#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 3.84 -3.07 4.04 2.03 -1.26 -4.75 116.55 117.38 1xob n ASP 2 Ca 0.00 -2.42 -0.34 0.00 0.52 0.00 0.00 54.79 52.55 1xob n ASP 2 Cb 0.00 -1.06 -0.05 0.00 -0.72 0.00 0.00 41.12 39.29 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 5.18 3.51 -4.16 -0.67 5.02 -1.26 -4.85 118.16 120.93 1xob n LYS 3 Ca 0.44 -2.23 -0.16 0.00 -2.02 0.00 0.00 58.31 54.34 1xob n LYS 3 Cb 0.21 -2.60 -0.12 0.00 -0.02 0.00 0.00 35.03 32.50 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 1.13 0.76 -0.57 -0.18 1.01 -1.26 -4.79 121.20 117.31 1xob s ILE 4 Ca 0.66 -0.98 -0.23 0.00 0.00 0.00 0.00 60.65 60.10 1xob s ILE 4 Cb 0.22 -0.75 0.05 0.00 0.01 0.00 0.00 42.46 41.98 1xob s ILE 4 CO -0.06 -0.19 0.90 -0.63 0.00 0.00 0.00 174.94 174.95 1xob s ILE 5 N -1.06 4.45 -0.87 2.92 -1.09 -0.23 -4.90 121.20 120.42 1xob s ILE 5 Ca -0.04 0.04 -0.25 0.00 -2.23 0.00 0.00 60.65 58.17 1xob s ILE 5 Cb -0.08 -4.53 0.04 0.00 -1.58 0.00 0.00 42.46 36.31 1xob s ILE 5 CO 0.01 -1.14 1.34 -1.00 -1.23 0.00 0.00 174.94 172.92 1xob s HIS 6 N 3.78 2.43 0.68 3.97 3.76 -1.26 -0.71 115.29 127.95 1xob s HIS 6 Ca 0.27 -0.46 -0.11 0.00 -0.15 0.00 0.00 55.06 54.61 1xob s HIS 6 Cb -0.14 -4.64 0.00 0.00 1.11 0.00 0.00 32.58 28.91 1xob s HIS 6 CO 0.16 -1.99 1.07 -0.51 -0.85 0.00 0.00 174.74 172.63 1xob s LEU 7 N 5.26 3.01 0.15 0.89 1.43 0.99 -4.97 118.68 125.45 1xob s LEU 7 Ca 0.39 1.30 0.02 0.00 -1.03 0.00 0.00 54.13 54.82 1xob s LEU 7 Cb -0.05 -4.17 -0.05 0.00 0.03 0.00 0.00 46.19 41.95 1xob s LEU 7 CO 0.03 -1.25 -0.04 0.42 0.23 0.00 0.00 176.35 175.74 1xob s THR 8 N -3.25 0.81 0.18 5.49 -4.23 -1.26 -4.13 115.64 109.25 1xob s THR 8 Ca 0.57 -1.99 -0.14 0.00 -1.18 0.00 0.00 61.69 58.96 1xob s THR 8 Cb -0.12 -1.96 0.09 0.00 1.34 0.00 0.00 72.50 71.85 1xob s THR 8 CO 0.53 -0.63 1.72 -0.78 -0.54 0.00 0.00 174.62 174.93 1xob h ASP 9 N 2.77 0.01 -0.61 3.99 1.82 -1.94 0.85 116.42 123.31 1xob h ASP 9 Ca -0.36 0.08 0.06 0.00 -0.39 0.00 0.00 57.03 56.42 1xob h ASP 9 Cb 1.19 0.11 -0.06 0.00 0.68 0.00 0.00 39.33 41.25 1xob h ASP 9 CO 0.64 0.04 0.31 -0.78 -1.61 0.00 0.00 179.24 177.83 1xob h ASP 10 N 0.23 0.43 1.06 2.28 3.58 -2.01 -2.65 116.42 119.35 1xob h ASP 10 Ca 0.23 0.04 -0.16 0.00 0.42 0.00 0.00 57.03 57.55 1xob h ASP 10 Cb 0.29 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 1xob h ASP 10 CO -0.29 0.28 -0.77 0.77 -2.88 0.00 0.00 179.24 176.34 1xob h SER 11 N 0.58 0.00 -0.95 2.28 4.64 -1.80 -3.37 113.55 114.93 1xob h SER 11 Ca 0.28 0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.80 1xob h SER 11 Cb 0.22 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.13 1xob h SER 11 CO -0.20 0.77 -0.22 0.33 -0.87 0.00 0.00 176.83 176.64 1xob n PHE 12 N -3.40 0.36 0.06 4.77 -0.00 0.23 -0.52 117.46 118.96 1xob n PHE 12 Ca 0.00 1.16 -0.10 0.00 -0.00 0.00 0.00 57.45 58.51 1xob n PHE 12 Cb 0.81 -1.06 -0.06 0.00 -0.00 0.00 0.00 39.48 39.17 1xob n PHE 12 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.76 176.98 1xob h ASP 13 N 0.00 -0.99 -0.15 -2.13 3.58 -1.72 0.25 116.42 115.26 1xob h ASP 13 Ca 0.46 0.11 -0.04 0.00 0.42 0.00 0.00 57.03 57.98 1xob h ASP 13 Cb 0.72 0.37 -0.00 0.00 1.72 0.00 0.00 39.33 42.13 1xob h ASP 13 CO -0.97 -0.34 -0.07 0.74 -2.88 0.00 0.00 179.24 175.72 1xob h THR 14 N -0.45 1.31 0.00 2.25 2.02 -1.60 0.12 112.91 116.56 1xob h THR 14 Ca -0.00 -1.11 -0.05 0.00 0.77 0.00 0.00 66.41 66.02 1xob h THR 14 Cb 0.46 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 1xob h THR 14 CO -0.19 0.32 -0.25 0.44 0.37 0.00 0.00 175.52 176.22 1xob h ASP 15 N -0.02 0.00 0.00 4.18 5.19 -0.79 -3.28 116.42 121.70 1xob h ASP 15 Ca 0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1xob h ASP 15 Cb 0.54 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.05 1xob h ASP 15 CO 0.02 0.25 -0.06 0.52 -3.12 0.00 0.00 179.24 176.85 1xob n VAL 16 N -3.26 0.84 -0.22 -1.35 0.31 0.84 -4.50 118.33 110.99 1xob n VAL 16 Ca 0.01 0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.62 1xob n VAL 16 Cb 0.53 -1.45 0.24 0.00 -0.91 0.00 0.00 33.84 32.25 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 -0.06 0.87 -2.05 7.52 3.38 -0.63 -0.82 115.31 123.53 1xob h LEU 17 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xob h LEU 17 Cb 0.06 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1xob h LEU 17 CO 0.00 0.64 0.00 0.29 0.09 0.00 0.00 178.44 179.46 1xob n LYS 18 N -4.41 2.50 -2.85 1.13 5.02 0.30 -4.08 118.16 115.77 1xob n LYS 18 Ca 0.08 -1.88 -0.43 0.00 -2.02 0.00 0.00 58.31 54.06 1xob n LYS 18 Cb 0.04 -1.53 -0.04 0.00 -0.02 0.00 0.00 35.03 33.48 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 -1.53 3.13 -1.23 7.82 0.00 -0.31 -4.93 121.76 124.71 1xob s ALA 19 Ca 0.34 -1.58 -0.13 0.00 0.00 0.00 0.00 51.96 50.59 1xob s ALA 19 Cb 0.20 -3.80 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 1xob s ALA 19 CO 0.20 -2.60 2.31 -3.47 0.00 0.00 0.00 175.76 172.20 1xob n ASP 20 N 7.60 4.93 -2.34 0.00 2.03 -1.26 -2.82 116.55 124.69 1xob n ASP 20 Ca -0.02 -2.64 0.00 0.00 0.52 0.00 0.00 54.79 52.66 1xob n ASP 20 Cb 0.46 -1.40 0.01 0.00 -0.72 0.00 0.00 41.12 39.47 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 4.01 0.61 3.66 0.27 0.00 -1.26 -4.84 105.19 107.65 1xob n GLY 21 Ca 0.56 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.52 3.54 -0.07 4.61 0.00 -1.26 -0.78 121.76 126.28 1xob s ALA 22 Ca 0.14 -0.40 -0.00 0.00 0.00 0.00 0.00 51.96 51.70 1xob s ALA 22 Cb -0.01 -2.80 0.02 0.00 0.00 0.00 0.00 23.12 20.34 1xob s ALA 22 CO 0.01 -0.42 -0.04 0.42 0.00 0.00 0.00 175.76 175.73 1xob s ILE 23 N 1.59 0.63 -0.46 0.00 1.01 0.46 -0.87 121.20 123.55 1xob s ILE 23 Ca 0.24 -0.10 -0.19 0.00 0.00 0.00 0.00 60.65 60.60 1xob s ILE 23 Cb -0.15 -0.69 0.03 0.00 0.01 0.00 0.00 42.46 41.66 1xob s ILE 23 CO 0.10 0.28 0.59 -0.22 0.00 0.00 0.00 174.94 175.68 1xob s LEU 24 N 1.45 4.73 -0.45 2.97 1.98 0.19 -0.24 118.68 129.31 1xob s LEU 24 Ca -0.02 -0.60 -0.16 0.00 -2.89 0.00 0.00 54.13 50.46 1xob s LEU 24 Cb -0.13 -2.56 0.05 0.00 0.66 0.00 0.00 46.19 44.21 1xob s LEU 24 CO -0.03 -0.77 0.37 -0.69 -1.89 0.00 0.00 176.35 173.34 1xob s VAL 25 N 2.60 5.22 -0.57 1.68 1.01 0.46 -0.06 120.40 130.74 1xob s VAL 25 Ca 0.18 -0.85 -0.21 0.00 0.00 0.00 0.00 61.98 61.10 1xob s VAL 25 Cb -0.16 -4.05 0.07 0.00 0.00 0.00 0.00 36.38 32.23 1xob s VAL 25 CO 0.15 -0.47 0.78 -0.62 0.00 0.00 0.00 175.10 174.94 1xob s ASP 26 N 2.20 6.22 -0.18 3.32 3.68 0.20 -0.49 116.67 131.63 1xob s ASP 26 Ca 0.05 -0.97 -0.29 0.00 2.13 0.00 0.00 52.55 53.47 1xob s ASP 26 Cb -0.22 -2.35 -0.00 0.00 -1.45 0.00 0.00 42.92 38.90 1xob s ASP 26 CO 0.09 -1.13 1.10 -0.36 0.13 0.00 0.00 175.17 174.99 1xob s PHE 27 N 3.20 3.24 0.21 -5.34 0.40 0.47 -0.39 117.98 119.77 1xob s PHE 27 Ca 0.18 1.36 0.00 0.00 -0.60 0.00 0.00 56.93 57.88 1xob s PHE 27 Cb -0.19 -3.32 -0.05 0.00 0.51 0.00 0.00 43.02 39.97 1xob s PHE 27 CO 0.11 -0.80 0.09 1.67 0.70 0.00 0.00 175.22 176.99 1xob s TRP 28 N 2.98 1.28 -0.02 0.36 1.48 0.20 -1.00 118.94 124.22 1xob s TRP 28 Ca 0.48 -1.23 -0.02 0.00 -1.06 0.00 0.00 56.10 54.28 1xob s TRP 28 Cb -0.18 -0.70 0.00 0.00 -1.16 0.00 0.00 33.47 31.43 1xob s TRP 28 CO 0.11 -0.44 0.05 0.00 -4.06 0.00 0.00 176.95 172.62 1xob s ALA 29 N -3.91 -0.13 0.13 2.67 0.00 -1.26 -0.44 121.76 118.82 1xob s ALA 29 Ca 0.34 0.12 -0.21 0.00 0.00 0.00 0.00 51.96 52.22 1xob s ALA 29 Cb 0.07 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.08 1xob s ALA 29 CO 0.10 -0.03 1.69 1.49 0.00 0.00 0.00 175.76 179.01 1xob h GLU 30 N 6.00 -0.08 -0.01 0.00 4.57 -1.99 -2.58 114.58 120.49 1xob h GLU 30 Ca -0.25 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 1xob h GLU 30 Cb 1.21 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.81 1xob h GLU 30 CO 0.47 -0.05 0.01 0.11 -1.18 0.00 0.00 179.01 178.37 1xob h TRP 31 N -0.08 0.00 -0.86 0.92 5.08 -2.05 -3.36 115.95 115.61 1xob h TRP 31 Ca 0.09 0.00 -0.66 0.00 1.08 0.00 0.00 58.89 59.39 1xob h TRP 31 Cb 0.21 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 26.29 1xob h TRP 31 CO -0.22 0.00 2.13 0.00 -1.28 0.00 0.00 178.44 179.07 1xob n GLY 33 N 5.48 -0.41 0.40 0.00 0.00 -1.26 -0.22 105.19 109.19 1xob n GLY 33 Ca 0.48 0.17 0.33 0.00 0.00 0.00 0.00 46.02 47.01 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 0.10 -0.69 1.61 0.11 -1.94 0.30 132.00 131.49 1xob h PRO 34 Ca 0.02 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.21 1xob h PRO 34 Cb 0.06 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 31.07 1xob h PRO 34 CO -0.13 0.07 0.34 0.00 -0.21 0.00 0.00 178.00 178.07 1xob h LYS 36 N 0.59 0.45 -0.82 0.00 1.57 -0.57 -2.89 116.57 114.91 1xob h LYS 36 Ca 0.34 -0.24 0.12 0.00 -1.87 0.00 0.00 60.65 58.99 1xob h LYS 36 Cb 0.34 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.58 1xob h LYS 36 CO -0.26 0.82 0.43 0.52 -0.57 0.00 0.00 179.45 180.39 1xob h MET 37 N 0.11 0.66 0.00 3.15 2.86 -0.59 -0.04 114.93 121.07 1xob h MET 37 Ca 0.03 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1xob h MET 37 Cb 0.74 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1xob h MET 37 CO 0.05 0.44 0.00 0.44 1.06 0.00 0.00 176.91 178.89 1xob n ILE 38 N -4.82 0.48 0.08 -1.22 -5.35 0.10 -4.14 119.36 104.48 1xob n ILE 38 Ca 0.15 -0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.48 1xob n ILE 38 Cb 0.35 -0.72 -0.08 0.00 -1.74 0.00 0.00 39.64 37.45 1xob n ILE 38 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xob h ALA 39 N 2.66 -0.80 -0.90 -1.28 0.00 -0.78 0.12 119.26 118.29 1xob h ALA 39 Ca 0.00 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 54.94 1xob h ALA 39 Cb 0.50 0.81 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 1xob h ALA 39 CO 0.00 -1.02 0.54 -1.00 0.00 0.00 0.00 179.25 177.77 1xob h PRO 40 N -0.64 0.89 0.21 0.00 0.13 -1.74 0.11 132.00 130.95 1xob h PRO 40 Ca 0.03 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1xob h PRO 40 Cb 0.70 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 1xob h PRO 40 CO -0.31 0.59 -0.20 0.82 -0.23 0.00 0.00 178.00 178.66 1xob h ILE 41 N 0.91 0.56 -0.96 -3.56 2.04 -1.57 0.69 117.51 115.62 1xob h ILE 41 Ca 0.43 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.38 1xob h ILE 41 Cb 0.36 0.56 -0.07 0.00 -0.74 0.00 0.00 36.82 36.93 1xob h ILE 41 CO -0.24 0.00 0.62 -0.07 0.00 0.00 0.00 178.15 178.46 1xob h LEU 42 N -0.44 0.92 -0.10 1.44 3.38 -0.03 0.64 115.31 121.11 1xob h LEU 42 Ca -0.00 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1xob h LEU 42 Cb 0.41 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1xob h LEU 42 CO -0.05 0.55 0.05 0.44 0.09 0.00 0.00 178.44 179.53 1xob h ASP 43 N 1.03 0.13 0.01 -0.43 3.32 -0.05 0.19 116.42 120.62 1xob h ASP 43 Ca 0.44 -0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.40 1xob h ASP 43 Cb 0.32 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 1xob h ASP 43 CO -0.19 0.20 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.08 1xob h GLU 44 N 0.06 -0.20 -0.48 3.56 5.08 -0.05 -1.10 114.58 121.46 1xob h GLU 44 Ca 0.04 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.49 1xob h GLU 44 Cb 0.10 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.32 1xob h GLU 44 CO -0.01 -0.13 0.05 0.82 -1.00 0.00 0.00 179.01 178.75 1xob h ILE 45 N -0.20 0.69 -0.56 3.13 1.08 -0.77 0.81 117.51 121.69 1xob h ILE 45 Ca 0.04 -0.06 0.07 0.00 -0.39 0.00 0.00 64.86 64.52 1xob h ILE 45 Cb 0.25 0.50 -0.06 0.00 -3.07 0.00 0.00 36.82 34.44 1xob h ILE 45 CO -0.11 0.03 0.24 0.00 -0.69 0.00 0.00 178.15 177.62 1xob h ALA 46 N 1.39 0.72 0.27 1.87 0.00 -0.01 0.78 119.26 124.28 1xob h ALA 46 Ca 0.24 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1xob h ALA 46 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1xob h ALA 46 CO -0.35 -0.15 -0.13 0.22 0.00 0.00 0.00 179.25 178.84 1xob h ASP 47 N 0.45 -0.31 -0.48 0.00 3.58 -0.17 -0.54 116.42 118.95 1xob h ASP 47 Ca 0.27 -0.10 0.10 0.00 0.42 0.00 0.00 57.03 57.72 1xob h ASP 47 Cb 0.27 0.08 -0.09 0.00 1.72 0.00 0.00 39.33 41.31 1xob h ASP 47 CO -0.24 -0.09 -0.13 -0.33 -2.88 0.00 0.00 179.24 175.58 1xob h GLU 48 N -0.52 -0.01 -1.00 0.28 5.08 -0.39 -1.26 114.58 116.75 1xob h GLU 48 Ca -0.04 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.83 1xob h GLU 48 Cb 0.39 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 29.35 1xob h GLU 48 CO 0.06 -0.01 0.63 0.66 -1.00 0.00 0.00 179.01 179.36 1xob n TYR 49 N -5.35 2.91 -1.68 4.33 4.01 0.22 -4.99 117.16 116.61 1xob n TYR 49 Ca 0.04 -1.83 -0.42 0.00 -0.16 0.00 0.00 57.90 55.53 1xob n TYR 49 Cb 0.26 -0.93 -0.03 0.00 -0.31 0.00 0.00 39.34 38.33 1xob n TYR 49 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1xob s GLN 50 N -3.14 4.14 0.00 -0.72 0.74 -0.21 -0.37 119.66 120.10 1xob s GLN 50 Ca 0.54 2.61 0.00 0.00 0.05 0.00 0.00 55.36 58.56 1xob s GLN 50 Cb 0.45 -4.08 0.00 0.00 1.10 0.00 0.00 33.01 30.49 1xob s GLN 50 CO 0.10 -0.94 0.00 0.41 -0.55 0.00 0.00 175.29 174.31 1xob n GLY 51 N 4.49 0.81 0.17 2.59 0.00 -1.26 -4.81 105.19 107.18 1xob n GLY 51 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.33 0.19 -4.26 1.61 5.02 0.50 -5.02 118.16 113.87 1xob n LYS 52 Ca 0.00 0.05 -0.20 0.00 -2.02 0.00 0.00 58.31 56.14 1xob n LYS 52 Cb 0.00 -1.09 -0.16 0.00 -0.02 0.00 0.00 35.03 33.76 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 -5.64 1.50 -0.66 -0.35 2.96 0.14 -4.71 118.68 111.91 1xob s LEU 53 Ca -0.11 -0.16 -0.23 0.00 -0.22 0.00 0.00 54.13 53.41 1xob s LEU 53 Cb 0.03 -0.50 0.06 0.00 0.50 0.00 0.00 46.19 46.28 1xob s LEU 53 CO 0.17 -0.01 1.01 -0.89 -1.32 0.00 0.00 176.35 175.31 1xob s THR 54 N 0.68 4.24 -0.11 3.68 2.01 -0.05 -4.65 115.64 121.44 1xob s THR 54 Ca -0.10 -0.22 -0.30 0.00 0.31 0.00 0.00 61.69 61.39 1xob s THR 54 Cb -0.13 -4.71 -0.01 0.00 0.01 0.00 0.00 72.50 67.66 1xob s THR 54 CO 0.01 -1.49 1.04 -0.69 -0.69 0.00 0.00 174.62 172.79 1xob s VAL 55 N 4.29 4.70 0.08 3.82 1.01 -1.26 -0.63 120.40 132.40 1xob s VAL 55 Ca 0.24 1.97 0.05 0.00 0.00 0.00 0.00 61.98 64.24 1xob s VAL 55 Cb -0.15 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1xob s VAL 55 CO 0.11 -0.01 -0.12 0.00 0.00 0.00 0.00 175.10 175.08 1xob s ALA 56 N 2.12 1.12 0.03 5.51 0.00 0.91 -1.07 121.76 130.38 1xob s ALA 56 Ca 0.49 -1.05 0.06 0.00 0.00 0.00 0.00 51.96 51.47 1xob s ALA 56 Cb -0.19 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 1xob s ALA 56 CO 0.18 0.09 -0.17 0.15 0.00 0.00 0.00 175.76 176.01 1xob s LYS 57 N -2.06 1.22 -0.18 0.00 1.02 0.11 -0.63 119.74 119.22 1xob s LYS 57 Ca -0.00 -0.78 -0.02 0.00 0.02 0.00 0.00 55.97 55.19 1xob s LYS 57 Cb -0.08 -1.25 0.06 0.00 -0.52 0.00 0.00 37.83 36.03 1xob s LYS 57 CO 0.02 0.32 0.02 -1.17 -0.92 0.00 0.00 175.35 173.62 1xob s LEU 58 N -0.94 1.28 -0.47 3.17 0.20 0.48 -0.00 118.68 122.41 1xob s LEU 58 Ca 0.05 -0.77 -0.29 0.00 0.69 0.00 0.00 54.13 53.81 1xob s LEU 58 Cb -0.08 -0.66 0.03 0.00 -0.43 0.00 0.00 46.19 45.05 1xob s LEU 58 CO 0.01 -0.28 1.18 0.21 -0.29 0.00 0.00 176.35 177.18 1xob s ASN 59 N 1.81 6.59 0.47 3.68 3.84 -1.26 -0.63 114.94 129.45 1xob s ASN 59 Ca -0.01 0.52 0.26 0.00 0.21 0.00 0.00 52.86 53.85 1xob s ASN 59 Cb -0.17 -2.55 1.03 0.00 -0.55 0.00 0.00 41.25 39.01 1xob s ASN 59 CO -0.07 -1.28 1.86 0.16 -2.79 0.00 0.00 177.10 174.98 1xob h ILE 60 N 6.26 0.40 -0.38 -5.21 3.07 -0.97 -1.19 117.51 119.48 1xob h ILE 60 Ca -0.24 -0.95 0.02 0.00 1.55 0.00 0.00 64.86 65.24 1xob h ILE 60 Cb 1.07 1.70 -0.03 0.00 -0.27 0.00 0.00 36.82 39.29 1xob h ILE 60 CO 1.12 0.16 0.22 0.44 -1.05 0.00 0.00 178.15 179.03 1xob h ASP 61 N 0.00 0.34 1.45 2.16 3.32 -1.91 -0.00 116.42 121.79 1xob h ASP 61 Ca -0.00 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 1xob h ASP 61 Cb 0.69 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 1xob h ASP 61 CO 0.02 0.25 -0.55 1.56 -1.72 0.00 0.00 179.24 178.80 1xob h GLN 62 N 0.44 0.00 -2.14 3.56 1.08 -1.92 -3.39 115.11 112.74 1xob h GLN 62 Ca 0.16 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.78 1xob h GLN 62 Cb 0.02 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 27.04 1xob h GLN 62 CO -0.08 0.51 -0.80 0.09 -0.95 0.00 0.00 178.83 177.59 1xob n ASN 63 N -3.22 2.66 0.13 1.46 3.02 -0.46 -4.98 115.26 113.88 1xob n ASN 63 Ca 0.02 -3.25 -0.14 0.00 -0.03 0.00 0.00 54.58 51.18 1xob n ASN 63 Cb 0.75 -0.64 -0.06 0.00 -0.61 0.00 0.00 39.78 39.22 1xob n ASN 63 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1xob h PRO 64 N 3.77 -0.56 -0.89 3.52 0.11 -1.22 -3.17 132.00 133.55 1xob h PRO 64 Ca 0.14 0.04 0.24 0.00 0.11 0.00 0.00 66.00 66.53 1xob h PRO 64 Cb 0.72 0.13 -0.17 0.00 0.11 0.00 0.00 31.00 31.79 1xob h PRO 64 CO 0.70 -0.37 0.02 0.41 -0.21 0.00 0.00 178.00 178.54 1xob n GLY 65 N -1.43 -1.21 0.39 -0.55 0.00 -1.26 -0.35 105.19 100.77 1xob n GLY 65 Ca -0.07 0.87 0.17 0.00 0.00 0.00 0.00 46.02 47.00 1xob n GLY 65 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xob h THR 66 N 0.00 0.73 0.10 2.61 2.02 -1.94 -2.12 112.91 114.31 1xob h THR 66 Ca 0.54 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.57 1xob h THR 66 Cb 1.11 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1xob h THR 66 CO -0.84 0.07 -0.07 0.00 0.37 0.00 0.00 175.52 175.06 1xob h ALA 67 N 1.62 -0.89 -0.85 6.16 0.00 -0.87 -1.09 119.26 123.35 1xob h ALA 67 Ca 0.42 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.33 1xob h ALA 67 Cb 1.02 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 1xob h ALA 67 CO -0.15 -0.89 0.56 -1.00 0.00 0.00 0.00 179.25 177.77 1xob h PRO 68 N -0.16 1.04 -1.00 0.00 0.13 -1.71 0.45 132.00 130.74 1xob h PRO 68 Ca -0.01 -0.06 0.17 0.00 -0.87 0.00 0.00 66.00 65.22 1xob h PRO 68 Cb 0.13 -0.23 -0.10 0.00 0.13 0.00 0.00 31.00 30.93 1xob h PRO 68 CO 0.01 0.69 0.62 0.87 -0.23 0.00 0.00 178.00 179.95 1xob h LYS 69 N 1.07 0.81 -0.45 0.86 1.57 -1.25 0.07 116.57 119.25 1xob h LYS 69 Ca 0.33 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1xob h LYS 69 Cb 0.01 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.13 1xob h LYS 69 CO -0.10 0.54 0.00 0.66 -0.57 0.00 0.00 179.45 179.98 1xob n TYR 70 N -4.72 1.58 -3.80 -1.35 4.01 -0.42 -4.96 117.16 107.49 1xob n TYR 70 Ca 0.22 -0.78 -0.29 0.00 -0.16 0.00 0.00 57.90 56.89 1xob n TYR 70 Cb 0.51 -0.41 0.02 0.00 -0.31 0.00 0.00 39.34 39.14 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 0.21 -0.50 3.68 2.72 0.00 0.01 -4.87 105.19 106.44 1xob n GLY 71 Ca 0.25 0.17 -0.46 0.00 0.00 0.00 0.00 46.02 45.98 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 -4.55 0.51 -0.01 -0.61 -0.00 0.03 -4.88 119.36 109.84 1xob n ILE 72 Ca 0.03 -0.09 -0.17 0.00 -0.00 0.00 0.00 62.75 62.52 1xob n ILE 72 Cb 0.53 -1.97 -0.14 0.00 -0.00 0.00 0.00 39.64 38.07 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 8.95 0.15 -1.55 0.38 2.47 -1.90 -3.45 114.38 119.43 1xob h ARG 73 Ca -0.48 -0.26 0.08 0.00 -1.26 0.00 0.00 59.98 58.06 1xob h ARG 73 Cb 1.25 0.09 -0.24 0.00 -1.65 0.00 0.00 29.97 29.42 1xob h ARG 73 CO 0.94 1.12 0.53 0.20 0.56 0.00 0.00 179.97 183.31 1xob s GLY 74 N -4.31 -0.20 0.21 0.04 0.00 -1.26 -5.18 107.32 96.63 1xob s GLY 74 Ca -0.16 2.32 -0.08 0.00 0.00 0.00 0.00 44.72 46.79 1xob s GLY 74 CO 0.76 1.35 0.51 -0.26 0.00 0.00 0.00 173.10 175.46 1xob s ILE 75 N -0.59 4.99 0.23 0.90 -5.25 -1.26 -3.92 121.20 116.31 1xob s ILE 75 Ca 0.00 0.34 -0.30 0.00 -0.99 0.00 0.00 60.65 59.71 1xob s ILE 75 Cb -0.02 -3.63 -0.09 0.00 2.95 0.00 0.00 42.46 41.67 1xob s ILE 75 CO -0.02 -0.06 1.24 -2.16 -1.79 0.00 0.00 174.94 172.15 1xob s PRO 76 N -2.83 4.46 -0.23 0.37 0.04 -1.26 -4.82 135.00 130.73 1xob s PRO 76 Ca 0.46 1.98 0.02 0.00 0.04 0.00 0.00 61.00 63.50 1xob s PRO 76 Cb -0.11 -3.19 0.05 0.00 0.04 0.00 0.00 34.50 31.29 1xob s PRO 76 CO 0.23 -0.11 -0.13 0.99 0.04 0.00 0.00 177.00 178.01 1xob s THR 77 N -0.37 2.06 -0.56 1.26 2.01 -0.17 -0.45 115.64 119.41 1xob s THR 77 Ca 0.52 -1.35 -0.18 0.00 0.31 0.00 0.00 61.69 60.99 1xob s THR 77 Cb -0.35 -2.08 0.10 0.00 0.01 0.00 0.00 72.50 70.18 1xob s THR 77 CO 0.41 0.16 0.64 -0.76 -0.69 0.00 0.00 174.62 174.37 1xob s LEU 78 N 1.20 5.48 -0.40 4.42 1.43 0.80 -0.39 118.68 131.22 1xob s LEU 78 Ca -0.04 -1.41 -0.20 0.00 -1.03 0.00 0.00 54.13 51.45 1xob s LEU 78 Cb -0.17 -2.30 0.01 0.00 0.03 0.00 0.00 46.19 43.76 1xob s LEU 78 CO -0.08 -1.01 0.58 -0.76 0.23 0.00 0.00 176.35 175.32 1xob s LEU 79 N 2.43 4.47 -0.51 1.79 2.01 0.36 -0.80 118.68 128.43 1xob s LEU 79 Ca 0.10 -0.23 -0.20 0.00 0.01 0.00 0.00 54.13 53.81 1xob s LEU 79 Cb -0.24 -2.66 0.05 0.00 0.01 0.00 0.00 46.19 43.35 1xob s LEU 79 CO 0.07 -0.65 0.68 -0.22 1.01 0.00 0.00 176.35 177.24 1xob s LEU 80 N 2.61 4.80 0.06 1.79 2.96 0.24 -0.41 118.68 130.73 1xob s LEU 80 Ca 0.20 -0.80 -0.11 0.00 -0.22 0.00 0.00 54.13 53.20 1xob s LEU 80 Cb -0.15 -2.52 -0.06 0.00 0.50 0.00 0.00 46.19 43.96 1xob s LEU 80 CO 0.16 -0.95 0.41 -0.36 -1.32 0.00 0.00 176.35 174.29 1xob s PHE 81 N 2.87 3.62 -0.05 5.38 0.40 0.66 0.24 117.98 131.10 1xob s PHE 81 Ca 0.18 0.85 -0.01 0.00 -0.60 0.00 0.00 56.93 57.35 1xob s PHE 81 Cb -0.18 -2.20 0.03 0.00 0.51 0.00 0.00 43.02 41.18 1xob s PHE 81 CO 0.13 0.55 0.03 0.15 0.70 0.00 0.00 175.22 176.78 1xob s LYS 82 N -1.68 0.23 -1.41 0.44 1.02 0.54 -0.40 119.74 118.49 1xob s LYS 82 Ca 0.30 0.22 -0.02 0.00 0.02 0.00 0.00 55.97 56.50 1xob s LYS 82 Cb -0.15 -0.66 0.02 0.00 -0.52 0.00 0.00 37.83 36.52 1xob s LYS 82 CO 0.17 -0.28 0.57 0.09 -0.92 0.00 0.00 175.35 174.97 1xob n ASN 83 N 5.02 -1.09 0.00 2.83 3.02 0.04 -1.03 115.26 124.04 1xob n ASN 83 Ca -0.09 -0.94 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 1xob n ASN 83 Cb 0.50 -3.39 0.00 0.00 -0.61 0.00 0.00 39.78 36.29 1xob n ASN 83 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xob n GLY 84 N -1.80 1.22 3.68 7.41 0.00 -1.13 -4.89 105.19 109.68 1xob n GLY 84 Ca -0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.19 3.15 -0.33 1.61 2.02 -0.20 -4.72 118.70 120.05 1xob s GLU 85 Ca 0.00 -0.39 -0.28 0.00 0.02 0.00 0.00 54.97 54.32 1xob s GLU 85 Cb 0.00 -2.87 -0.02 0.00 0.10 0.00 0.00 34.13 31.34 1xob s GLU 85 CO 0.00 0.64 1.89 0.08 0.02 0.00 0.00 175.26 177.89 1xob s VAL 86 N -0.71 3.38 -0.03 2.63 1.01 -1.26 -0.34 120.40 125.08 1xob s VAL 86 Ca 0.11 0.38 -0.21 0.00 0.00 0.00 0.00 61.98 62.26 1xob s VAL 86 Cb -0.12 -3.54 -0.32 0.00 0.00 0.00 0.00 36.38 32.41 1xob s VAL 86 CO 0.02 -0.36 0.93 0.00 0.00 0.00 0.00 175.10 175.69 1xob h ALA 87 N 13.50 -0.10 -2.79 5.51 0.00 -0.53 -3.48 119.26 131.38 1xob h ALA 87 Ca -0.34 -0.72 -0.08 0.00 0.00 0.00 0.00 54.91 53.77 1xob h ALA 87 Cb 1.18 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.98 1xob h ALA 87 CO 1.03 0.44 -0.17 0.00 0.00 0.00 0.00 179.25 180.54 1xob s ALA 88 N -2.51 -0.13 -0.15 0.00 0.00 -0.92 -5.03 121.76 113.02 1xob s ALA 88 Ca -0.13 -0.92 -0.13 0.00 0.00 0.00 0.00 51.96 50.78 1xob s ALA 88 Cb 0.02 1.07 0.04 0.00 0.00 0.00 0.00 23.12 24.25 1xob s ALA 88 CO 0.85 -0.81 0.40 0.99 0.00 0.00 0.00 175.76 177.19 1xob s THR 89 N -4.02 -0.00 -0.02 0.00 2.01 -1.26 -0.59 115.64 111.75 1xob s THR 89 Ca 0.23 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.26 1xob s THR 89 Cb 0.00 -0.56 -0.00 0.00 0.01 0.00 0.00 72.50 71.96 1xob s THR 89 CO 0.08 0.00 -0.10 -0.75 -0.69 0.00 0.00 174.62 173.16 1xob s LYS 90 N 0.29 1.01 -0.21 4.92 2.47 0.02 -5.00 119.74 123.24 1xob s LYS 90 Ca -0.01 -0.36 -0.04 0.00 -1.56 0.00 0.00 55.97 54.01 1xob s LYS 90 Cb -0.03 -0.95 -0.01 0.00 -1.46 0.00 0.00 37.83 35.38 1xob s LYS 90 CO -0.00 0.16 -0.03 0.08 0.16 0.00 0.00 175.35 175.71 1xob s VAL 91 N 0.04 3.54 0.00 4.02 1.01 -1.26 -0.14 120.40 127.61 1xob s VAL 91 Ca -0.01 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.53 1xob s VAL 91 Cb -0.07 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.70 1xob s VAL 91 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.14 1xob n GLY 92 N 4.53 0.42 3.66 4.51 0.00 0.40 -5.02 105.19 113.70 1xob n GLY 92 Ca -0.18 -1.89 -0.29 0.00 0.00 0.00 0.00 46.02 43.66 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 -1.82 0.85 0.09 4.61 0.00 -1.26 -4.82 121.76 119.41 1xob s ALA 93 Ca 0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 51.96 51.50 1xob s ALA 93 Cb 0.00 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.00 1xob s ALA 93 CO 0.00 -2.97 0.03 -0.51 0.00 0.00 0.00 175.76 172.31 1xob s LEU 94 N -6.54 2.09 0.59 0.00 1.43 -1.26 -5.11 118.68 109.89 1xob s LEU 94 Ca 0.66 -1.07 -0.08 0.00 -1.03 0.00 0.00 54.13 52.61 1xob s LEU 94 Cb -0.18 0.31 -0.02 0.00 0.03 0.00 0.00 46.19 46.34 1xob s LEU 94 CO 0.57 -0.67 0.94 -0.94 0.23 0.00 0.00 176.35 176.49 1xob s SER 95 N -2.97 5.92 0.21 2.29 1.04 -1.26 -4.87 113.70 114.05 1xob s SER 95 Ca 0.14 1.04 -0.10 0.00 0.48 0.00 0.00 55.95 57.52 1xob s SER 95 Cb 0.07 -2.10 0.22 0.00 0.10 0.00 0.00 66.02 64.31 1xob s SER 95 CO -0.05 -0.93 1.81 0.50 0.98 0.00 0.00 173.24 175.55 1xob h LYS 96 N -0.20 0.67 0.60 4.02 3.64 -1.99 0.34 116.57 123.65 1xob h LYS 96 Ca -0.45 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 58.86 1xob h LYS 96 Cb 1.22 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 1xob h LYS 96 CO 0.62 0.44 -0.39 0.78 -2.27 0.00 0.00 179.45 178.64 1xob h GLY 97 N 0.69 -1.03 1.15 5.01 0.00 -1.99 0.11 103.07 107.01 1xob h GLY 97 Ca 0.29 0.43 0.00 0.00 0.00 0.00 0.00 47.33 48.05 1xob h GLY 97 CO -0.17 -0.36 0.55 1.46 0.00 0.00 0.00 176.54 178.02 1xob h GLN 98 N -0.94 1.14 -0.05 4.80 7.50 -1.90 -0.23 115.11 125.44 1xob h GLN 98 Ca -0.07 -0.08 -0.00 0.00 0.50 0.00 0.00 58.65 58.99 1xob h GLN 98 Cb 0.77 -0.25 -0.00 0.00 0.05 0.00 0.00 27.48 28.04 1xob h GLN 98 CO 0.06 0.77 0.01 1.25 -1.50 0.00 0.00 178.83 179.43 1xob h LEU 99 N 1.17 0.07 -0.38 1.46 5.85 -0.75 0.83 115.31 123.56 1xob h LEU 99 Ca 0.31 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.90 1xob h LEU 99 Cb -0.10 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 40.84 1xob h LEU 99 CO -0.06 0.26 -0.08 0.11 -0.34 0.00 0.00 178.44 178.32 1xob h LYS 100 N -0.13 0.01 0.20 1.25 1.79 -0.33 0.50 116.57 119.87 1xob h LYS 100 Ca 0.01 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.49 1xob h LYS 100 Cb 0.22 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.84 1xob h LYS 100 CO -0.00 0.01 -0.27 0.93 -1.08 0.00 0.00 179.45 179.04 1xob h GLU 101 N 0.01 -0.51 -0.15 3.15 5.08 -0.85 0.13 114.58 121.44 1xob h GLU 101 Ca 0.18 0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.63 1xob h GLU 101 Cb 0.28 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.58 1xob h GLU 101 CO -0.38 -0.34 -0.24 0.35 -1.00 0.00 0.00 179.01 177.40 1xob h PHE 102 N -0.53 -0.64 0.20 4.33 3.57 -0.34 0.75 116.94 124.28 1xob h PHE 102 Ca 0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1xob h PHE 102 Cb 0.52 0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.57 1xob h PHE 102 CO -0.21 -0.32 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.39 1xob h LEU 103 N -0.29 -0.22 -0.35 0.59 3.38 -0.79 -2.38 115.31 115.24 1xob h LEU 103 Ca 0.11 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.08 1xob h LEU 103 Cb 0.45 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.19 1xob h LEU 103 CO -0.32 -0.07 -0.14 -0.78 0.09 0.00 0.00 178.44 177.22 1xob h ASP 104 N -0.36 -0.48 -0.83 -0.43 3.58 -0.48 0.16 116.42 117.58 1xob h ASP 104 Ca -0.03 0.12 0.11 0.00 0.42 0.00 0.00 57.03 57.66 1xob h ASP 104 Cb 0.28 0.28 -0.06 0.00 1.72 0.00 0.00 39.33 41.55 1xob h ASP 104 CO 0.04 -0.17 0.54 0.00 -2.88 0.00 0.00 179.24 176.77 1xob h ALA 105 N 1.23 1.79 0.08 -0.78 0.00 -0.76 0.10 119.26 120.92 1xob h ALA 105 Ca 0.18 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 1xob h ALA 105 Cb 0.34 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.99 1xob h ALA 105 CO -0.40 0.02 -0.64 -0.91 0.00 0.00 0.00 179.25 177.32 1xob h ASN 106 N 0.71 0.42 -0.32 0.00 2.35 -0.66 -3.30 115.58 114.78 1xob h ASN 106 Ca 0.39 -0.89 0.02 0.00 -0.55 0.00 0.00 56.30 55.28 1xob h ASN 106 Cb 0.55 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.76 1xob h ASN 106 CO -0.16 1.28 0.15 -0.07 -1.65 0.00 0.00 177.43 176.98 1xob h LEU 107 N -0.37 0.22 0.00 1.61 3.38 -0.36 -3.52 115.31 116.27 1xob h LEU 107 Ca -0.10 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xob h LEU 107 Cb 1.44 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.17 1xob h LEU 107 CO 0.12 0.17 0.00 0.00 0.09 0.00 0.00 178.44 178.82