 1tk8 s LEU 94 CO 0.00 -3.58 0.64 -0.94 0.23 0.00 0.00 176.35 172.70 1tk8 s SER 95 N -2.56 5.71 0.16 2.29 1.04 -1.26 -4.79 113.70 114.28 1tk8 s SER 95 Ca 0.68 0.03 -0.28 0.00 0.48 0.00 0.00 55.95 56.85 1tk8 s SER 95 Cb -0.24 -1.21 -0.02 0.00 0.10 0.00 0.00 66.02 64.65 1tk8 s SER 95 CO 0.61 -0.76 1.56 0.50 0.98 0.00 0.00 173.24 176.13 1tk8 h LYS 96 N 0.45 -0.26 -0.95 4.02 1.63 -1.95 -0.91 116.57 118.61 1tk8 h LYS 96 Ca -0.44 0.02 0.04 0.00 -0.85 0.00 0.00 60.65 59.41 1tk8 h LYS 96 Cb 1.27 0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 32.90 1tk8 h LYS 96 CO 0.54 -0.17 0.62 0.78 -3.45 0.00 0.00 179.45 177.76 1tk8 h GLY 97 N -0.27 1.39 1.28 5.01 0.00 -1.99 -2.21 103.07 106.28 1tk8 h GLY 97 Ca 0.14 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 46.94 1tk8 h GLY 97 CO -0.67 0.39 0.06 1.46 0.00 0.00 0.00 176.54 177.78 1tk8 h GLN 98 N 1.18 0.89 -0.64 4.80 4.20 -1.69 -0.86 115.11 122.99 1tk8 h GLN 98 Ca 0.38 -0.22 -0.06 0.00 0.06 0.00 0.00 58.65 58.81 1tk8 h GLN 98 Cb 0.03 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 1tk8 h GLN 98 CO -0.13 0.84 0.15 1.25 -0.67 0.00 0.00 178.83 180.27 1tk8 h LEU 99 N 0.84 0.97 0.19 1.46 6.46 -0.78 -1.44 115.31 123.01 1tk8 h LEU 99 Ca 0.17 -0.24 -0.01 0.00 -0.12 0.00 0.00 57.88 57.68 1tk8 h LEU 99 Cb 0.41 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.08 1tk8 h LEU 99 CO 0.01 0.95 -0.09 0.11 -0.62 0.00 0.00 178.44 178.80 1tk8 h LYS 100 N 0.94 -0.25 -0.28 1.25 1.57 -0.96 0.32 116.57 119.17 1tk8 h LYS 100 Ca 0.20 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.06 1tk8 h LYS 100 Cb 0.37 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.67 1tk8 h LYS 100 CO 0.00 -0.14 -0.11 0.93 -0.57 0.00 0.00 179.45 179.56 1tk8 h GLU 101 N -0.29 -0.06 -0.07 3.15 5.08 -1.03 0.18 114.58 121.53 1tk8 h GLU 101 Ca -0.03 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1tk8 h GLU 101 Cb 0.22 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1tk8 h GLU 101 CO 0.04 -0.04 -0.13 0.35 -1.00 0.00 0.00 179.01 178.23 1tk8 h PHE 102 N -0.07 -0.34 0.67 4.33 3.57 -0.98 -0.98 116.94 123.14 1tk8 h PHE 102 Ca 0.14 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 1tk8 h PHE 102 Cb 0.28 0.16 0.01 0.00 2.79 0.00 0.00 35.95 39.19 1tk8 h PHE 102 CO -0.31 -0.20 -0.32 -0.07 -2.23 0.00 0.00 178.31 175.18 1tk8 h LEU 103 N -0.19 -0.76 -1.40 0.59 3.38 0.14 -1.98 115.31 115.09 1tk8 h LEU 103 Ca 0.07 -0.01 0.20 0.00 0.09 0.00 0.00 57.88 58.23 1tk8 h LEU 103 Cb 0.29 0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.16 1tk8 h LEU 103 CO -0.18 -0.44 0.60 0.44 0.09 0.00 0.00 178.44 178.95 1tk8 h ASP 104 N -1.05 0.50 0.17 -0.43 3.32 -0.66 0.35 116.42 118.62 1tk8 h ASP 104 Ca -0.09 0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.84 1tk8 h ASP 104 Cb 0.72 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.22 1tk8 h ASP 104 CO 0.15 0.20 -0.66 0.00 -1.72 0.00 0.00 179.24 177.21 1tk8 h ALA 105 N 1.61 0.64 -0.02 3.45 0.00 -1.06 -3.24 119.26 120.64 1tk8 h ALA 105 Ca 0.49 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1tk8 h ALA 105 Cb 1.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1tk8 h ALA 105 CO -0.22 0.73 -0.19 0.09 0.00 0.00 0.00 179.25 179.66 1tk8 n ASN 106 N -3.88 1.81 -0.35 0.00 3.02 -0.34 -5.10 115.26 110.42 1tk8 n ASN 106 Ca -0.04 -1.44 0.04 0.00 -0.03 0.00 0.00 54.58 53.12 1tk8 n ASN 106 Cb 0.67 0.16 0.04 0.00 -0.61 0.00 0.00 39.78 40.03 1tk8 n ASN 106 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82