#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xob n ASP 2 N 0.00 0.00 -0.01 6.43 2.03 -1.26 -1.00 116.55 122.74 1xob n ASP 2 Ca 0.00 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.41 1xob n ASP 2 Cb 0.00 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.25 1xob n ASP 2 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1xob n LYS 3 N 0.00 0.58 -2.70 -0.67 5.02 -1.26 -4.96 118.16 114.17 1xob n LYS 3 Ca 0.00 -0.18 -0.41 0.00 -2.02 0.00 0.00 58.31 55.70 1xob n LYS 3 Cb 0.00 -1.46 -0.04 0.00 -0.02 0.00 0.00 35.03 33.51 1xob n LYS 3 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1xob s ILE 4 N -3.34 4.50 -0.42 -0.18 1.01 -0.17 -4.56 121.20 118.05 1xob s ILE 4 Ca -0.07 2.01 -0.21 0.00 0.00 0.00 0.00 60.65 62.38 1xob s ILE 4 Cb 0.12 -4.29 0.02 0.00 0.01 0.00 0.00 42.46 38.32 1xob s ILE 4 CO 0.80 0.28 0.66 -0.63 0.00 0.00 0.00 174.94 176.05 1xob s ILE 5 N 0.20 4.82 -0.68 2.92 -1.09 -0.20 -1.11 121.20 126.06 1xob s ILE 5 Ca 0.48 0.30 -0.26 0.00 -2.23 0.00 0.00 60.65 58.95 1xob s ILE 5 Cb -0.24 -4.19 0.04 0.00 -1.58 0.00 0.00 42.46 36.50 1xob s ILE 5 CO 0.30 -0.53 1.17 -1.00 -1.23 0.00 0.00 174.94 173.64 1xob s HIS 6 N 2.87 2.46 0.58 3.97 3.76 -1.26 -0.69 115.29 126.98 1xob s HIS 6 Ca 0.24 -0.09 -0.07 0.00 -0.15 0.00 0.00 55.06 55.00 1xob s HIS 6 Cb -0.14 -4.49 -0.01 0.00 1.11 0.00 0.00 32.58 29.05 1xob s HIS 6 CO 0.18 -1.85 0.91 -0.51 -0.85 0.00 0.00 174.74 172.63 1xob s LEU 7 N 5.09 3.30 0.16 0.89 1.43 0.76 -4.95 118.68 125.36 1xob s LEU 7 Ca 0.33 0.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.33 1xob s LEU 7 Cb -0.10 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.29 1xob s LEU 7 CO 0.16 -0.94 0.04 0.42 0.23 0.00 0.00 176.35 176.26 1xob s THR 8 N -2.99 0.34 0.21 5.49 -4.23 -1.26 -4.09 115.64 109.11 1xob s THR 8 Ca 0.53 -1.95 -0.09 0.00 -1.18 0.00 0.00 61.69 59.00 1xob s THR 8 Cb -0.11 -2.15 0.15 0.00 1.34 0.00 0.00 72.50 71.73 1xob s THR 8 CO 0.47 -0.40 1.81 -0.78 -0.54 0.00 0.00 174.62 175.17 1xob h ASP 9 N 2.75 0.54 -0.61 3.99 3.58 -1.93 0.15 116.42 124.90 1xob h ASP 9 Ca -0.36 0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.14 1xob h ASP 9 Cb 1.21 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 42.15 1xob h ASP 9 CO 0.60 0.35 0.39 -0.78 -2.88 0.00 0.00 179.24 176.92 1xob h ASP 10 N 0.68 0.65 0.87 2.28 3.58 -2.01 -2.93 116.42 119.54 1xob h ASP 10 Ca 0.30 -0.01 -0.21 0.00 0.42 0.00 0.00 57.03 57.54 1xob h ASP 10 Cb 0.20 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 1xob h ASP 10 CO -0.19 0.46 -0.98 0.77 -2.88 0.00 0.00 179.24 176.42 1xob h SER 11 N 0.77 0.08 -0.82 2.28 4.64 -1.82 -3.38 113.55 115.31 1xob h SER 11 Ca 0.23 -0.08 0.11 0.00 -0.47 0.00 0.00 61.79 61.58 1xob h SER 11 Cb -0.03 -0.03 -0.12 0.00 -0.31 0.00 0.00 62.40 61.91 1xob h SER 11 CO -0.08 1.01 -0.38 0.33 -0.87 0.00 0.00 176.83 176.84 1xob n PHE 12 N -3.45 -0.13 0.18 4.77 7.35 0.49 -0.66 117.46 126.01 1xob n PHE 12 Ca -0.02 1.01 -0.15 0.00 -0.76 0.00 0.00 57.45 57.53 1xob n PHE 12 Cb 0.90 -0.71 -0.08 0.00 0.35 0.00 0.00 39.48 39.95 1xob n PHE 12 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1xob h ASP 13 N 0.00 -1.16 -0.21 -2.13 5.19 -1.74 0.34 116.42 116.71 1xob h ASP 13 Ca 0.22 0.11 -0.01 0.00 -0.62 0.00 0.00 57.03 56.74 1xob h ASP 13 Cb 0.43 0.41 -0.01 0.00 0.18 0.00 0.00 39.33 40.34 1xob h ASP 13 CO -0.79 -0.52 0.11 0.74 -3.12 0.00 0.00 179.24 175.65 1xob h THR 14 N -0.74 1.12 0.01 0.35 2.02 -1.56 0.12 112.91 114.23 1xob h THR 14 Ca -0.01 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 66.83 1xob h THR 14 Cb 0.71 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1xob h THR 14 CO -0.15 0.12 -0.01 0.44 0.37 0.00 0.00 175.52 176.29 1xob h ASP 15 N 0.22 -0.02 0.00 4.18 5.19 -0.81 -3.32 116.42 121.87 1xob h ASP 15 Ca 0.07 -0.75 -0.08 0.00 -0.62 0.00 0.00 57.03 55.65 1xob h ASP 15 Cb 0.09 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.60 1xob h ASP 15 CO -0.01 0.77 -0.80 0.52 -3.12 0.00 0.00 179.24 176.60 1xob n VAL 16 N -4.72 1.46 -0.18 -1.35 0.31 0.11 -3.41 118.33 110.56 1xob n VAL 16 Ca -0.09 0.13 -0.10 0.00 -0.01 0.00 0.00 64.34 64.27 1xob n VAL 16 Cb 0.37 -2.28 0.01 0.00 -0.91 0.00 0.00 33.84 31.03 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 -1.00 0.95 -3.32 7.52 3.38 -0.83 -1.98 115.31 120.02 1xob h LEU 17 Ca -0.12 -0.33 -0.34 0.00 0.09 0.00 0.00 57.88 57.18 1xob h LEU 17 Cb 0.78 -0.26 -0.20 0.00 0.09 0.00 0.00 40.66 41.08 1xob h LEU 17 CO -0.07 1.05 0.44 0.29 0.09 0.00 0.00 178.44 180.24 1xob n LYS 18 N -4.24 1.83 -1.49 1.13 5.02 0.33 -3.96 118.16 116.78 1xob n LYS 18 Ca 0.01 -1.97 -0.32 0.00 -2.02 0.00 0.00 58.31 54.01 1xob n LYS 18 Cb 0.36 -1.77 0.08 0.00 -0.02 0.00 0.00 35.03 33.67 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 -2.17 2.28 -0.42 7.82 0.00 -0.75 -4.84 121.76 123.69 1xob s ALA 19 Ca 0.37 0.52 0.11 0.00 0.00 0.00 0.00 51.96 52.96 1xob s ALA 19 Cb 0.31 -3.34 0.39 0.00 0.00 0.00 0.00 23.12 20.49 1xob s ALA 19 CO 0.07 -1.61 0.92 -3.47 0.00 0.00 0.00 175.76 171.66 1xob n ASP 20 N -2.91 2.57 0.00 0.00 2.03 -1.26 -4.32 116.55 112.65 1xob n ASP 20 Ca 0.11 -3.21 0.00 0.00 0.52 0.00 0.00 54.79 52.20 1xob n ASP 20 Cb 0.52 -0.55 0.00 0.00 -0.72 0.00 0.00 41.12 40.37 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 -0.08 -1.71 3.58 0.27 0.00 -1.26 -4.97 105.19 101.02 1xob n GLY 21 Ca 0.25 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 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 -1.30 3.41 -0.24 4.61 0.00 -1.26 -0.69 121.76 126.28 1xob s ALA 22 Ca 0.00 -0.74 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 1xob s ALA 22 Cb 0.00 -3.36 0.01 0.00 0.00 0.00 0.00 23.12 19.77 1xob s ALA 22 CO 0.00 -1.55 -0.05 0.42 0.00 0.00 0.00 175.76 174.58 1xob s ILE 23 N 3.09 3.13 -0.75 0.00 1.01 0.38 -0.71 121.20 127.36 1xob s ILE 23 Ca 0.30 -0.77 -0.21 0.00 0.00 0.00 0.00 60.65 59.98 1xob s ILE 23 Cb -0.13 -2.51 0.10 0.00 0.01 0.00 0.00 42.46 39.93 1xob s ILE 23 CO 0.18 0.30 0.98 -0.22 0.00 0.00 0.00 174.94 176.18 1xob s LEU 24 N 1.40 4.80 -0.46 2.97 2.96 0.20 -0.18 118.68 130.37 1xob s LEU 24 Ca 0.03 -1.45 -0.22 0.00 -0.22 0.00 0.00 54.13 52.26 1xob s LEU 24 Cb -0.15 -2.39 0.03 0.00 0.50 0.00 0.00 46.19 44.17 1xob s LEU 24 CO -0.04 -1.25 0.76 -0.69 -1.32 0.00 0.00 176.35 173.81 1xob s VAL 25 N 3.33 4.68 -0.51 1.68 1.01 0.61 -0.44 120.40 130.75 1xob s VAL 25 Ca 0.24 0.29 -0.20 0.00 0.00 0.00 0.00 61.98 62.32 1xob s VAL 25 Cb -0.14 -4.32 0.06 0.00 0.00 0.00 0.00 36.38 31.99 1xob s VAL 25 CO 0.02 -0.74 0.65 -0.62 0.00 0.00 0.00 175.10 174.42 1xob s ASP 26 N 2.20 6.23 -0.13 3.32 3.68 0.30 -0.37 116.67 131.90 1xob s ASP 26 Ca 0.27 -0.88 -0.29 0.00 2.13 0.00 0.00 52.55 53.78 1xob s ASP 26 Cb -0.13 -2.30 -0.01 0.00 -1.45 0.00 0.00 42.92 39.03 1xob s ASP 26 CO 0.21 -0.93 1.05 -0.36 0.13 0.00 0.00 175.17 175.28 1xob s PHE 27 N 2.74 3.40 0.25 -5.34 0.40 0.16 -0.55 117.98 119.04 1xob s PHE 27 Ca 0.16 1.49 0.02 0.00 -0.60 0.00 0.00 56.93 58.00 1xob s PHE 27 Cb -0.19 -3.25 -0.04 0.00 0.51 0.00 0.00 43.02 40.05 1xob s PHE 27 CO 0.12 -0.49 0.16 1.67 0.70 0.00 0.00 175.22 177.38 1xob s TRP 28 N 2.37 1.39 -0.02 0.36 1.48 0.10 -1.35 118.94 123.26 1xob s TRP 28 Ca 0.49 -1.43 -0.09 0.00 -1.06 0.00 0.00 56.10 54.01 1xob s TRP 28 Cb -0.19 -0.67 0.01 0.00 -1.16 0.00 0.00 33.47 31.47 1xob s TRP 28 CO 0.16 -0.65 0.19 0.00 -4.06 0.00 0.00 176.95 172.59 1xob s ALA 29 N -3.89 -0.47 0.13 2.67 0.00 -1.26 -0.49 121.76 118.45 1xob s ALA 29 Ca 0.39 0.12 -0.23 0.00 0.00 0.00 0.00 51.96 52.24 1xob s ALA 29 Cb 0.06 0.00 -0.03 0.00 0.00 0.00 0.00 23.12 23.15 1xob s ALA 29 CO 0.16 -0.20 1.66 1.49 0.00 0.00 0.00 175.76 178.88 1xob h GLU 30 N 4.52 -0.22 0.00 0.00 4.81 -1.99 -2.17 114.58 119.53 1xob h GLU 30 Ca -0.29 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.94 1xob h GLU 30 Cb 1.19 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.62 1xob h GLU 30 CO 0.40 -0.14 -0.06 0.11 -0.73 0.00 0.00 179.01 178.59 1xob h TRP 31 N -0.22 0.00 0.00 0.92 5.08 -2.06 -3.37 115.95 116.30 1xob h TRP 31 Ca 0.09 0.00 -0.71 0.00 1.08 0.00 0.00 58.89 59.35 1xob h TRP 31 Cb 0.35 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 26.47 1xob h TRP 31 CO -0.27 0.06 3.10 0.00 -1.28 0.00 0.00 178.44 180.05 1xob n GLY 33 N 4.12 0.00 0.58 0.00 0.00 -1.26 -0.48 105.19 108.15 1xob n GLY 33 Ca 0.52 0.00 0.42 0.00 0.00 0.00 0.00 46.02 46.96 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 0.05 -0.67 1.61 0.11 -1.95 0.16 132.00 131.30 1xob h PRO 34 Ca 0.00 -0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.21 1xob h PRO 34 Cb 0.00 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 31.02 1xob h PRO 34 CO 0.00 0.03 0.30 0.00 -0.21 0.00 0.00 178.00 178.12 1xob h LYS 36 N 0.50 0.00 -0.05 0.00 1.57 -0.87 0.49 116.57 118.21 1xob h LYS 36 Ca 0.34 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.97 1xob h LYS 36 Cb 0.41 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.73 1xob h LYS 36 CO -0.30 0.24 -0.57 0.52 -0.57 0.00 0.00 179.45 178.77 1xob h MET 37 N 0.00 0.48 0.00 3.15 2.86 -0.88 -3.26 114.93 117.28 1xob h MET 37 Ca -0.00 -0.45 -0.14 0.00 -2.06 0.00 0.00 59.70 57.05 1xob h MET 37 Cb 0.55 0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.30 1xob h MET 37 CO 0.03 1.09 -0.67 -0.84 1.06 0.00 0.00 176.91 177.58 1xob h ILE 38 N 0.04 1.38 -0.93 -1.22 3.07 -0.85 -3.37 117.51 115.62 1xob h ILE 38 Ca -0.06 -2.37 0.09 0.00 1.55 0.00 0.00 64.86 64.07 1xob h ILE 38 Cb 1.24 2.32 -0.12 0.00 -0.27 0.00 0.00 36.82 39.99 1xob h ILE 38 CO 0.11 0.66 -0.53 0.00 -1.05 0.00 0.00 178.15 177.34 1xob n ALA 39 N -2.37 -0.55 -0.37 0.16 0.00 0.14 -0.39 120.51 117.14 1xob n ALA 39 Ca -0.00 0.81 0.04 0.00 0.00 0.00 0.00 53.44 54.28 1xob n ALA 39 Cb 0.69 -0.16 0.19 0.00 0.00 0.00 0.00 19.45 20.17 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 1.10 -0.17 0.00 0.13 -1.75 0.44 132.00 131.75 1xob h PRO 40 Ca 0.17 -0.07 0.01 0.00 -0.87 0.00 0.00 66.00 65.24 1xob h PRO 40 Cb 0.40 -0.25 -0.02 0.00 0.13 0.00 0.00 31.00 31.27 1xob h PRO 40 CO -0.88 0.72 0.07 0.82 -0.23 0.00 0.00 178.00 178.50 1xob h ILE 41 N 1.13 0.97 -0.69 -3.56 2.04 -0.92 0.68 117.51 117.17 1xob h ILE 41 Ca 0.45 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 66.31 1xob h ILE 41 Cb 0.25 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.08 1xob h ILE 41 CO -0.20 0.03 0.40 -0.07 0.00 0.00 0.00 178.15 178.31 1xob h LEU 42 N 0.15 0.61 -0.19 1.44 3.38 0.32 0.89 115.31 121.92 1xob h LEU 42 Ca 0.07 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1xob h LEU 42 Cb 0.03 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1xob h LEU 42 CO -0.07 0.40 0.13 0.44 0.09 0.00 0.00 178.44 179.43 1xob h ASP 43 N 0.75 0.22 0.04 -0.43 3.32 -0.25 0.18 116.42 120.25 1xob h ASP 43 Ca 0.30 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.36 1xob h ASP 43 Cb 0.15 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1xob h ASP 43 CO -0.16 0.16 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.05 1xob h GLU 44 N 0.26 -0.24 -0.61 3.56 5.08 -0.28 -1.32 114.58 121.03 1xob h GLU 44 Ca 0.07 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.52 1xob h GLU 44 Cb -0.03 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 1xob h GLU 44 CO -0.02 -0.16 0.29 0.82 -1.00 0.00 0.00 179.01 178.94 1xob h ILE 45 N -0.25 0.87 -0.87 3.13 1.08 -0.65 0.85 117.51 121.67 1xob h ILE 45 Ca 0.04 -0.18 0.09 0.00 -0.39 0.00 0.00 64.86 64.42 1xob h ILE 45 Cb 0.29 0.30 -0.07 0.00 -3.07 0.00 0.00 36.82 34.27 1xob h ILE 45 CO -0.11 0.10 0.52 0.00 -0.69 0.00 0.00 178.15 177.97 1xob h ALA 46 N 1.37 1.25 0.32 1.87 0.00 -0.02 0.69 119.26 124.75 1xob h ALA 46 Ca 0.29 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1xob h ALA 46 Cb 0.28 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1xob h ALA 46 CO -0.24 0.17 -0.16 0.22 0.00 0.00 0.00 179.25 179.25 1xob h ASP 47 N 0.88 -0.37 -0.64 0.00 3.58 -0.11 -1.30 116.42 118.47 1xob h ASP 47 Ca 0.41 -0.17 0.13 0.00 0.42 0.00 0.00 57.03 57.82 1xob h ASP 47 Cb 0.34 0.09 -0.11 0.00 1.72 0.00 0.00 39.33 41.37 1xob h ASP 47 CO -0.23 0.02 -0.07 -0.33 -2.88 0.00 0.00 179.24 175.74 1xob h GLU 48 N -0.82 0.05 -0.80 0.28 5.08 -0.34 -1.21 114.58 116.82 1xob h GLU 48 Ca -0.04 -0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.93 1xob h GLU 48 Cb 0.52 -0.01 -0.23 0.00 0.50 0.00 0.00 28.75 29.53 1xob h GLU 48 CO 0.07 0.04 0.42 0.66 -1.00 0.00 0.00 179.01 179.20 1xob n TYR 49 N -5.36 2.49 -1.67 4.33 4.02 0.19 -5.01 117.16 116.15 1xob n TYR 49 Ca 0.09 -1.68 -0.47 0.00 -0.01 0.00 0.00 57.90 55.83 1xob n TYR 49 Cb 0.36 -0.80 -0.04 0.00 -0.02 0.00 0.00 39.34 38.84 1xob n TYR 49 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xob n GLN 50 N -0.98 2.18 0.00 -0.72 10.64 -0.46 -0.45 117.38 127.58 1xob n GLN 50 Ca 0.50 0.79 0.00 0.00 -1.83 0.00 0.00 57.00 56.46 1xob n GLN 50 Cb 1.48 -2.59 0.00 0.00 -0.86 0.00 0.00 30.24 28.27 1xob n GLN 50 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1xob n GLY 51 N 3.77 2.97 0.13 2.61 0.00 -1.26 -4.75 105.19 108.65 1xob n GLY 51 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.00 0.63 -4.46 1.61 5.02 0.40 -4.93 118.16 114.43 1xob n LYS 52 Ca 0.00 0.20 -0.28 0.00 -2.02 0.00 0.00 58.31 56.20 1xob n LYS 52 Cb 0.00 -1.51 -0.17 0.00 -0.02 0.00 0.00 35.03 33.33 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 -6.92 1.71 -0.63 -0.35 2.96 0.15 -4.54 118.68 111.07 1xob s LEU 53 Ca -0.36 -0.42 -0.23 0.00 -0.22 0.00 0.00 54.13 52.89 1xob s LEU 53 Cb 0.11 -1.08 0.06 0.00 0.50 0.00 0.00 46.19 45.78 1xob s LEU 53 CO 0.56 0.01 0.95 -0.89 -1.32 0.00 0.00 176.35 175.67 1xob s THR 54 N 0.98 4.34 0.05 3.68 2.01 0.12 -4.62 115.64 122.20 1xob s THR 54 Ca -0.07 -0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.47 1xob s THR 54 Cb -0.15 -4.64 -0.04 0.00 0.01 0.00 0.00 72.50 67.68 1xob s THR 54 CO -0.01 -1.35 0.99 -0.69 -0.69 0.00 0.00 174.62 172.87 1xob s VAL 55 N 4.03 4.65 0.04 3.82 1.01 -1.26 -0.63 120.40 132.05 1xob s VAL 55 Ca 0.24 2.00 0.01 0.00 0.00 0.00 0.00 61.98 64.24 1xob s VAL 55 Cb -0.15 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 31.92 1xob s VAL 55 CO 0.13 0.21 -0.06 0.00 0.00 0.00 0.00 175.10 175.38 1xob s ALA 56 N 0.63 0.45 -0.04 5.51 0.00 0.41 -1.03 121.76 127.70 1xob s ALA 56 Ca 0.51 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.71 1xob s ALA 56 Cb -0.23 0.11 -0.00 0.00 0.00 0.00 0.00 23.12 23.00 1xob s ALA 56 CO 0.29 -0.11 -0.14 0.15 0.00 0.00 0.00 175.76 175.95 1xob s LYS 57 N -1.92 1.43 -0.21 0.00 1.02 0.14 -0.54 119.74 119.66 1xob s LYS 57 Ca -0.09 -0.48 0.01 0.00 0.02 0.00 0.00 55.97 55.44 1xob s LYS 57 Cb -0.07 -1.27 0.05 0.00 -0.52 0.00 0.00 37.83 36.01 1xob s LYS 57 CO -0.01 0.18 -0.09 -1.17 -0.92 0.00 0.00 175.35 173.34 1xob s LEU 58 N 0.11 2.36 -0.50 3.17 0.20 0.29 -0.17 118.68 124.15 1xob s LEU 58 Ca -0.04 -0.95 -0.29 0.00 0.69 0.00 0.00 54.13 53.54 1xob s LEU 58 Cb -0.10 -1.23 0.03 0.00 -0.43 0.00 0.00 46.19 44.46 1xob s LEU 58 CO 0.01 -0.16 1.19 0.21 -0.29 0.00 0.00 176.35 177.31 1xob s ASN 59 N 1.39 6.54 0.48 3.68 3.84 -1.26 -0.72 114.94 128.89 1xob s ASN 59 Ca -0.02 0.40 0.27 0.00 0.21 0.00 0.00 52.86 53.73 1xob s ASN 59 Cb -0.17 -2.55 1.10 0.00 -0.55 0.00 0.00 41.25 39.08 1xob s ASN 59 CO -0.08 -1.35 1.89 0.16 -2.79 0.00 0.00 177.10 174.94 1xob h ILE 60 N 6.25 0.36 -0.23 -5.21 3.07 -0.99 -0.78 117.51 119.97 1xob h ILE 60 Ca -0.24 -0.87 0.02 0.00 1.55 0.00 0.00 64.86 65.32 1xob h ILE 60 Cb 1.06 1.66 -0.02 0.00 -0.27 0.00 0.00 36.82 39.25 1xob h ILE 60 CO 1.14 0.14 0.08 0.44 -1.05 0.00 0.00 178.15 178.90 1xob h ASP 61 N 0.00 0.09 0.86 2.16 3.32 -1.91 -0.36 116.42 120.59 1xob h ASP 61 Ca -0.00 0.02 -0.23 0.00 0.02 0.00 0.00 57.03 56.84 1xob h ASP 61 Cb 0.64 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 1xob h ASP 61 CO 0.02 0.08 -1.08 1.56 -1.72 0.00 0.00 179.24 178.10 1xob h GLN 62 N 0.19 0.10 -2.24 3.56 1.08 -1.93 -3.39 115.11 112.48 1xob h GLN 62 Ca 0.10 -0.16 -0.61 0.00 -1.45 0.00 0.00 58.65 56.53 1xob h GLN 62 Cb 0.07 0.06 -0.41 0.00 -0.05 0.00 0.00 27.48 27.14 1xob h GLN 62 CO -0.10 1.07 -0.55 0.09 -0.95 0.00 0.00 178.83 178.39 1xob n ASN 63 N -3.42 4.09 -0.07 1.46 3.02 -0.31 -4.92 115.26 115.11 1xob n ASN 63 Ca -0.03 -3.52 -0.10 0.00 -0.03 0.00 0.00 54.58 50.90 1xob n ASN 63 Cb 0.96 -0.66 -0.04 0.00 -0.61 0.00 0.00 39.78 39.44 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 3.87 0.36 -0.99 3.52 0.13 -1.28 -3.21 132.00 134.39 1xob h PRO 64 Ca 0.18 -0.06 0.37 0.00 -0.87 0.00 0.00 66.00 65.63 1xob h PRO 64 Cb 0.61 -0.06 -0.17 0.00 0.13 0.00 0.00 31.00 31.51 1xob h PRO 64 CO 0.85 0.40 0.47 0.78 -0.23 0.00 0.00 178.00 180.27 1xob h GLY 65 N 0.24 2.07 2.00 1.56 0.00 -1.91 0.80 103.07 107.83 1xob h GLY 65 Ca 0.08 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 1xob h GLY 65 CO -0.01 -0.69 -0.17 -0.84 0.00 0.00 0.00 176.54 174.83 1xob h THR 66 N 0.07 0.83 0.63 4.70 2.02 -1.95 -3.16 112.91 116.05 1xob h THR 66 Ca 0.78 -0.65 -0.03 0.00 0.77 0.00 0.00 66.41 67.29 1xob h THR 66 Cb 1.96 1.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.76 1xob h THR 66 CO -0.75 0.17 -0.35 0.00 0.37 0.00 0.00 175.52 174.96 1xob h ALA 67 N 1.83 -1.21 -0.68 6.16 0.00 -1.02 -2.90 119.26 121.44 1xob h ALA 67 Ca -0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1xob h ALA 67 Cb 0.37 0.42 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1xob h ALA 67 CO 0.02 -1.16 0.42 -1.00 0.00 0.00 0.00 179.25 177.53 1xob h PRO 68 N -0.90 0.92 -0.83 0.00 0.13 -1.73 -0.30 132.00 129.29 1xob h PRO 68 Ca -0.09 -0.07 0.22 0.00 -0.87 0.00 0.00 66.00 65.20 1xob h PRO 68 Cb 0.71 -0.20 -0.04 0.00 0.13 0.00 0.00 31.00 31.60 1xob h PRO 68 CO 0.11 0.64 0.58 0.87 -0.23 0.00 0.00 178.00 179.97 1xob h LYS 69 N 0.94 0.11 -0.04 0.86 1.57 -1.50 0.12 116.57 118.63 1xob h LYS 69 Ca 0.25 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1xob h LYS 69 Cb -0.05 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1xob h LYS 69 CO -0.05 0.08 0.00 0.66 -0.57 0.00 0.00 179.45 179.57 1xob n TYR 70 N -4.36 0.15 -4.13 -1.35 4.01 -0.86 -5.01 117.16 105.61 1xob n TYR 70 Ca 0.17 -0.95 -0.32 0.00 -0.16 0.00 0.00 57.90 56.64 1xob n TYR 70 Cb 0.82 -0.17 -0.02 0.00 -0.31 0.00 0.00 39.34 39.66 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 -1.23 -0.37 3.64 2.72 0.00 0.03 -4.83 105.19 105.16 1xob n GLY 71 Ca 0.16 0.14 -0.50 0.00 0.00 0.00 0.00 46.02 45.82 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 -4.42 0.46 0.03 -0.61 -0.00 -0.30 -4.86 119.36 109.66 1xob n ILE 72 Ca -0.06 -0.15 -0.19 0.00 -0.00 0.00 0.00 62.75 62.35 1xob n ILE 72 Cb 0.56 -1.77 -0.14 0.00 -0.00 0.00 0.00 39.64 38.29 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 9.82 0.25 -1.79 0.38 2.47 -1.91 -3.46 114.38 120.14 1xob h ARG 73 Ca -0.44 -0.42 0.01 0.00 -1.26 0.00 0.00 59.98 57.87 1xob h ARG 73 Cb 1.29 0.16 -0.22 0.00 -1.65 0.00 0.00 29.97 29.54 1xob h ARG 73 CO 0.96 1.20 0.34 0.20 0.56 0.00 0.00 179.97 183.23 1xob s GLY 74 N -4.37 -0.41 0.11 0.04 0.00 -1.26 -5.14 107.32 96.29 1xob s GLY 74 Ca -0.14 1.85 0.02 0.00 0.00 0.00 0.00 44.72 46.44 1xob s GLY 74 CO 0.81 1.21 0.25 -0.26 0.00 0.00 0.00 173.10 175.11 1xob s ILE 75 N -0.75 5.31 0.37 0.90 -4.36 -1.26 -3.99 121.20 117.42 1xob s ILE 75 Ca -0.04 -0.58 -0.27 0.00 -0.26 0.00 0.00 60.65 59.50 1xob s ILE 75 Cb -0.02 -3.67 -0.09 0.00 1.25 0.00 0.00 42.46 39.93 1xob s ILE 75 CO 0.04 0.01 1.23 -2.16 0.24 0.00 0.00 174.94 174.30 1xob s PRO 76 N -2.92 4.17 -0.26 0.37 0.04 -1.26 -4.65 135.00 130.50 1xob s PRO 76 Ca 0.34 2.02 0.02 0.00 0.04 0.00 0.00 61.00 63.43 1xob s PRO 76 Cb -0.12 -2.86 0.06 0.00 0.04 0.00 0.00 34.50 31.63 1xob s PRO 76 CO 0.28 -0.27 -0.09 0.99 0.04 0.00 0.00 177.00 177.94 1xob s THR 77 N -1.27 2.02 -0.84 1.26 2.01 -0.46 -0.18 115.64 118.17 1xob s THR 77 Ca 0.53 -1.55 -0.20 0.00 0.31 0.00 0.00 61.69 60.79 1xob s THR 77 Cb -0.35 -2.17 0.11 0.00 0.01 0.00 0.00 72.50 70.10 1xob s THR 77 CO 0.45 -0.06 1.06 -0.76 -0.69 0.00 0.00 174.62 174.63 1xob s LEU 78 N 1.17 4.92 -0.33 4.42 1.43 0.61 -0.67 118.68 130.22 1xob s LEU 78 Ca -0.08 -1.75 -0.20 0.00 -1.03 0.00 0.00 54.13 51.07 1xob s LEU 78 Cb -0.20 -2.40 -0.00 0.00 0.03 0.00 0.00 46.19 43.62 1xob s LEU 78 CO -0.05 -1.16 0.60 -0.76 0.23 0.00 0.00 176.35 175.21 1xob s LEU 79 N 3.01 4.23 -0.73 1.79 1.02 0.50 -0.90 118.68 127.60 1xob s LEU 79 Ca 0.29 0.22 -0.19 0.00 0.02 0.00 0.00 54.13 54.47 1xob s LEU 79 Cb -0.09 -2.75 0.12 0.00 0.02 0.00 0.00 46.19 43.49 1xob s LEU 79 CO -0.04 -0.52 0.88 -0.22 0.02 0.00 0.00 176.35 176.47 1xob s LEU 80 N 2.60 5.27 -0.57 1.79 2.96 -0.14 -0.28 118.68 130.30 1xob s LEU 80 Ca 0.23 -1.67 -0.23 0.00 -0.22 0.00 0.00 54.13 52.24 1xob s LEU 80 Cb -0.15 -2.34 0.05 0.00 0.50 0.00 0.00 46.19 44.25 1xob s LEU 80 CO 0.13 -1.10 0.91 -0.36 -1.32 0.00 0.00 176.35 174.62 1xob s PHE 81 N 2.65 2.79 -0.46 5.38 0.40 0.75 -0.21 117.98 129.28 1xob s PHE 81 Ca 0.20 -0.18 -0.20 0.00 -0.60 0.00 0.00 56.93 56.15 1xob s PHE 81 Cb -0.16 -4.06 0.03 0.00 0.51 0.00 0.00 43.02 39.34 1xob s PHE 81 CO 0.01 -1.38 0.60 0.15 0.70 0.00 0.00 175.22 175.30 1xob s LYS 82 N 3.84 3.19 -1.36 0.44 1.02 0.63 -0.47 119.74 127.04 1xob s LYS 82 Ca 0.27 -0.61 -0.01 0.00 0.02 0.00 0.00 55.97 55.64 1xob s LYS 82 Cb -0.14 -4.00 -0.00 0.00 -0.52 0.00 0.00 37.83 33.17 1xob s LYS 82 CO 0.16 -1.06 0.51 -1.71 -0.92 0.00 0.00 175.35 172.34 1xob n ASN 83 N 6.13 -0.76 0.00 2.83 5.15 0.13 -0.86 115.26 127.88 1xob n ASN 83 Ca -0.04 -0.95 0.00 0.00 -0.60 0.00 0.00 54.58 52.98 1xob n ASN 83 Cb 0.47 -3.35 0.00 0.00 -0.53 0.00 0.00 39.78 36.37 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 -1.86 2.96 3.62 8.20 0.00 -1.18 -4.77 105.19 112.17 1xob n GLY 84 Ca -0.30 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 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 0.00 4.06 -0.41 1.61 2.02 -0.04 -4.85 118.70 121.10 1xob s GLU 85 Ca 0.00 0.13 -0.27 0.00 0.02 0.00 0.00 54.97 54.85 1xob s GLU 85 Cb 0.00 -3.62 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 1xob s GLU 85 CO 0.00 -0.23 2.10 0.08 0.02 0.00 0.00 175.26 177.23 1xob s VAL 86 N 1.92 3.20 0.06 2.63 1.01 -1.26 -0.27 120.40 127.68 1xob s VAL 86 Ca 0.17 0.17 -0.11 0.00 0.00 0.00 0.00 61.98 62.21 1xob s VAL 86 Cb -0.15 -3.37 -0.31 0.00 0.00 0.00 0.00 36.38 32.55 1xob s VAL 86 CO 0.09 -0.30 1.09 0.00 0.00 0.00 0.00 175.10 175.98 1xob h ALA 87 N 15.87 -0.02 -2.88 5.51 0.00 -0.93 -3.48 119.26 133.34 1xob h ALA 87 Ca -0.31 -0.84 -0.02 0.00 0.00 0.00 0.00 54.91 53.74 1xob h ALA 87 Cb 1.21 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 19.01 1xob h ALA 87 CO 1.09 0.79 0.03 0.00 0.00 0.00 0.00 179.25 181.16 1xob s ALA 88 N -2.74 -0.85 -0.16 0.00 0.00 -1.22 -5.02 121.76 111.78 1xob s ALA 88 Ca -0.07 -0.35 -0.05 0.00 0.00 0.00 0.00 51.96 51.49 1xob s ALA 88 Cb 0.06 0.89 0.08 0.00 0.00 0.00 0.00 23.12 24.14 1xob s ALA 88 CO 0.92 -0.84 0.29 0.99 0.00 0.00 0.00 175.76 177.12 1xob s THR 89 N -3.90 -0.45 -0.34 0.00 2.01 -1.26 -0.97 115.64 110.72 1xob s THR 89 Ca 0.12 0.19 -0.10 0.00 0.31 0.00 0.00 61.69 62.20 1xob s THR 89 Cb -0.01 -0.53 0.01 0.00 0.01 0.00 0.00 72.50 71.98 1xob s THR 89 CO 0.00 0.05 0.18 -0.75 -0.69 0.00 0.00 174.62 173.41 1xob s LYS 90 N 2.45 3.03 -0.19 4.92 2.36 -0.08 -4.94 119.74 127.28 1xob s LYS 90 Ca 0.02 -0.93 -0.20 0.00 -2.55 0.00 0.00 55.97 52.31 1xob s LYS 90 Cb -0.13 -3.64 -0.03 0.00 -1.05 0.00 0.00 37.83 32.98 1xob s LYS 90 CO -0.10 -0.58 0.58 0.08 1.55 0.00 0.00 175.35 176.88 1xob s VAL 91 N 1.57 5.06 0.00 4.02 1.01 -1.26 -0.29 120.40 130.52 1xob s VAL 91 Ca 0.03 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.09 1xob s VAL 91 Cb -0.18 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1xob s VAL 91 CO 0.06 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.92 1xob n GLY 92 N 3.80 0.53 3.70 4.51 0.00 0.74 -5.02 105.19 113.46 1xob n GLY 92 Ca -0.03 -1.85 -0.29 0.00 0.00 0.00 0.00 46.02 43.84 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 -2.16 1.37 0.27 4.61 0.00 -1.26 -4.67 121.76 119.92 1xob s ALA 93 Ca 0.00 -0.14 -0.16 0.00 0.00 0.00 0.00 51.96 51.66 1xob s ALA 93 Cb 0.00 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.96 1xob s ALA 93 CO 0.00 -2.50 0.60 -0.48 0.00 0.00 0.00 175.76 173.38 1xob s LEU 94 N -6.30 0.07 0.56 0.00 2.34 -1.26 -5.09 118.68 109.00 1xob s LEU 94 Ca 0.64 -0.82 -0.06 0.00 0.06 0.00 0.00 54.13 53.95 1xob s LEU 94 Cb -0.18 2.23 -0.01 0.00 -0.56 0.00 0.00 46.19 47.66 1xob s LEU 94 CO 0.57 -1.26 0.87 -0.94 -1.06 0.00 0.00 176.35 174.53 1xob s SER 95 N -2.99 5.86 0.28 1.48 1.04 -1.26 -4.91 113.70 113.21 1xob s SER 95 Ca 0.17 0.84 -0.02 0.00 0.48 0.00 0.00 55.95 57.42 1xob s SER 95 Cb -0.03 -1.94 0.41 0.00 0.10 0.00 0.00 66.02 64.55 1xob s SER 95 CO 0.09 -0.88 1.93 0.50 0.98 0.00 0.00 173.24 175.85 1xob h LYS 96 N -0.05 1.14 0.41 4.02 3.64 -1.99 0.01 116.57 123.74 1xob h LYS 96 Ca -0.46 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 1xob h LYS 96 Cb 1.23 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 1xob h LYS 96 CO 0.61 0.75 -0.33 0.78 -2.27 0.00 0.00 179.45 178.99 1xob h GLY 97 N 1.17 -0.82 0.42 5.01 0.00 -1.99 0.14 103.07 107.01 1xob h GLY 97 Ca 0.36 0.38 0.08 0.00 0.00 0.00 0.00 47.33 48.15 1xob h GLY 97 CO -0.10 -0.30 0.17 1.46 0.00 0.00 0.00 176.54 177.77 1xob h GLN 98 N -0.74 0.32 -0.02 4.80 7.50 -1.84 -1.07 115.11 124.06 1xob h GLN 98 Ca -0.04 -0.02 0.01 0.00 0.50 0.00 0.00 58.65 59.10 1xob h GLN 98 Cb 0.65 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.09 1xob h GLN 98 CO -0.02 0.21 -0.02 1.25 -1.50 0.00 0.00 178.83 178.75 1xob h LEU 99 N 0.33 -0.07 -0.36 1.46 5.85 -0.67 0.05 115.31 121.91 1xob h LEU 99 Ca 0.27 0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.06 1xob h LEU 99 Cb 0.32 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 1xob h LEU 99 CO -0.29 -0.04 0.01 0.11 -0.34 0.00 0.00 178.44 177.90 1xob h LYS 100 N -0.03 0.11 -0.41 1.25 1.79 -0.10 0.82 116.57 120.00 1xob h LYS 100 Ca 0.02 -0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.42 1xob h LYS 100 Cb 0.06 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.67 1xob h LYS 100 CO -0.04 0.07 0.02 1.05 -1.08 0.00 0.00 179.45 179.47 1xob h GLU 101 N 0.12 0.71 -0.19 3.15 4.11 -1.00 0.16 114.58 121.65 1xob h GLU 101 Ca 0.17 -0.22 0.05 0.00 0.07 0.00 0.00 59.36 59.44 1xob h GLU 101 Cb 0.23 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.36 1xob h GLU 101 CO -0.28 0.79 -0.18 0.35 0.07 0.00 0.00 179.01 179.75 1xob h PHE 102 N 0.55 -0.47 0.43 2.06 3.57 -0.55 0.92 116.94 123.46 1xob h PHE 102 Ca 0.12 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1xob h PHE 102 Cb 0.45 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.43 1xob h PHE 102 CO 0.03 -0.26 -0.27 -0.07 -2.23 0.00 0.00 178.31 175.52 1xob h LEU 103 N -0.20 -0.66 -0.41 0.59 3.38 -0.69 -1.82 115.31 115.50 1xob h LEU 103 Ca 0.12 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.21 1xob h LEU 103 Cb 0.38 0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.24 1xob h LEU 103 CO -0.31 -0.42 -0.13 -0.78 0.09 0.00 0.00 178.44 176.89 1xob h ASP 104 N -0.67 -0.47 -0.91 -0.43 3.58 -0.63 0.20 116.42 117.10 1xob h ASP 104 Ca -0.05 0.13 0.09 0.00 0.42 0.00 0.00 57.03 57.63 1xob h ASP 104 Cb 0.55 0.29 -0.07 0.00 1.72 0.00 0.00 39.33 41.82 1xob h ASP 104 CO 0.05 -0.17 0.59 0.00 -2.88 0.00 0.00 179.24 176.83 1xob h ALA 105 N 1.33 1.59 0.11 -0.78 0.00 -0.67 0.10 119.26 120.94 1xob h ALA 105 Ca 0.20 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.90 1xob h ALA 105 Cb 0.34 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 17.93 1xob h ALA 105 CO -0.44 0.23 -0.87 -0.91 0.00 0.00 0.00 179.25 177.26 1xob h ASN 106 N 0.93 0.58 -0.34 0.00 2.35 -0.31 -3.32 115.58 115.47 1xob h ASN 106 Ca 0.42 -0.88 -0.02 0.00 -0.55 0.00 0.00 56.30 55.27 1xob h ASN 106 Cb 0.37 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 1xob h ASN 106 CO -0.18 1.40 0.12 -0.07 -1.65 0.00 0.00 177.43 177.05 1xob h LEU 107 N -0.16 0.48 0.00 1.61 3.38 -0.40 -3.52 115.31 116.71 1xob h LEU 107 Ca -0.14 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1xob h LEU 107 Cb 1.63 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.25 1xob h LEU 107 CO 0.16 0.54 0.00 0.00 0.09 0.00 0.00 178.44 179.23