#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xob s ASP 2 N 0.00 6.39 0.28 6.43 -1.08 -1.26 -4.92 116.67 122.52 1xob s ASP 2 Ca 0.00 2.70 0.05 0.00 -0.52 0.00 0.00 52.55 54.78 1xob s ASP 2 Cb 0.00 -2.64 0.41 0.00 -1.46 0.00 0.00 42.92 39.23 1xob s ASP 2 CO 0.00 -0.80 1.68 0.11 0.52 0.00 0.00 175.17 176.68 1xob h LYS 3 N 2.83 0.30 -6.72 4.34 1.79 -1.96 -3.43 116.57 113.73 1xob h LYS 3 Ca -0.50 -0.14 -0.49 0.00 -2.18 0.00 0.00 60.65 57.34 1xob h LYS 3 Cb 1.24 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.87 1xob h LYS 3 CO 0.63 0.66 0.35 0.42 -1.08 0.00 0.00 179.45 180.43 1xob s ILE 4 N -4.17 4.13 -0.33 1.86 1.01 -1.26 -4.63 121.20 117.82 1xob s ILE 4 Ca -0.05 2.08 -0.21 0.00 0.00 0.00 0.00 60.65 62.47 1xob s ILE 4 Cb 0.13 -4.33 -0.00 0.00 0.01 0.00 0.00 42.46 38.27 1xob s ILE 4 CO 0.78 0.48 0.66 -0.63 0.00 0.00 0.00 174.94 176.23 1xob s ILE 5 N -1.02 4.89 -0.58 2.92 -1.09 -0.12 -4.89 121.20 121.31 1xob s ILE 5 Ca 0.42 0.81 -0.27 0.00 -2.23 0.00 0.00 60.65 59.38 1xob s ILE 5 Cb -0.26 -4.06 0.03 0.00 -1.58 0.00 0.00 42.46 36.60 1xob s ILE 5 CO 0.32 -0.24 1.11 -1.00 -1.23 0.00 0.00 174.94 173.90 1xob s HIS 6 N 2.72 2.65 0.33 3.97 3.76 -1.26 -0.54 115.29 126.92 1xob s HIS 6 Ca 0.26 0.22 -0.06 0.00 -0.15 0.00 0.00 55.06 55.34 1xob s HIS 6 Cb -0.15 -4.37 -0.05 0.00 1.11 0.00 0.00 32.58 29.12 1xob s HIS 6 CO 0.13 -1.54 0.61 -0.51 -0.85 0.00 0.00 174.74 172.58 1xob s LEU 7 N 4.66 3.99 0.19 0.89 1.43 0.31 -4.96 118.68 125.18 1xob s LEU 7 Ca 0.38 0.81 0.08 0.00 -1.03 0.00 0.00 54.13 54.36 1xob s LEU 7 Cb -0.09 -3.65 -0.05 0.00 0.03 0.00 0.00 46.19 42.44 1xob s LEU 7 CO 0.22 -0.26 -0.16 0.42 0.23 0.00 0.00 176.35 176.81 1xob s THR 8 N -2.19 1.77 0.21 5.49 -4.23 -1.26 -4.30 115.64 111.12 1xob s THR 8 Ca 0.46 -2.12 -0.10 0.00 -1.18 0.00 0.00 61.69 58.75 1xob s THR 8 Cb -0.11 -1.97 0.14 0.00 1.34 0.00 0.00 72.50 71.90 1xob s THR 8 CO 0.31 -0.51 1.77 -0.78 -0.54 0.00 0.00 174.62 174.87 1xob h ASP 9 N 2.77 0.35 -0.60 3.99 3.58 -1.94 0.11 116.42 124.67 1xob h ASP 9 Ca -0.39 0.06 0.04 0.00 0.42 0.00 0.00 57.03 57.16 1xob h ASP 9 Cb 1.22 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.23 1xob h ASP 9 CO 0.58 0.22 0.34 -0.78 -2.88 0.00 0.00 179.24 176.72 1xob h ASP 10 N 0.50 0.53 0.76 2.28 3.58 -2.01 -2.91 116.42 119.16 1xob h ASP 10 Ca 0.30 0.02 -0.21 0.00 0.42 0.00 0.00 57.03 57.55 1xob h ASP 10 Cb 0.30 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 1xob h ASP 10 CO -0.25 0.36 -0.99 0.77 -2.88 0.00 0.00 179.24 176.25 1xob h SER 11 N 0.66 0.17 -0.84 2.28 4.64 -1.75 -3.37 113.55 115.34 1xob h SER 11 Ca 0.26 -0.17 0.20 0.00 -0.47 0.00 0.00 61.79 61.61 1xob h SER 11 Cb 0.10 -0.06 -0.16 0.00 -0.31 0.00 0.00 62.40 61.98 1xob h SER 11 CO -0.14 1.05 -0.11 0.33 -0.87 0.00 0.00 176.83 177.10 1xob n PHE 12 N -3.52 0.41 -0.33 4.77 -0.00 0.29 -0.42 117.46 118.66 1xob n PHE 12 Ca -0.03 1.02 0.07 0.00 -0.00 0.00 0.00 57.45 58.51 1xob n PHE 12 Cb 0.89 -1.05 0.26 0.00 -0.00 0.00 0.00 39.48 39.59 1xob n PHE 12 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.76 177.14 1xob h ASP 13 N 0.00 0.88 0.00 -2.13 2.03 -1.73 0.20 116.42 115.67 1xob h ASP 13 Ca 0.45 0.03 -0.23 0.00 -0.73 0.00 0.00 57.03 56.55 1xob h ASP 13 Cb 0.81 -0.14 -0.03 0.00 -0.83 0.00 0.00 39.33 39.13 1xob h ASP 13 CO -0.83 0.49 -1.31 0.41 -1.03 0.00 0.00 179.24 176.97 1xob n THR 14 N -4.57 1.53 0.18 1.15 -1.04 0.44 -2.34 114.28 109.63 1xob n THR 14 Ca 0.17 -0.04 0.02 0.00 -2.04 0.00 0.00 64.05 62.17 1xob n THR 14 Cb 0.33 -2.05 0.33 0.00 -1.82 0.00 0.00 70.33 67.12 1xob n THR 14 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1xob h ASP 15 N -1.00 0.00 0.00 8.00 5.19 -0.75 -3.21 116.42 124.66 1xob h ASP 15 Ca -0.35 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.06 1xob h ASP 15 Cb 1.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.79 1xob h ASP 15 CO -0.21 0.42 -0.26 0.52 -3.12 0.00 0.00 179.24 176.58 1xob n VAL 16 N -3.96 1.22 0.19 -1.35 0.31 0.61 -4.43 118.33 110.93 1xob n VAL 16 Ca -0.02 0.32 0.06 0.00 -0.01 0.00 0.00 64.34 64.69 1xob n VAL 16 Cb 0.46 -1.76 0.54 0.00 -0.91 0.00 0.00 33.84 32.16 1xob n VAL 16 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1xob h LEU 17 N -0.26 0.11 -3.03 7.52 3.38 -1.27 0.12 115.31 121.88 1xob h LEU 17 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xob h LEU 17 Cb 0.26 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1xob h LEU 17 CO 0.00 0.15 0.00 0.29 0.09 0.00 0.00 178.44 178.97 1xob n LYS 18 N -4.44 3.87 -2.44 1.13 5.02 -0.99 -4.05 118.16 116.27 1xob n LYS 18 Ca -0.02 -2.70 -0.39 0.00 -2.02 0.00 0.00 58.31 53.18 1xob n LYS 18 Cb 0.15 -1.97 -0.03 0.00 -0.02 0.00 0.00 35.03 33.16 1xob n LYS 18 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xob s ALA 19 N -2.09 2.53 -1.17 7.82 0.00 0.03 -4.89 121.76 124.00 1xob s ALA 19 Ca 0.48 -1.69 -0.17 0.00 0.00 0.00 0.00 51.96 50.58 1xob s ALA 19 Cb 0.33 -4.42 -0.05 0.00 0.00 0.00 0.00 23.12 18.98 1xob s ALA 19 CO 0.20 -3.69 2.14 -3.47 0.00 0.00 0.00 175.76 170.94 1xob n ASP 20 N 10.11 3.64 0.00 0.00 2.03 -1.26 -2.78 116.55 128.29 1xob n ASP 20 Ca 0.22 -2.74 0.00 0.00 0.52 0.00 0.00 54.79 52.80 1xob n ASP 20 Cb 0.50 -1.41 0.00 0.00 -0.72 0.00 0.00 41.12 39.49 1xob n ASP 20 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xob n GLY 21 N 4.23 -1.26 3.45 0.27 0.00 -1.26 -4.92 105.19 105.69 1xob n GLY 21 Ca 0.52 -0.87 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 1xob n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xob s ALA 22 N -1.06 3.22 -0.19 4.61 0.00 -1.26 -0.87 121.76 126.21 1xob s ALA 22 Ca 0.00 -1.24 0.01 0.00 0.00 0.00 0.00 51.96 50.73 1xob s ALA 22 Cb 0.00 -2.21 0.03 0.00 0.00 0.00 0.00 23.12 20.94 1xob s ALA 22 CO 0.00 -0.66 -0.14 0.42 0.00 0.00 0.00 175.76 175.37 1xob s ILE 23 N 1.62 1.84 -0.78 0.00 1.01 0.52 -0.80 121.20 124.61 1xob s ILE 23 Ca 0.06 -1.00 -0.24 0.00 0.00 0.00 0.00 60.65 59.46 1xob s ILE 23 Cb -0.16 -1.80 0.06 0.00 0.01 0.00 0.00 42.46 40.57 1xob s ILE 23 CO 0.05 0.32 1.17 -0.22 0.00 0.00 0.00 174.94 176.26 1xob s LEU 24 N 1.34 3.90 -0.34 2.97 2.96 0.27 -0.35 118.68 129.43 1xob s LEU 24 Ca 0.01 -1.02 -0.24 0.00 -0.22 0.00 0.00 54.13 52.66 1xob s LEU 24 Cb -0.15 -2.49 0.01 0.00 0.50 0.00 0.00 46.19 44.06 1xob s LEU 24 CO -0.10 -1.54 0.81 -0.69 -1.32 0.00 0.00 176.35 173.51 1xob s VAL 25 N 4.61 4.73 -0.48 1.68 1.01 0.62 -0.56 120.40 132.02 1xob s VAL 25 Ca 0.32 1.07 -0.16 0.00 0.00 0.00 0.00 61.98 63.22 1xob s VAL 25 Cb -0.09 -4.21 0.08 0.00 0.00 0.00 0.00 36.38 32.16 1xob s VAL 25 CO 0.06 -0.37 0.41 -0.62 0.00 0.00 0.00 175.10 174.58 1xob s ASP 26 N 1.75 6.15 -0.21 3.32 3.68 0.55 -0.41 116.67 131.51 1xob s ASP 26 Ca 0.33 -1.39 -0.29 0.00 2.13 0.00 0.00 52.55 53.33 1xob s ASP 26 Cb -0.13 -2.19 0.00 0.00 -1.45 0.00 0.00 42.92 39.15 1xob s ASP 26 CO 0.15 -0.68 1.06 -0.36 0.13 0.00 0.00 175.17 175.47 1xob s PHE 27 N 1.63 3.32 0.12 -5.34 0.40 0.23 -0.67 117.98 117.68 1xob s PHE 27 Ca 0.04 1.45 -0.02 0.00 -0.60 0.00 0.00 56.93 57.79 1xob s PHE 27 Cb -0.25 -3.28 -0.03 0.00 0.51 0.00 0.00 43.02 39.96 1xob s PHE 27 CO 0.06 -0.55 0.08 1.67 0.70 0.00 0.00 175.22 177.18 1xob s TRP 28 N 3.05 0.74 -0.01 0.36 1.48 -0.12 -1.32 118.94 123.13 1xob s TRP 28 Ca 0.46 -1.14 0.04 0.00 -1.06 0.00 0.00 56.10 54.41 1xob s TRP 28 Cb -0.16 -0.40 -0.01 0.00 -1.16 0.00 0.00 33.47 31.74 1xob s TRP 28 CO 0.08 -0.53 -0.15 0.00 -4.06 0.00 0.00 176.95 172.30 1xob s ALA 29 N -4.02 1.22 0.16 2.67 0.00 -1.26 -0.10 121.76 120.43 1xob s ALA 29 Ca 0.20 -0.63 -0.16 0.00 0.00 0.00 0.00 51.96 51.38 1xob s ALA 29 Cb 0.07 -0.31 0.10 0.00 0.00 0.00 0.00 23.12 22.98 1xob s ALA 29 CO -0.00 0.29 1.71 0.93 0.00 0.00 0.00 175.76 178.69 1xob h GLU 30 N 5.80 0.13 0.00 0.00 5.08 -1.99 -1.33 114.58 122.27 1xob h GLU 30 Ca -0.35 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 57.99 1xob h GLU 30 Cb 1.16 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 1xob h GLU 30 CO 0.49 0.09 -0.08 0.11 -1.00 0.00 0.00 179.01 178.61 1xob h TRP 31 N 0.13 0.00 -0.59 4.33 5.08 -2.05 -3.39 115.95 119.47 1xob h TRP 31 Ca 0.19 0.00 -0.69 0.00 1.08 0.00 0.00 58.89 59.47 1xob h TRP 31 Cb 0.26 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 26.35 1xob h TRP 31 CO -0.24 0.08 2.48 0.00 -1.28 0.00 0.00 178.44 179.48 1xob n GLY 33 N 5.01 -0.39 0.46 0.00 0.00 -1.26 -0.24 105.19 108.77 1xob n GLY 33 Ca 0.50 0.17 0.34 0.00 0.00 0.00 0.00 46.02 47.02 1xob n GLY 33 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xob h PRO 34 N 0.00 0.15 -0.17 1.61 0.11 -1.94 0.25 132.00 132.02 1xob h PRO 34 Ca 0.02 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.13 1xob h PRO 34 Cb 0.05 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1xob h PRO 34 CO -0.13 0.10 0.07 0.00 -0.21 0.00 0.00 178.00 177.84 1xob h LYS 36 N 0.17 0.77 -0.45 0.00 1.57 -0.69 -0.24 116.57 117.70 1xob h LYS 36 Ca 0.07 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1xob h LYS 36 Cb 0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1xob h LYS 36 CO -0.05 0.80 0.27 1.98 -0.57 0.00 0.00 179.45 181.88 1xob h MET 37 N 0.71 0.61 0.00 3.15 4.05 -0.41 -2.82 114.93 120.22 1xob h MET 37 Ca 0.14 -0.05 -0.10 0.00 -0.28 0.00 0.00 59.70 59.40 1xob h MET 37 Cb 0.48 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.14 1xob h MET 37 CO 0.02 0.44 -0.47 -0.84 0.23 0.00 0.00 176.91 176.30 1xob h ILE 38 N 0.60 0.91 -0.86 1.77 3.07 -0.58 -3.38 117.51 119.04 1xob h ILE 38 Ca 0.16 -1.95 0.09 0.00 1.55 0.00 0.00 64.86 64.71 1xob h ILE 38 Cb -0.01 2.21 -0.11 0.00 -0.27 0.00 0.00 36.82 38.64 1xob h ILE 38 CO -0.03 0.46 -0.47 0.00 -1.05 0.00 0.00 178.15 177.06 1xob n ALA 39 N -2.26 -0.45 -0.36 0.16 0.00 -0.13 -0.27 120.51 117.21 1xob n ALA 39 Ca 0.01 0.76 0.03 0.00 0.00 0.00 0.00 53.44 54.24 1xob n ALA 39 Cb 0.64 -0.18 0.18 0.00 0.00 0.00 0.00 19.45 20.09 1xob n ALA 39 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1xob h PRO 40 N 0.00 1.08 0.07 0.00 0.13 -1.73 0.14 132.00 131.68 1xob h PRO 40 Ca 0.18 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1xob h PRO 40 Cb 0.39 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.27 1xob h PRO 40 CO -0.82 0.71 -0.06 0.82 -0.23 0.00 0.00 178.00 178.42 1xob h ILE 41 N 1.11 0.86 -0.72 -3.56 2.04 -0.86 0.33 117.51 116.71 1xob h ILE 41 Ca 0.44 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.36 1xob h ILE 41 Cb 0.23 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 37.11 1xob h ILE 41 CO -0.19 0.00 0.41 -0.07 0.00 0.00 0.00 178.15 178.30 1xob h LEU 42 N -0.14 0.61 -0.12 1.44 3.38 -0.04 0.87 115.31 121.32 1xob h LEU 42 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xob h LEU 42 Cb 0.14 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1xob h LEU 42 CO -0.02 0.39 0.08 0.44 0.09 0.00 0.00 178.44 179.42 1xob h ASP 43 N 0.75 0.14 0.04 -0.43 3.32 -0.22 0.15 116.42 120.17 1xob h ASP 43 Ca 0.32 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1xob h ASP 43 Cb 0.21 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1xob h ASP 43 CO -0.19 0.11 -0.05 -0.33 -1.72 0.00 0.00 179.24 177.06 1xob h GLU 44 N 0.15 -0.11 -0.37 3.56 4.39 -0.37 -0.96 114.58 120.87 1xob h GLU 44 Ca 0.04 0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.82 1xob h GLU 44 Cb -0.01 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.61 1xob h GLU 44 CO -0.01 -0.07 0.01 0.82 -1.16 0.00 0.00 179.01 178.60 1xob h ILE 45 N -0.11 0.74 -0.42 3.13 1.08 -0.67 0.12 117.51 121.37 1xob h ILE 45 Ca 0.01 -0.04 0.08 0.00 -0.39 0.00 0.00 64.86 64.52 1xob h ILE 45 Cb 0.11 0.61 -0.07 0.00 -3.07 0.00 0.00 36.82 34.39 1xob h ILE 45 CO -0.02 0.02 -0.05 0.00 -0.69 0.00 0.00 178.15 177.41 1xob h ALA 46 N 1.32 0.34 0.76 1.87 0.00 -0.28 0.83 119.26 124.11 1xob h ALA 46 Ca 0.18 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 1xob h ALA 46 Cb 0.25 0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.31 1xob h ALA 46 CO -0.29 -0.42 -0.36 0.22 0.00 0.00 0.00 179.25 178.39 1xob h ASP 47 N 0.06 -0.86 -0.69 0.00 3.58 -0.38 -2.60 116.42 115.52 1xob h ASP 47 Ca 0.21 0.02 0.14 0.00 0.42 0.00 0.00 57.03 57.82 1xob h ASP 47 Cb 0.31 0.22 -0.10 0.00 1.72 0.00 0.00 39.33 41.48 1xob h ASP 47 CO -0.39 -0.59 0.17 -0.33 -2.88 0.00 0.00 179.24 175.23 1xob h GLU 48 N -1.07 0.28 -0.77 0.28 5.08 -0.41 -1.59 114.58 116.37 1xob h GLU 48 Ca -0.10 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 1xob h GLU 48 Cb 0.79 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.92 1xob h GLU 48 CO 0.17 0.18 0.13 0.66 -1.00 0.00 0.00 179.01 179.15 1xob n TYR 49 N -5.13 1.74 -1.63 4.33 4.02 0.25 -4.98 117.16 115.75 1xob n TYR 49 Ca 0.12 -0.79 -0.51 0.00 -0.01 0.00 0.00 57.90 56.72 1xob n TYR 49 Cb 0.41 -0.50 -0.06 0.00 -0.02 0.00 0.00 39.34 39.17 1xob n TYR 49 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1xob n GLN 50 N 0.16 1.48 0.00 -0.72 6.02 -0.60 -0.38 117.38 123.34 1xob n GLN 50 Ca 0.27 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.79 1xob n GLN 50 Cb 1.06 -2.23 0.00 0.00 1.02 0.00 0.00 30.24 30.09 1xob n GLN 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xob n GLY 51 N 3.14 3.08 0.13 1.08 0.00 -1.26 -4.74 105.19 106.61 1xob n GLY 51 Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 1xob n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xob n LYS 52 N -1.87 0.65 -3.81 1.61 5.02 0.49 -4.99 118.16 115.28 1xob n LYS 52 Ca 0.00 0.16 -0.13 0.00 -2.02 0.00 0.00 58.31 56.32 1xob n LYS 52 Cb 0.00 -1.53 -0.13 0.00 -0.02 0.00 0.00 35.03 33.35 1xob n LYS 52 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1xob s LEU 53 N -6.59 1.31 -0.02 -0.35 2.96 0.17 -4.74 118.68 111.43 1xob s LEU 53 Ca -0.35 0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 53.74 1xob s LEU 53 Cb 0.09 0.37 -0.05 0.00 0.50 0.00 0.00 46.19 47.11 1xob s LEU 53 CO 0.60 -0.07 0.24 -0.89 -1.32 0.00 0.00 176.35 174.91 1xob s THR 54 N 0.40 5.34 -0.04 3.68 2.01 0.02 -4.40 115.64 122.66 1xob s THR 54 Ca -0.03 0.15 0.06 0.00 0.31 0.00 0.00 61.69 62.18 1xob s THR 54 Cb -0.04 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 68.91 1xob s THR 54 CO -0.02 0.41 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.40 1xob s VAL 55 N -1.25 2.32 0.05 3.82 1.01 -1.26 -0.56 120.40 124.52 1xob s VAL 55 Ca 0.25 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1xob s VAL 55 Cb -0.13 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 1xob s VAL 55 CO 0.14 0.58 -0.06 0.00 0.00 0.00 0.00 175.10 175.76 1xob s ALA 56 N -0.50 0.53 -0.06 5.51 0.00 0.28 -0.95 121.76 126.57 1xob s ALA 56 Ca 0.06 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.18 1xob s ALA 56 Cb -0.11 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1xob s ALA 56 CO 0.01 -0.13 -0.17 0.15 0.00 0.00 0.00 175.76 175.62 1xob s LYS 57 N -2.22 2.00 -0.28 0.00 1.02 0.30 -0.33 119.74 120.24 1xob s LYS 57 Ca -0.06 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.37 1xob s LYS 57 Cb -0.05 -1.64 0.07 0.00 -0.52 0.00 0.00 37.83 35.69 1xob s LYS 57 CO -0.02 0.15 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.36 1xob s LEU 58 N 0.33 3.36 -0.65 3.17 0.20 0.16 -0.53 118.68 124.71 1xob s LEU 58 Ca -0.11 -1.53 -0.27 0.00 0.69 0.00 0.00 54.13 52.91 1xob s LEU 58 Cb -0.14 -1.38 0.02 0.00 -0.43 0.00 0.00 46.19 44.26 1xob s LEU 58 CO 0.04 -0.27 1.35 0.21 -0.29 0.00 0.00 176.35 177.39 1xob s ASN 59 N 1.20 6.12 0.50 3.68 3.04 -1.26 -0.94 114.94 127.29 1xob s ASN 59 Ca -0.01 -0.09 0.21 0.00 0.04 0.00 0.00 52.86 53.01 1xob s ASN 59 Cb -0.19 -2.55 1.29 0.00 -1.54 0.00 0.00 41.25 38.26 1xob s ASN 59 CO -0.08 -1.79 2.01 0.16 -3.04 0.00 0.00 177.10 174.36 1xob h ILE 60 N 6.22 0.80 -0.55 -5.21 -0.00 -0.71 0.11 117.51 118.17 1xob h ILE 60 Ca -0.27 -0.04 0.05 0.00 -0.00 0.00 0.00 64.86 64.60 1xob h ILE 60 Cb 1.07 0.68 -0.05 0.00 -0.00 0.00 0.00 36.82 38.53 1xob h ILE 60 CO 1.23 0.02 0.28 0.44 -0.00 0.00 0.00 178.15 180.12 1xob h ASP 61 N 0.11 0.40 0.51 2.16 3.32 -1.90 0.09 116.42 121.11 1xob h ASP 61 Ca 0.24 0.03 -0.30 0.00 0.02 0.00 0.00 57.03 57.02 1xob h ASP 61 Cb 0.80 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1xob h ASP 61 CO -0.02 0.27 -1.40 1.56 -1.72 0.00 0.00 179.24 177.93 1xob h GLN 62 N 0.54 0.29 -2.16 3.56 4.20 -1.62 -3.40 115.11 116.53 1xob h GLN 62 Ca 0.24 -0.50 -0.59 0.00 0.06 0.00 0.00 58.65 57.86 1xob h GLN 62 Cb 0.15 0.19 -0.41 0.00 0.30 0.00 0.00 27.48 27.70 1xob h GLN 62 CO -0.17 1.20 -0.68 0.09 -0.67 0.00 0.00 178.83 178.60 1xob n ASN 63 N -3.52 3.16 -0.20 1.46 3.02 0.26 -4.93 115.26 114.51 1xob n ASN 63 Ca -0.13 -3.32 -0.09 0.00 -0.03 0.00 0.00 54.58 51.01 1xob n ASN 63 Cb 1.04 -0.66 0.02 0.00 -0.61 0.00 0.00 39.78 39.57 1xob n ASN 63 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1xob h PRO 64 N 4.13 0.91 -0.99 3.52 0.13 -1.20 -3.23 132.00 135.26 1xob h PRO 64 Ca 0.18 -0.24 0.36 0.00 -0.87 0.00 0.00 66.00 65.43 1xob h PRO 64 Cb 0.70 -0.11 -0.17 0.00 0.13 0.00 0.00 31.00 31.55 1xob h PRO 64 CO 0.77 0.87 0.47 0.78 -0.23 0.00 0.00 178.00 180.66 1xob h GLY 65 N 0.81 2.05 2.00 1.56 0.00 -1.91 0.95 103.07 108.52 1xob h GLY 65 Ca 0.17 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 1xob h GLY 65 CO 0.01 -0.66 -0.15 -0.84 0.00 0.00 0.00 176.54 174.90 1xob h THR 66 N 0.11 0.49 0.66 4.70 2.02 -1.95 -3.27 112.91 115.67 1xob h THR 66 Ca 0.77 -0.76 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 1xob h THR 66 Cb 1.90 1.52 -0.00 0.00 -1.74 0.00 0.00 68.15 69.83 1xob h THR 66 CO -0.73 0.15 -0.39 0.00 0.37 0.00 0.00 175.52 174.91 1xob h ALA 67 N 1.85 -1.22 -0.72 6.16 0.00 -1.00 -2.93 119.26 121.41 1xob h ALA 67 Ca -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1xob h ALA 67 Cb 0.51 0.49 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1xob h ALA 67 CO 0.02 -1.17 0.43 -1.00 0.00 0.00 0.00 179.25 177.53 1xob h PRO 68 N -0.98 0.97 -0.97 0.00 0.13 -1.73 -0.17 132.00 129.25 1xob h PRO 68 Ca -0.09 -0.08 0.22 0.00 -0.87 0.00 0.00 66.00 65.18 1xob h PRO 68 Cb 0.78 -0.21 -0.08 0.00 0.13 0.00 0.00 31.00 31.62 1xob h PRO 68 CO 0.10 0.68 0.63 0.87 -0.23 0.00 0.00 178.00 180.05 1xob h LYS 69 N 0.99 0.48 -0.24 0.86 1.57 -1.58 0.30 116.57 118.95 1xob h LYS 69 Ca 0.26 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1xob h LYS 69 Cb -0.04 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.16 1xob h LYS 69 CO -0.05 0.32 0.00 0.66 -0.57 0.00 0.00 179.45 179.81 1xob n TYR 70 N -4.60 0.63 -4.05 -1.35 4.01 -0.99 -4.99 117.16 105.82 1xob n TYR 70 Ca 0.22 -0.76 -0.31 0.00 -0.16 0.00 0.00 57.90 56.89 1xob n TYR 70 Cb 0.72 -0.20 -0.01 0.00 -0.31 0.00 0.00 39.34 39.55 1xob n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xob n GLY 71 N -0.32 -0.38 3.67 2.72 0.00 0.09 -4.80 105.19 106.17 1xob n GLY 71 Ca 0.16 0.15 -0.61 0.00 0.00 0.00 0.00 46.02 45.72 1xob n GLY 71 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xob n ILE 72 N -4.45 0.16 -0.03 -0.61 -0.00 -0.21 -4.87 119.36 109.34 1xob n ILE 72 Ca -0.07 -0.04 -0.16 0.00 -0.00 0.00 0.00 62.75 62.48 1xob n ILE 72 Cb 0.57 -0.91 -0.13 0.00 -0.00 0.00 0.00 39.64 39.16 1xob n ILE 72 CO 0.00 0.00 0.00 0.03 -0.00 0.00 0.00 176.55 176.58 1xob h ARG 73 N 6.89 0.10 -1.67 0.38 -0.00 -1.91 -3.48 114.38 114.69 1xob h ARG 73 Ca -0.41 -0.16 0.04 0.00 -0.50 0.00 0.00 59.98 58.96 1xob h ARG 73 Cb 1.35 0.06 -0.25 0.00 0.00 0.00 0.00 29.97 31.13 1xob h ARG 73 CO 0.99 1.06 0.41 0.20 0.00 0.00 0.00 179.97 182.62 1xob s GLY 74 N -4.24 -0.24 0.12 0.04 0.00 -1.26 -5.16 107.32 96.58 1xob s GLY 74 Ca -0.17 2.43 -0.10 0.00 0.00 0.00 0.00 44.72 46.88 1xob s GLY 74 CO 0.73 1.66 0.45 -0.26 0.00 0.00 0.00 173.10 175.69 1xob s ILE 75 N -0.02 5.02 0.18 0.90 -4.36 -1.26 -3.41 121.20 118.25 1xob s ILE 75 Ca 0.01 0.50 -0.30 0.00 -0.26 0.00 0.00 60.65 60.60 1xob s ILE 75 Cb -0.04 -3.66 -0.08 0.00 1.25 0.00 0.00 42.46 39.92 1xob s ILE 75 CO -0.03 0.21 1.33 -2.16 0.24 0.00 0.00 174.94 174.53 1xob s PRO 76 N -2.11 4.37 -0.32 0.37 0.04 -1.26 -4.70 135.00 131.39 1xob s PRO 76 Ca 0.37 2.06 -0.06 0.00 0.04 0.00 0.00 61.00 63.41 1xob s PRO 76 Cb -0.14 -3.21 0.03 0.00 0.04 0.00 0.00 34.50 31.23 1xob s PRO 76 CO 0.19 -0.31 0.08 0.99 0.04 0.00 0.00 177.00 177.99 1xob s THR 77 N 0.38 3.72 -0.30 1.26 2.01 -0.43 -0.45 115.64 121.82 1xob s THR 77 Ca 0.59 -1.00 -0.17 0.00 0.31 0.00 0.00 61.69 61.42 1xob s THR 77 Cb -0.37 -3.03 -0.02 0.00 0.01 0.00 0.00 72.50 69.09 1xob s THR 77 CO 0.36 -0.06 0.47 -0.76 -0.69 0.00 0.00 174.62 173.94 1xob s LEU 78 N 1.42 4.18 -0.23 4.42 1.43 0.43 -0.60 118.68 129.73 1xob s LEU 78 Ca -0.00 0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1xob s LEU 78 Cb -0.19 -2.56 0.03 0.00 0.03 0.00 0.00 46.19 43.50 1xob s LEU 78 CO 0.02 -0.34 -0.12 -0.76 0.23 0.00 0.00 176.35 175.37 1xob s LEU 79 N 2.28 2.86 -0.77 1.79 1.02 0.46 -0.47 118.68 125.85 1xob s LEU 79 Ca 0.18 -0.92 -0.20 0.00 0.02 0.00 0.00 54.13 53.21 1xob s LEU 79 Cb -0.16 -1.57 0.10 0.00 0.02 0.00 0.00 46.19 44.59 1xob s LEU 79 CO 0.11 -0.10 0.99 -0.22 0.02 0.00 0.00 176.35 177.15 1xob s LEU 80 N 1.26 4.88 -0.50 1.79 2.96 0.10 -0.27 118.68 128.89 1xob s LEU 80 Ca -0.00 -1.54 -0.25 0.00 -0.22 0.00 0.00 54.13 52.11 1xob s LEU 80 Cb -0.16 -2.39 0.03 0.00 0.50 0.00 0.00 46.19 44.17 1xob s LEU 80 CO -0.08 -1.21 0.96 -0.36 -1.32 0.00 0.00 176.35 174.34 1xob s PHE 81 N 3.18 2.86 -0.22 5.38 0.40 0.52 -0.34 117.98 129.75 1xob s PHE 81 Ca 0.25 0.30 -0.06 0.00 -0.60 0.00 0.00 56.93 56.81 1xob s PHE 81 Cb -0.13 -4.06 -0.03 0.00 0.51 0.00 0.00 43.02 39.31 1xob s PHE 81 CO 0.01 -1.21 0.03 0.15 0.70 0.00 0.00 175.22 174.89 1xob s LYS 82 N 3.94 3.65 -1.39 0.44 1.02 0.89 -0.35 119.74 127.93 1xob s LYS 82 Ca 0.36 -0.49 -0.04 0.00 0.02 0.00 0.00 55.97 55.82 1xob s LYS 82 Cb -0.10 -3.19 0.02 0.00 -0.52 0.00 0.00 37.83 34.04 1xob s LYS 82 CO 0.25 -0.06 0.70 -1.71 -0.92 0.00 0.00 175.35 173.61 1xob n ASN 83 N 4.50 -1.81 0.00 2.83 5.15 -0.05 -1.00 115.26 124.88 1xob n ASN 83 Ca -0.17 -0.86 0.00 0.00 -0.60 0.00 0.00 54.58 52.96 1xob n ASN 83 Cb 0.52 -3.77 0.00 0.00 -0.53 0.00 0.00 39.78 36.00 1xob n ASN 83 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1xob n GLY 84 N -1.68 0.67 3.56 8.20 0.00 -1.12 -4.90 105.19 109.92 1xob n GLY 84 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 1xob n GLY 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xob s GLU 85 N -0.41 2.50 -0.35 1.61 0.41 -0.17 -4.73 118.70 117.56 1xob s GLU 85 Ca 0.00 -0.74 -0.29 0.00 -0.41 0.00 0.00 54.97 53.54 1xob s GLU 85 Cb 0.00 -2.45 -0.01 0.00 -1.78 0.00 0.00 34.13 29.89 1xob s GLU 85 CO 0.00 0.60 1.63 0.08 -0.49 0.00 0.00 175.26 177.08 1xob s VAL 86 N -0.94 3.67 0.02 2.63 1.01 -1.26 -0.08 120.40 125.45 1xob s VAL 86 Ca 0.16 0.69 -0.17 0.00 0.00 0.00 0.00 61.98 62.65 1xob s VAL 86 Cb -0.11 -3.87 -0.32 0.00 0.00 0.00 0.00 36.38 32.08 1xob s VAL 86 CO 0.06 -0.54 1.02 0.00 0.00 0.00 0.00 175.10 175.64 1xob h ALA 87 N 11.78 -0.08 -2.97 5.51 0.00 -1.00 -3.48 119.26 129.02 1xob h ALA 87 Ca -0.31 -0.77 0.05 0.00 0.00 0.00 0.00 54.91 53.87 1xob h ALA 87 Cb 1.14 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 1xob h ALA 87 CO 1.05 0.59 0.17 0.00 0.00 0.00 0.00 179.25 181.05 1xob s ALA 88 N -2.74 -1.04 0.12 0.00 0.00 -1.23 -5.04 121.76 111.83 1xob s ALA 88 Ca -0.11 -0.41 -0.12 0.00 0.00 0.00 0.00 51.96 51.32 1xob s ALA 88 Cb 0.04 0.89 0.01 0.00 0.00 0.00 0.00 23.12 24.06 1xob s ALA 88 CO 0.91 -1.01 0.32 -0.08 0.00 0.00 0.00 175.76 175.90 1xob s THR 89 N -3.94 0.09 -0.12 0.00 -1.32 -1.26 -0.72 115.64 108.38 1xob s THR 89 Ca 0.13 -0.94 -0.07 0.00 -1.21 0.00 0.00 61.69 59.61 1xob s THR 89 Cb -0.05 -1.37 0.05 0.00 -1.51 0.00 0.00 72.50 69.61 1xob s THR 89 CO 0.07 -0.42 0.28 -0.75 -2.21 0.00 0.00 174.62 171.60 1xob s LYS 90 N -3.86 0.26 -0.26 7.08 2.47 0.38 -5.00 119.74 120.81 1xob s LYS 90 Ca 0.06 0.57 -0.09 0.00 -1.56 0.00 0.00 55.97 54.94 1xob s LYS 90 Cb 0.03 -0.07 -0.04 0.00 -1.46 0.00 0.00 37.83 36.28 1xob s LYS 90 CO -0.09 -0.15 0.14 0.08 0.16 0.00 0.00 175.35 175.49 1xob s VAL 91 N 1.17 4.97 0.00 4.02 1.01 -1.26 -0.43 120.40 129.87 1xob s VAL 91 Ca -0.08 0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1xob s VAL 91 Cb -0.09 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1xob s VAL 91 CO -0.08 0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.94 1xob n GLY 92 N 4.77 0.33 3.66 4.51 0.00 0.40 -5.02 105.19 113.85 1xob n GLY 92 Ca -0.15 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 43.70 1xob n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xob s ALA 93 N -1.83 1.17 0.06 4.61 0.00 -1.26 -4.80 121.76 119.70 1xob s ALA 93 Ca 0.00 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.10 1xob s ALA 93 Cb 0.00 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 1xob s ALA 93 CO 0.00 -2.71 -0.08 -0.51 0.00 0.00 0.00 175.76 172.46 1xob s LEU 94 N -6.50 2.32 0.40 0.00 1.43 -1.26 -5.13 118.68 109.94 1xob s LEU 94 Ca 0.65 -0.66 -0.19 0.00 -1.03 0.00 0.00 54.13 52.90 1xob s LEU 94 Cb -0.21 -0.17 -0.10 0.00 0.03 0.00 0.00 46.19 45.74 1xob s LEU 94 CO 0.59 -0.25 0.88 -0.94 0.23 0.00 0.00 176.35 176.86 1xob s SER 95 N -1.94 6.89 0.20 2.29 1.04 -1.26 -4.87 113.70 116.06 1xob s SER 95 Ca -0.04 1.56 -0.12 0.00 0.48 0.00 0.00 55.95 57.83 1xob s SER 95 Cb -0.06 -2.49 0.26 0.00 0.10 0.00 0.00 66.02 63.82 1xob s SER 95 CO -0.01 -0.32 1.66 0.50 0.98 0.00 0.00 173.24 176.06 1xob h LYS 96 N 2.01 0.10 0.34 4.02 3.64 -1.99 0.49 116.57 125.16 1xob h LYS 96 Ca -0.49 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1xob h LYS 96 Cb 1.18 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 1xob h LYS 96 CO 0.62 0.06 -0.41 0.78 -2.27 0.00 0.00 179.45 178.24 1xob h GLY 97 N 0.10 -0.94 0.57 5.01 0.00 -1.99 0.67 103.07 106.49 1xob h GLY 97 Ca 0.30 0.47 0.09 0.00 0.00 0.00 0.00 47.33 48.19 1xob h GLY 97 CO -0.51 -0.31 0.52 1.46 0.00 0.00 0.00 176.54 177.70 1xob h GLN 98 N -0.79 0.86 0.15 4.80 1.08 -1.82 0.29 115.11 119.69 1xob h GLN 98 Ca -0.02 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.12 1xob h GLN 98 Cb 0.72 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 1xob h GLN 98 CO -0.11 0.57 -0.07 1.25 -0.95 0.00 0.00 178.83 179.52 1xob h LEU 99 N 0.89 -0.17 -0.57 1.46 5.85 -0.48 0.10 115.31 122.39 1xob h LEU 99 Ca 0.41 -0.04 0.07 0.00 0.84 0.00 0.00 57.88 59.16 1xob h LEU 99 Cb 0.33 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.35 1xob h LEU 99 CO -0.23 -0.07 0.24 0.11 -0.34 0.00 0.00 178.44 178.15 1xob h LYS 100 N -0.25 0.44 0.21 1.25 1.57 -0.09 0.54 116.57 120.24 1xob h LYS 100 Ca -0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1xob h LYS 100 Cb 0.20 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1xob h LYS 100 CO 0.03 0.29 -0.19 0.93 -0.57 0.00 0.00 179.45 179.94 1xob h GLU 101 N 0.46 -0.41 -0.31 3.15 5.08 -0.71 0.90 114.58 122.73 1xob h GLU 101 Ca 0.27 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.72 1xob h GLU 101 Cb 0.27 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.54 1xob h GLU 101 CO -0.24 -0.27 -0.13 0.35 -1.00 0.00 0.00 179.01 177.72 1xob h PHE 102 N -0.42 -0.30 0.13 4.33 3.57 -0.31 0.92 116.94 124.85 1xob h PHE 102 Ca -0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1xob h PHE 102 Cb 0.39 0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.31 1xob h PHE 102 CO -0.14 -0.20 -0.06 -0.07 -2.23 0.00 0.00 178.31 175.61 1xob h LEU 103 N -0.07 -0.15 -0.37 0.59 3.38 -0.71 -1.16 115.31 116.82 1xob h LEU 103 Ca 0.16 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.19 1xob h LEU 103 Cb 0.31 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.04 1xob h LEU 103 CO -0.36 -0.09 -0.04 -0.78 0.09 0.00 0.00 178.44 177.26 1xob h ASP 104 N -0.19 -0.22 -0.68 -0.43 3.58 -0.37 0.17 116.42 118.28 1xob h ASP 104 Ca -0.02 0.09 0.07 0.00 0.42 0.00 0.00 57.03 57.59 1xob h ASP 104 Cb 0.15 0.18 -0.04 0.00 1.72 0.00 0.00 39.33 41.33 1xob h ASP 104 CO 0.03 -0.07 0.45 0.00 -2.88 0.00 0.00 179.24 176.77 1xob h ALA 105 N 1.34 1.76 0.10 -0.78 0.00 -0.59 0.93 119.26 122.01 1xob h ALA 105 Ca 0.18 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 1xob h ALA 105 Cb 0.26 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.90 1xob h ALA 105 CO -0.33 0.13 -0.84 -0.91 0.00 0.00 0.00 179.25 177.30 1xob h ASN 106 N 0.68 0.56 -0.28 0.00 2.35 0.06 -3.32 115.58 115.63 1xob h ASN 106 Ca 0.30 -0.88 -0.01 0.00 -0.55 0.00 0.00 56.30 55.16 1xob h ASN 106 Cb 0.29 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 1xob h ASN 106 CO -0.09 1.39 0.13 -0.07 -1.65 0.00 0.00 177.43 177.13 1xob h LEU 107 N -0.18 0.38 0.00 1.61 3.38 -0.39 -3.52 115.31 116.59 1xob h LEU 107 Ca -0.13 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1xob h LEU 107 Cb 1.61 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.26 1xob h LEU 107 CO 0.16 0.42 0.00 0.00 0.09 0.00 0.00 178.44 179.11