#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1txx h ASP 2 N 0.00 0.00 -0.31 4.04 5.19 -2.03 -2.99 116.42 120.32 1txx h ASP 2 Ca 0.00 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.30 1txx h ASP 2 Cb 0.00 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.44 1txx h ASP 2 CO 0.00 0.00 -0.03 0.29 -3.12 0.00 0.00 179.24 176.38 1txx n LYS 3 N -2.44 2.22 -4.87 3.56 4.01 -1.26 -4.98 118.16 114.41 1txx n LYS 3 Ca 0.03 -3.02 -0.27 0.00 -0.51 0.00 0.00 58.31 54.53 1txx n LYS 3 Cb 0.31 -1.82 -0.15 0.00 -0.51 0.00 0.00 35.03 32.86 1txx n LYS 3 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1txx s ILE 4 N -3.07 1.79 -0.20 -0.18 -1.09 -1.13 -4.56 121.20 112.75 1txx s ILE 4 Ca 0.43 -1.13 -0.08 0.00 -2.23 0.00 0.00 60.65 57.64 1txx s ILE 4 Cb 0.38 -1.52 -0.04 0.00 -1.58 0.00 0.00 42.46 39.70 1txx s ILE 4 CO 0.04 0.35 0.08 -0.63 -1.23 0.00 0.00 174.94 173.55 1txx s ILE 5 N -0.69 4.91 -0.29 2.92 -1.09 -0.54 -5.01 121.20 121.42 1txx s ILE 5 Ca 0.09 0.01 -0.12 0.00 -2.23 0.00 0.00 60.65 58.40 1txx s ILE 5 Cb -0.09 -3.23 -0.04 0.00 -1.58 0.00 0.00 42.46 37.52 1txx s ILE 5 CO 0.01 0.44 0.24 -2.28 -1.23 0.00 0.00 174.94 172.11 1txx s HIS 6 N 0.53 3.23 0.25 3.97 5.65 -1.26 -0.60 115.29 127.06 1txx s HIS 6 Ca 0.04 0.14 0.07 0.00 0.25 0.00 0.00 55.06 55.56 1txx s HIS 6 Cb -0.12 -2.44 -0.03 0.00 -1.18 0.00 0.00 32.58 28.80 1txx s HIS 6 CO 0.01 -0.21 0.24 -0.51 -0.65 0.00 0.00 174.74 173.62 1txx s LEU 7 N 1.83 3.92 0.23 8.88 1.43 -0.74 -4.99 118.68 129.25 1txx s LEU 7 Ca 0.09 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 53.03 1txx s LEU 7 Cb -0.16 -2.46 -0.05 0.00 0.03 0.00 0.00 46.19 43.54 1txx s LEU 7 CO 0.11 -0.07 0.00 0.42 0.23 0.00 0.00 176.35 177.04 1txx s THR 8 N -2.11 1.01 0.54 5.49 -4.23 -1.26 -4.60 115.64 110.48 1txx s THR 8 Ca 0.34 -2.03 0.20 0.00 -1.18 0.00 0.00 61.69 59.02 1txx s THR 8 Cb -0.08 -2.36 0.30 0.00 1.34 0.00 0.00 72.50 71.71 1txx s THR 8 CO 0.26 -0.31 2.15 0.44 -0.54 0.00 0.00 174.62 176.62 1txx h ASP 9 N 2.47 0.00 0.44 3.99 3.32 -1.91 -2.18 116.42 122.54 1txx h ASP 9 Ca -0.38 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.65 1txx h ASP 9 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1txx h ASP 9 CO 0.64 0.00 -0.21 0.44 -1.72 0.00 0.00 179.24 178.39 1txx h ASP 10 N 0.00 -0.50 0.25 6.45 5.19 -2.00 -3.29 116.42 122.52 1txx h ASP 10 Ca 0.03 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1txx h ASP 10 Cb 0.14 0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.78 1txx h ASP 10 CO -0.00 -0.11 0.00 -1.54 -3.12 0.00 0.00 179.24 174.47 1txx n SER 11 N -5.20 0.00 -0.21 6.45 3.41 -1.01 -3.73 113.62 113.32 1txx n SER 11 Ca -0.10 0.12 -0.06 0.00 -0.26 0.00 0.00 58.87 58.57 1txx n SER 11 Cb 0.29 -0.29 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1txx n SER 11 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1txx h PHE 12 N 0.00 0.79 -0.17 7.33 3.57 -1.47 -1.54 116.94 125.44 1txx h PHE 12 Ca 0.00 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.50 1txx h PHE 12 Cb 0.13 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1txx h PHE 12 CO 0.00 0.54 0.09 0.22 -2.23 0.00 0.00 178.31 176.93 1txx h ASP 13 N 0.80 0.14 0.44 0.41 3.58 -1.81 -0.71 116.42 119.28 1txx h ASP 13 Ca 0.21 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.65 1txx h ASP 13 Cb -0.01 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.02 1txx h ASP 13 CO -0.04 0.11 -0.21 0.74 -2.88 0.00 0.00 179.24 176.96 1txx h THR 14 N 0.20 0.00 0.00 2.25 2.02 -1.82 0.40 112.91 115.96 1txx h THR 14 Ca 0.07 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 1txx h THR 14 Cb 0.01 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.41 1txx h THR 14 CO -0.04 0.00 -0.06 0.44 0.37 0.00 0.00 175.52 176.23 1txx h ASP 15 N -1.07 0.00 0.00 4.18 3.32 -1.34 -2.61 116.42 118.90 1txx h ASP 15 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1txx h ASP 15 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1txx h ASP 15 CO 0.10 0.06 -0.02 0.52 -1.72 0.00 0.00 179.24 178.17 1txx n VAL 16 N -3.26 0.46 -0.25 -1.35 0.31 -0.30 -4.47 118.33 109.47 1txx n VAL 16 Ca -0.01 0.16 -0.01 0.00 -0.01 0.00 0.00 64.34 64.48 1txx n VAL 16 Cb 0.25 -1.25 0.11 0.00 -0.91 0.00 0.00 33.84 32.04 1txx n VAL 16 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1txx h LEU 17 N -0.02 0.62 0.00 7.52 3.38 -1.22 -2.40 115.31 123.19 1txx h LEU 17 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1txx h LEU 17 Cb 0.02 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1txx h LEU 17 CO 0.00 0.40 -0.59 0.11 0.09 0.00 0.00 178.44 178.45 1txx h LYS 18 N 0.75 0.00 -6.54 1.13 6.56 -0.22 -3.23 116.57 115.03 1txx h LYS 18 Ca 0.32 0.00 -0.59 0.00 -1.06 0.00 0.00 60.65 59.33 1txx h LYS 18 Cb 0.20 0.00 0.15 0.00 -0.57 0.00 0.00 32.23 32.01 1txx h LYS 18 CO -0.18 0.00 -0.16 0.00 -2.06 0.00 0.00 179.45 177.05 1txx n ALA 19 N -1.83 -0.67 -2.82 3.86 0.00 -0.90 -4.96 120.51 113.18 1txx n ALA 19 Ca 0.03 0.11 -0.34 0.00 0.00 0.00 0.00 53.44 53.24 1txx n ALA 19 Cb 0.44 -1.93 -0.11 0.00 0.00 0.00 0.00 19.45 17.86 1txx n ALA 19 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1txx s ASP 20 N -0.99 5.11 0.00 0.00 1.47 -1.26 -4.61 116.67 116.40 1txx s ASP 20 Ca 0.66 0.01 0.00 0.00 1.18 0.00 0.00 52.55 54.41 1txx s ASP 20 Cb -0.52 -1.69 0.00 0.00 -0.34 0.00 0.00 42.92 40.37 1txx s ASP 20 CO 0.55 0.25 0.00 0.61 0.68 0.00 0.00 175.17 177.26 1txx n GLY 21 N 3.01 0.99 3.72 2.12 0.00 -1.26 -4.97 105.19 108.79 1txx n GLY 21 Ca -0.18 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 1txx n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1txx s ALA 22 N -2.13 3.68 -0.18 4.61 0.00 -1.26 -4.60 121.76 121.88 1txx s ALA 22 Ca 0.00 1.24 0.01 0.00 0.00 0.00 0.00 51.96 53.21 1txx s ALA 22 Cb 0.00 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.57 1txx s ALA 22 CO 0.00 -0.69 -0.16 0.42 0.00 0.00 0.00 175.76 175.33 1txx s ILE 23 N 1.11 1.88 -0.35 0.00 -1.09 -0.22 -1.95 121.20 120.58 1txx s ILE 23 Ca 0.67 -0.92 -0.17 0.00 -2.23 0.00 0.00 60.65 58.00 1txx s ILE 23 Cb -0.40 -1.77 -0.00 0.00 -1.58 0.00 0.00 42.46 38.71 1txx s ILE 23 CO 0.31 0.42 0.43 -0.22 -1.23 0.00 0.00 174.94 174.65 1txx s LEU 24 N 1.34 4.45 -0.14 2.97 2.96 0.12 -0.35 118.68 130.03 1txx s LEU 24 Ca 0.03 -0.21 -0.03 0.00 -0.22 0.00 0.00 54.13 53.70 1txx s LEU 24 Cb -0.14 -2.44 -0.03 0.00 0.50 0.00 0.00 46.19 44.08 1txx s LEU 24 CO -0.11 -0.42 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.77 1txx s VAL 25 N 2.18 3.91 -0.43 1.68 1.01 0.01 -1.07 120.40 127.68 1txx s VAL 25 Ca 0.14 -0.36 -0.13 0.00 0.00 0.00 0.00 61.98 61.63 1txx s VAL 25 Cb -0.16 -2.69 0.05 0.00 0.00 0.00 0.00 36.38 33.58 1txx s VAL 25 CO 0.13 0.52 0.32 -0.62 0.00 0.00 0.00 175.10 175.44 1txx s ASP 26 N 0.12 5.97 -0.33 3.32 2.15 0.45 -0.91 116.67 127.44 1txx s ASP 26 Ca -0.01 -1.21 -0.20 0.00 0.43 0.00 0.00 52.55 51.56 1txx s ASP 26 Cb -0.14 -2.11 -0.00 0.00 -0.30 0.00 0.00 42.92 40.37 1txx s ASP 26 CO 0.03 -0.54 0.64 -0.36 -0.17 0.00 0.00 175.17 174.77 1txx s PHE 27 N 1.59 3.19 0.33 -5.34 0.40 -0.88 -0.63 117.98 116.64 1txx s PHE 27 Ca 0.04 0.50 0.04 0.00 -0.60 0.00 0.00 56.93 56.90 1txx s PHE 27 Cb -0.22 -3.06 -0.01 0.00 0.51 0.00 0.00 43.02 40.24 1txx s PHE 27 CO 0.07 -0.54 0.36 -2.67 0.70 0.00 0.00 175.22 173.13 1txx n TRP 28 N 5.96 -1.04 -4.06 0.36 4.27 -0.10 -2.99 117.44 119.83 1txx n TRP 28 Ca -0.01 -2.54 -0.10 0.00 -3.89 0.00 0.00 57.50 50.97 1txx n TRP 28 Cb 0.49 0.39 -0.09 0.00 -1.36 0.00 0.00 31.31 30.74 1txx n TRP 28 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1txx s ALA 29 N -3.08 0.48 0.10 -1.67 0.00 -1.26 -1.54 121.76 114.79 1txx s ALA 29 Ca 0.34 -1.21 -0.29 0.00 0.00 0.00 0.00 51.96 50.81 1txx s ALA 29 Cb 0.01 0.85 -0.12 0.00 0.00 0.00 0.00 23.12 23.86 1txx s ALA 29 CO 0.24 -0.55 1.63 1.49 0.00 0.00 0.00 175.76 178.57 1txx h GLU 30 N 2.73 -0.57 -1.01 0.00 4.81 -1.99 -3.28 114.58 115.27 1txx h GLU 30 Ca -0.34 0.04 -0.54 0.00 -0.13 0.00 0.00 59.36 58.40 1txx h GLU 30 Cb 1.21 0.13 -0.30 0.00 0.63 0.00 0.00 28.75 30.42 1txx h GLU 30 CO 0.54 -0.38 0.68 0.91 -0.73 0.00 0.00 179.01 180.04 1txx n TRP 31 N -5.40 3.02 -3.58 0.92 7.02 -1.26 -4.84 117.44 113.31 1txx n TRP 31 Ca -0.09 -2.04 -0.41 0.00 -1.02 0.00 0.00 57.50 53.94 1txx n TRP 31 Cb 0.31 -1.03 -0.10 0.00 -2.42 0.00 0.00 31.31 28.07 1txx n TRP 31 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1txx h VAL 33 N 5.99 1.20 -0.07 0.00 3.04 -1.91 -2.13 116.25 122.38 1txx h VAL 33 Ca -0.24 -0.42 -0.07 0.00 -1.01 0.00 0.00 66.70 64.95 1txx h VAL 33 Cb 1.09 0.14 -0.01 0.00 -2.01 0.00 0.00 31.29 30.50 1txx h VAL 33 CO 0.74 0.21 -0.30 -0.50 -1.01 0.00 0.00 177.57 176.71 1txx h TRP 34 N 1.01 0.14 -0.48 3.17 -0.00 -1.93 -1.62 115.95 116.24 1txx h TRP 34 Ca 0.27 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 59.11 1txx h TRP 34 Cb -0.07 -0.04 -0.02 0.00 -0.00 0.00 0.00 29.16 29.04 1txx h TRP 34 CO 0.00 0.42 0.21 0.00 -0.00 0.00 0.00 178.44 179.07 1txx h LYS 36 N 0.64 0.00 0.00 0.00 6.56 -1.06 -2.94 116.57 119.76 1txx h LYS 36 Ca 0.16 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.73 1txx h LYS 36 Cb 0.16 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.81 1txx h LYS 36 CO -0.02 0.36 -0.12 1.98 -2.06 0.00 0.00 179.45 179.59 1txx h MET 37 N 0.00 0.00 -0.00 3.15 4.05 -0.80 -3.25 114.93 118.08 1txx h MET 37 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1txx h MET 37 Cb 0.71 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.51 1txx h MET 37 CO 0.05 0.12 -0.75 0.44 0.23 0.00 0.00 176.91 176.99 1txx n ILE 38 N -3.15 0.00 -0.33 1.77 -5.35 -1.03 -4.43 119.36 106.84 1txx n ILE 38 Ca 0.03 -0.05 0.09 0.00 -0.27 0.00 0.00 62.75 62.55 1txx n ILE 38 Cb 0.52 0.82 0.27 0.00 -1.74 0.00 0.00 39.64 39.50 1txx n ILE 38 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1txx h ALA 39 N 3.18 1.49 -0.08 -1.28 0.00 -1.58 0.12 119.26 121.12 1txx h ALA 39 Ca 0.00 0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.79 1txx h ALA 39 Cb 0.54 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1txx h ALA 39 CO 0.00 0.01 -0.75 -1.35 0.00 0.00 0.00 179.25 177.15 1txx h PRO 40 N 0.77 0.43 -0.80 0.00 0.10 -1.80 -2.54 132.00 128.17 1txx h PRO 40 Ca 0.52 -0.36 -0.05 0.00 0.10 0.00 0.00 66.00 66.20 1txx h PRO 40 Cb 0.71 0.08 -0.04 0.00 0.10 0.00 0.00 31.00 31.85 1txx h PRO 40 CO -0.35 1.00 0.31 0.82 0.10 0.00 0.00 178.00 179.89 1txx h ILE 41 N 0.29 1.26 -0.16 4.15 5.03 -1.48 -0.93 117.51 125.67 1txx h ILE 41 Ca -0.04 -0.84 -0.03 0.00 -0.12 0.00 0.00 64.86 63.83 1txx h ILE 41 Cb 1.34 0.31 -0.01 0.00 -3.03 0.00 0.00 36.82 35.43 1txx h ILE 41 CO 0.13 0.34 -0.04 -0.07 -0.68 0.00 0.00 178.15 177.83 1txx h LEU 42 N 1.17 0.21 0.09 1.44 3.38 -0.70 -2.21 115.31 118.68 1txx h LEU 42 Ca 0.27 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 1txx h LEU 42 Cb 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1txx h LEU 42 CO -0.02 0.29 -0.04 0.44 0.09 0.00 0.00 178.44 179.20 1txx h ASP 43 N 0.23 -0.10 -0.59 -0.43 3.32 -0.74 -2.68 116.42 115.43 1txx h ASP 43 Ca 0.05 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 1txx h ASP 43 Cb 0.23 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 1txx h ASP 43 CO 0.01 0.11 0.36 -0.33 -1.72 0.00 0.00 179.24 177.67 1txx h GLU 44 N -0.32 0.79 -0.60 3.56 5.08 -1.25 -2.18 114.58 119.67 1txx h GLU 44 Ca -0.01 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1txx h GLU 44 Cb 0.27 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1txx h GLU 44 CO 0.02 0.56 0.24 0.82 -1.00 0.00 0.00 179.01 179.65 1txx h ILE 45 N 0.79 1.23 -0.44 3.13 5.03 -1.44 -0.49 117.51 125.32 1txx h ILE 45 Ca 0.21 -0.72 0.07 0.00 -0.12 0.00 0.00 64.86 64.31 1txx h ILE 45 Cb -0.03 0.57 -0.06 0.00 -3.03 0.00 0.00 36.82 34.27 1txx h ILE 45 CO -0.04 0.28 0.08 0.00 -0.68 0.00 0.00 178.15 177.78 1txx h ALA 46 N 1.09 0.47 -0.56 1.87 0.00 -1.27 0.63 119.26 121.49 1txx h ALA 46 Ca 0.20 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 1txx h ALA 46 Cb 0.20 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1txx h ALA 46 CO -0.02 -0.33 -0.03 0.22 0.00 0.00 0.00 179.25 179.10 1txx h ASP 47 N 0.20 0.97 1.51 0.00 3.58 -0.96 -2.93 116.42 118.80 1txx h ASP 47 Ca 0.22 -0.28 -0.03 0.00 0.42 0.00 0.00 57.03 57.35 1txx h ASP 47 Cb 0.28 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 1txx h ASP 47 CO -0.29 1.04 -0.16 -0.33 -2.88 0.00 0.00 179.24 176.62 1txx h GLU 48 N 0.91 0.00 -0.44 0.28 5.08 0.27 -3.29 114.58 117.38 1txx h GLU 48 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1txx h GLU 48 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1txx h GLU 48 CO 0.03 0.16 0.00 0.66 -1.00 0.00 0.00 179.01 178.86 1txx n TYR 49 N -3.18 1.39 -1.70 4.33 4.02 0.21 -5.03 117.16 117.20 1txx n TYR 49 Ca 0.02 -0.75 -0.44 0.00 -0.01 0.00 0.00 57.90 56.73 1txx n TYR 49 Cb 0.52 -0.35 -0.02 0.00 -0.02 0.00 0.00 39.34 39.47 1txx n TYR 49 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1txx n GLN 50 N 0.25 2.25 0.00 -0.72 6.02 -1.12 0.25 117.38 124.31 1txx n GLN 50 Ca 0.24 0.80 0.00 0.00 -0.01 0.00 0.00 57.00 58.02 1txx n GLN 50 Cb 0.96 -2.48 0.00 0.00 1.02 0.00 0.00 30.24 29.73 1txx n GLN 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1txx n GLY 51 N 1.96 2.75 0.07 1.08 0.00 -1.26 -4.68 105.19 105.11 1txx n GLY 51 Ca 0.10 -0.26 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 1txx n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1txx n LYS 52 N 0.00 1.08 -3.90 1.61 5.02 -0.46 -5.03 118.16 116.49 1txx n LYS 52 Ca 0.00 -0.04 -0.11 0.00 -2.02 0.00 0.00 58.31 56.15 1txx n LYS 52 Cb 0.00 -1.44 -0.10 0.00 -0.02 0.00 0.00 35.03 33.46 1txx n LYS 52 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1txx s LEU 53 N -5.11 1.74 -0.16 -0.35 2.96 0.14 -4.21 118.68 113.69 1txx s LEU 53 Ca -0.08 -0.24 -0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1txx s LEU 53 Cb 0.06 0.49 -0.00 0.00 0.50 0.00 0.00 46.19 47.24 1txx s LEU 53 CO 0.72 -0.32 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.40 1txx s THR 54 N -1.26 2.74 -0.23 3.68 2.01 -0.82 -4.49 115.64 117.27 1txx s THR 54 Ca -0.14 -0.74 -0.10 0.00 0.31 0.00 0.00 61.69 61.03 1txx s THR 54 Cb -0.08 -2.17 -0.05 0.00 0.01 0.00 0.00 72.50 70.22 1txx s THR 54 CO 0.01 0.51 0.13 -0.69 -0.69 0.00 0.00 174.62 173.88 1txx s VAL 55 N 0.89 5.15 0.03 3.82 1.01 -1.26 -0.71 120.40 129.33 1txx s VAL 55 Ca -0.04 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1txx s VAL 55 Cb -0.15 -3.38 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 1txx s VAL 55 CO -0.01 0.37 -0.05 0.00 0.00 0.00 0.00 175.10 175.41 1txx s ALA 56 N 0.95 0.35 0.18 5.51 0.00 -0.23 -1.46 121.76 127.06 1txx s ALA 56 Ca 0.06 -0.63 0.10 0.00 0.00 0.00 0.00 51.96 51.50 1txx s ALA 56 Cb -0.13 0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 1txx s ALA 56 CO 0.03 -0.07 -0.16 0.15 0.00 0.00 0.00 175.76 175.71 1txx s LYS 57 N -1.37 1.81 -0.15 0.00 1.02 0.23 -0.41 119.74 120.87 1txx s LYS 57 Ca -0.11 -1.38 -0.04 0.00 0.02 0.00 0.00 55.97 54.46 1txx s LYS 57 Cb -0.09 -2.02 0.05 0.00 -0.52 0.00 0.00 37.83 35.25 1txx s LYS 57 CO -0.00 0.42 0.07 -1.17 -0.92 0.00 0.00 175.35 173.75 1txx s LEU 58 N -2.73 0.50 -0.58 3.17 2.96 0.20 -1.80 118.68 120.41 1txx s LEU 58 Ca 0.23 -0.50 -0.24 0.00 -0.22 0.00 0.00 54.13 53.39 1txx s LEU 58 Cb -0.08 -0.31 0.05 0.00 0.50 0.00 0.00 46.19 46.34 1txx s LEU 58 CO 0.13 -0.31 0.95 0.21 -1.32 0.00 0.00 176.35 176.00 1txx s ASN 59 N 2.07 6.30 0.23 3.68 3.84 -1.26 -0.93 114.94 128.87 1txx s ASN 59 Ca 0.02 -0.48 0.20 0.00 0.21 0.00 0.00 52.86 52.81 1txx s ASN 59 Cb -0.15 -2.43 0.92 0.00 -0.55 0.00 0.00 41.25 39.03 1txx s ASN 59 CO -0.08 -1.28 1.61 2.30 -2.79 0.00 0.00 177.10 176.86 1txx n ILE 60 N 6.14 1.02 -0.05 -5.21 -5.35 -0.59 -0.82 119.36 114.50 1txx n ILE 60 Ca 0.01 0.42 -0.16 0.00 -0.27 0.00 0.00 62.75 62.75 1txx n ILE 60 Cb 0.47 -1.36 -0.06 0.00 -1.74 0.00 0.00 39.64 36.94 1txx n ILE 60 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1txx h ASP 61 N 0.00 0.85 -0.59 7.28 3.32 -1.90 -3.16 116.42 122.22 1txx h ASP 61 Ca 0.00 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.46 1txx h ASP 61 Cb 0.20 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1txx h ASP 61 CO 0.00 1.29 0.00 0.00 -1.72 0.00 0.00 179.24 178.81 1txx n GLN 62 N -4.08 2.64 -3.12 3.56 10.64 -0.31 -4.50 117.38 122.21 1txx n GLN 62 Ca -0.06 -2.50 -0.14 0.00 -1.83 0.00 0.00 57.00 52.47 1txx n GLN 62 Cb 0.64 -1.53 -0.05 0.00 -0.86 0.00 0.00 30.24 28.44 1txx n GLN 62 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1txx s ASN 63 N -1.17 0.03 0.00 2.61 0.01 -0.00 -4.87 114.94 111.55 1txx s ASN 63 Ca 0.44 -2.09 0.29 0.00 -0.71 0.00 0.00 52.86 50.79 1txx s ASN 63 Cb 0.24 0.85 1.27 0.00 0.41 0.00 0.00 41.25 44.02 1txx s ASN 63 CO 0.32 -0.14 1.87 -0.81 -1.51 0.00 0.00 177.10 176.83 1txx n PRO 64 N 3.27 1.25 -0.00 -0.60 -0.05 -1.19 -4.08 135.00 133.60 1txx n PRO 64 Ca 0.20 -0.55 0.07 0.00 -0.05 0.00 0.00 63.50 63.17 1txx n PRO 64 Cb 0.51 -1.49 -0.09 0.00 -0.05 0.00 0.00 33.50 32.38 1txx n PRO 64 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 1txx n GLY 65 N 1.16 -0.47 0.07 0.55 0.00 -1.26 -4.59 105.19 100.65 1txx n GLY 65 Ca 0.19 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 1txx n GLY 65 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1txx h THR 66 N 0.00 1.53 -0.92 2.61 2.02 -1.95 -3.38 112.91 112.82 1txx h THR 66 Ca 0.00 -1.80 0.08 0.00 0.77 0.00 0.00 66.41 65.46 1txx h THR 66 Cb 0.43 2.71 -0.11 0.00 -1.74 0.00 0.00 68.15 69.44 1txx h THR 66 CO 0.00 0.45 -0.54 0.00 0.37 0.00 0.00 175.52 175.80 1txx n ALA 67 N -2.52 -0.59 -0.32 6.16 0.00 -1.26 -1.35 120.51 120.63 1txx n ALA 67 Ca -0.09 0.78 0.18 0.00 0.00 0.00 0.00 53.44 54.31 1txx n ALA 67 Cb 0.37 -0.13 0.37 0.00 0.00 0.00 0.00 19.45 20.06 1txx n ALA 67 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1txx h PRO 68 N 0.00 0.30 -0.05 0.00 0.11 -1.84 0.88 132.00 131.39 1txx h PRO 68 Ca 0.15 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.26 1txx h PRO 68 Cb 0.38 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.42 1txx h PRO 68 CO -0.86 0.20 0.04 0.87 -0.21 0.00 0.00 178.00 178.04 1txx h LYS 69 N 0.30 0.00 -0.21 1.05 1.57 -1.38 -2.44 116.57 115.47 1txx h LYS 69 Ca 0.63 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.41 1txx h LYS 69 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.65 1txx h LYS 69 CO -0.61 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 178.93 1txx n TYR 70 N -4.36 0.25 -1.08 -1.35 4.01 0.30 -4.94 117.16 110.00 1txx n TYR 70 Ca -0.02 -0.12 -0.03 0.00 -0.16 0.00 0.00 57.90 57.57 1txx n TYR 70 Cb 0.14 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.16 1txx n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1txx n GLY 71 N 1.38 0.60 3.63 2.72 0.00 -0.92 -4.93 105.19 107.67 1txx n GLY 71 Ca 0.17 -0.75 -0.45 0.00 0.00 0.00 0.00 46.02 44.99 1txx n GLY 71 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1txx n ILE 72 N -2.89 0.54 -0.11 -0.61 2.08 -1.15 -4.83 119.36 112.40 1txx n ILE 72 Ca -0.03 -0.22 -0.13 0.00 0.56 0.00 0.00 62.75 62.93 1txx n ILE 72 Cb 0.11 -2.17 -0.14 0.00 -0.75 0.00 0.00 39.64 36.69 1txx n ILE 72 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 1txx n ARG 73 N 7.64 0.75 -3.83 0.38 3.00 -1.26 -4.76 116.66 118.58 1txx n ARG 73 Ca 0.26 0.05 -0.08 0.00 -0.00 0.00 0.00 57.85 58.07 1txx n ARG 73 Cb 0.36 -1.50 -0.03 0.00 0.00 0.00 0.00 32.46 31.29 1txx n ARG 73 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1txx s GLY 74 N -5.79 0.01 0.21 5.14 0.00 -1.26 -5.18 107.32 100.44 1txx s GLY 74 Ca -0.19 -0.36 0.11 0.00 0.00 0.00 0.00 44.72 44.28 1txx s GLY 74 CO 0.70 -0.23 -0.21 -0.26 0.00 0.00 0.00 173.10 173.10 1txx s ILE 75 N -3.92 2.21 0.57 0.90 -4.36 -1.26 -4.12 121.20 111.22 1txx s ILE 75 Ca 0.12 -2.10 -0.16 0.00 -0.26 0.00 0.00 60.65 58.25 1txx s ILE 75 Cb -0.03 -2.09 -0.05 0.00 1.25 0.00 0.00 42.46 41.54 1txx s ILE 75 CO 0.04 -0.26 1.03 -2.16 0.24 0.00 0.00 174.94 173.83 1txx s PRO 76 N -2.96 3.54 -0.03 0.37 0.04 -1.26 -4.80 135.00 129.89 1txx s PRO 76 Ca 0.22 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.38 1txx s PRO 76 Cb -0.06 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1txx s PRO 76 CO 0.10 -0.62 -0.10 0.99 0.04 0.00 0.00 177.00 177.41 1txx s THR 77 N -2.55 0.85 -0.16 1.26 2.01 -1.16 -0.54 115.64 115.35 1txx s THR 77 Ca 0.62 -0.39 -0.02 0.00 0.31 0.00 0.00 61.69 62.21 1txx s THR 77 Cb -0.14 -0.75 -0.01 0.00 0.01 0.00 0.00 72.50 71.61 1txx s THR 77 CO 0.36 0.26 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.70 1txx s LEU 78 N 0.20 2.83 -0.16 4.42 1.43 -0.20 -2.08 118.68 125.12 1txx s LEU 78 Ca -0.04 -0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 52.72 1txx s LEU 78 Cb -0.09 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 1txx s LEU 78 CO 0.01 0.11 -0.06 -0.76 0.23 0.00 0.00 176.35 175.88 1txx s LEU 79 N 0.66 3.07 -0.38 1.79 1.02 -0.09 -1.09 118.68 123.67 1txx s LEU 79 Ca -0.05 -0.21 -0.12 0.00 0.02 0.00 0.00 54.13 53.76 1txx s LEU 79 Cb -0.15 -1.74 0.02 0.00 0.02 0.00 0.00 46.19 44.34 1txx s LEU 79 CO 0.02 0.14 0.23 -0.22 0.02 0.00 0.00 176.35 176.54 1txx s LEU 80 N 0.53 4.76 0.11 1.79 2.96 0.13 -0.81 118.68 128.15 1txx s LEU 80 Ca -0.04 -0.89 -0.00 0.00 -0.22 0.00 0.00 54.13 52.98 1txx s LEU 80 Cb -0.15 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 1txx s LEU 80 CO 0.03 -0.38 0.27 -0.36 -1.32 0.00 0.00 176.35 174.60 1txx s PHE 81 N 1.61 3.50 -0.17 5.38 0.40 0.53 0.79 117.98 130.01 1txx s PHE 81 Ca 0.03 0.29 -0.06 0.00 -0.60 0.00 0.00 56.93 56.59 1txx s PHE 81 Cb -0.19 -1.79 0.08 0.00 0.51 0.00 0.00 43.02 41.63 1txx s PHE 81 CO 0.08 0.53 0.35 0.15 0.70 0.00 0.00 175.22 177.03 1txx s LYS 82 N -2.77 0.25 -1.54 0.44 1.02 0.12 -1.06 119.74 116.21 1txx s LYS 82 Ca 0.36 0.89 -0.13 0.00 0.02 0.00 0.00 55.97 57.12 1txx s LYS 82 Cb -0.12 0.14 0.09 0.00 -0.52 0.00 0.00 37.83 37.42 1txx s LYS 82 CO 0.28 -0.28 0.93 -1.71 -0.92 0.00 0.00 175.35 173.65 1txx n ASN 83 N 5.37 -4.32 -0.37 2.83 4.05 -1.26 -1.52 115.26 120.04 1txx n ASN 83 Ca -0.07 -0.81 -0.05 0.00 0.45 0.00 0.00 54.58 54.10 1txx n ASN 83 Cb 0.50 -3.75 -0.02 0.00 1.23 0.00 0.00 39.78 37.73 1txx n ASN 83 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1txx n GLY 84 N -1.66 0.73 3.09 8.20 0.00 -1.22 -5.01 105.19 109.33 1txx n GLY 84 Ca 0.02 -0.50 -0.19 0.00 0.00 0.00 0.00 46.02 45.35 1txx n GLY 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1txx s GLU 85 N -1.98 0.82 0.01 1.61 0.41 -0.58 -4.96 118.70 114.02 1txx s GLU 85 Ca 0.00 -0.62 -0.30 0.00 -0.41 0.00 0.00 54.97 53.64 1txx s GLU 85 Cb 0.00 -0.78 -0.04 0.00 -1.78 0.00 0.00 34.13 31.53 1txx s GLU 85 CO 0.00 0.20 1.13 0.08 -0.49 0.00 0.00 175.26 176.18 1txx s VAL 86 N -0.72 4.33 -0.20 2.63 1.01 -1.26 -0.70 120.40 125.49 1txx s VAL 86 Ca 0.01 1.67 0.16 0.00 0.00 0.00 0.00 61.98 63.81 1txx s VAL 86 Cb -0.07 -4.07 -0.24 0.00 0.00 0.00 0.00 36.38 32.00 1txx s VAL 86 CO 0.01 0.09 0.07 0.00 0.00 0.00 0.00 175.10 175.27 1txx n ALA 87 N 4.28 1.49 -3.37 5.51 0.00 0.24 -4.90 120.51 123.75 1txx n ALA 87 Ca 0.09 -1.28 -0.13 0.00 0.00 0.00 0.00 53.44 52.11 1txx n ALA 87 Cb 0.48 -0.21 -0.03 0.00 0.00 0.00 0.00 19.45 19.68 1txx n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1txx s ALA 88 N -2.50 -1.51 0.04 0.00 0.00 -1.16 -5.00 121.76 111.63 1txx s ALA 88 Ca -0.12 0.57 -0.04 0.00 0.00 0.00 0.00 51.96 52.37 1txx s ALA 88 Cb 0.06 0.66 -0.02 0.00 0.00 0.00 0.00 23.12 23.82 1txx s ALA 88 CO 0.81 -0.66 0.05 0.95 0.00 0.00 0.00 175.76 176.91 1txx s THR 89 N -3.17 0.15 -0.05 0.00 -4.23 -1.26 -0.69 115.64 106.38 1txx s THR 89 Ca -0.02 -1.22 -0.02 0.00 -1.18 0.00 0.00 61.69 59.26 1txx s THR 89 Cb -0.00 -0.93 0.04 0.00 1.34 0.00 0.00 72.50 72.94 1txx s THR 89 CO -0.08 -0.67 0.09 -0.75 -0.54 0.00 0.00 174.62 172.67 1txx s LYS 90 N -2.72 -0.01 -0.17 3.99 2.36 -0.25 -4.98 119.74 117.96 1txx s LYS 90 Ca -0.04 0.36 -0.15 0.00 -2.55 0.00 0.00 55.97 53.59 1txx s LYS 90 Cb -0.01 -0.31 -0.04 0.00 -1.05 0.00 0.00 37.83 36.42 1txx s LYS 90 CO -0.05 -0.24 0.35 0.08 1.55 0.00 0.00 175.35 177.04 1txx s VAL 91 N 1.64 5.26 0.00 4.02 1.01 -1.26 -1.03 120.40 130.03 1txx s VAL 91 Ca -0.03 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.60 1txx s VAL 91 Cb -0.12 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1txx s VAL 91 CO -0.04 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1txx n GLY 92 N 3.58 -0.72 3.74 4.51 0.00 0.30 -5.00 105.19 111.61 1txx n GLY 92 Ca -0.10 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 43.90 1txx n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1txx s ALA 93 N -2.42 2.42 0.24 4.61 0.00 -1.26 -4.87 121.76 120.48 1txx s ALA 93 Ca 0.00 1.01 -0.15 0.00 0.00 0.00 0.00 51.96 52.83 1txx s ALA 93 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1txx s ALA 93 CO 0.00 -1.41 0.51 -0.48 0.00 0.00 0.00 175.76 174.38 1txx s LEU 94 N -4.39 0.23 0.79 0.00 2.34 -1.26 -5.14 118.68 111.25 1txx s LEU 94 Ca 0.78 -0.81 -0.08 0.00 0.06 0.00 0.00 54.13 54.08 1txx s LEU 94 Cb -0.31 1.94 0.13 0.00 -0.56 0.00 0.00 46.19 47.38 1txx s LEU 94 CO 0.37 -1.15 1.11 -0.94 -1.06 0.00 0.00 176.35 174.68 1txx s SER 95 N -2.98 4.11 0.18 1.48 1.04 -1.26 -4.86 113.70 111.41 1txx s SER 95 Ca 0.19 0.12 -0.10 0.00 0.48 0.00 0.00 55.95 56.64 1txx s SER 95 Cb -0.01 -0.49 0.06 0.00 0.10 0.00 0.00 66.02 65.68 1txx s SER 95 CO 0.07 -2.05 1.64 0.50 0.98 0.00 0.00 173.24 174.37 1txx h LYS 96 N -0.91 1.06 -0.44 4.02 3.64 -1.99 0.23 116.57 122.17 1txx h LYS 96 Ca -0.42 -0.33 0.05 0.00 -1.27 0.00 0.00 60.65 58.68 1txx h LYS 96 Cb 1.27 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1txx h LYS 96 CO 0.46 1.03 0.29 0.78 -2.27 0.00 0.00 179.45 179.75 1txx h GLY 97 N 0.96 0.46 0.77 5.01 0.00 -2.00 -0.80 103.07 107.47 1txx h GLY 97 Ca 0.17 -0.15 -0.13 0.00 0.00 0.00 0.00 47.33 47.22 1txx h GLY 97 CO 0.03 0.12 -0.45 1.46 0.00 0.00 0.00 176.54 177.70 1txx h GLN 98 N 0.39 0.41 -0.50 4.80 4.20 -1.67 -2.75 115.11 119.99 1txx h GLN 98 Ca 0.19 -0.36 0.04 0.00 0.06 0.00 0.00 58.65 58.57 1txx h GLN 98 Cb 0.25 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 1txx h GLN 98 CO -0.04 1.01 0.26 1.25 -0.67 0.00 0.00 178.83 180.64 1txx h LEU 99 N -0.07 0.37 -0.13 1.46 5.85 -0.50 -1.38 115.31 120.91 1txx h LEU 99 Ca -0.04 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1txx h LEU 99 Cb 1.13 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.07 1txx h LEU 99 CO 0.09 0.26 -0.15 0.50 -0.34 0.00 0.00 178.44 178.81 1txx h LYS 100 N 0.50 -0.17 -0.56 1.25 3.64 -1.18 -1.34 116.57 118.71 1txx h LYS 100 Ca 0.22 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.67 1txx h LYS 100 Cb 0.12 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.93 1txx h LYS 100 CO -0.15 -0.11 0.27 0.93 -2.27 0.00 0.00 179.45 178.12 1txx h GLU 101 N -0.18 0.50 -0.31 1.90 5.08 -1.25 0.24 114.58 120.56 1txx h GLU 101 Ca 0.09 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1txx h GLU 101 Cb 0.32 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1txx h GLU 101 CO -0.24 0.33 0.17 0.35 -1.00 0.00 0.00 179.01 178.62 1txx h PHE 102 N 0.51 0.32 0.06 4.33 3.57 -0.90 -1.15 116.94 123.68 1txx h PHE 102 Ca 0.26 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 1txx h PHE 102 Cb 0.20 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1txx h PHE 102 CO -0.11 0.18 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.05 1txx h LEU 103 N 0.35 -0.06 -2.02 0.59 3.38 -0.98 -2.91 115.31 113.65 1txx h LEU 103 Ca 0.13 -0.25 0.14 0.00 0.09 0.00 0.00 57.88 57.98 1txx h LEU 103 Cb 0.02 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1txx h LEU 103 CO -0.07 0.22 0.37 0.44 0.09 0.00 0.00 178.44 179.49 1txx h ASP 104 N -0.35 0.00 1.37 -0.43 5.19 -0.87 2.44 116.42 123.77 1txx h ASP 104 Ca -0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1txx h ASP 104 Cb 0.31 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.82 1txx h ASP 104 CO 0.01 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.13 1txx h ALA 105 N 1.72 1.00 0.00 3.45 0.00 -1.01 -3.31 119.26 121.11 1txx h ALA 105 Ca 0.23 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.95 1txx h ALA 105 Cb 0.96 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1txx h ALA 105 CO -0.00 0.00 -1.70 0.09 0.00 0.00 0.00 179.25 177.63 1txx n ASN 106 N -2.36 2.61 -4.69 0.00 3.02 0.39 -4.99 115.26 109.24 1txx n ASN 106 Ca 0.05 -0.02 -0.42 0.00 -0.03 0.00 0.00 54.58 54.16 1txx n ASN 106 Cb 0.40 0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 40.08 1txx n ASN 106 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1txx s LEU 107 N -4.96 4.39 0.00 3.41 1.43 0.73 -5.09 118.68 118.58 1txx s LEU 107 Ca -0.08 2.69 0.00 0.00 -1.03 0.00 0.00 54.13 55.71 1txx s LEU 107 Cb 0.03 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1txx s LEU 107 CO 0.39 -0.98 0.40 0.00 0.23 0.00 0.00 176.35 176.39