#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aqc n SER -1 N 0.00 1.76 0.00 1.61 7.64 -1.26 -4.67 113.62 118.70 2aqc n SER -1 Ca 0.00 -3.72 0.00 0.00 1.01 0.00 0.00 58.87 56.16 2aqc n SER -1 Cb 0.00 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2aqc n SER -1 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2aqc n HIS 0 N -1.10 0.00 0.25 1.43 -0.00 -1.26 -4.74 115.22 109.80 2aqc n HIS 0 Ca 0.18 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.99 2aqc n HIS 0 Cb 0.70 0.04 0.62 0.00 -0.00 0.00 0.00 29.99 31.35 2aqc n HIS 0 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.34 176.86 2aqc h MET 1 N 0.00 0.00 -7.08 -0.41 0.00 -2.06 -3.44 114.93 101.94 2aqc h MET 1 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 59.70 59.22 2aqc h MET 1 Cb 0.75 0.00 0.08 0.00 0.00 0.00 0.00 31.60 32.43 2aqc h MET 1 CO 0.00 0.13 0.10 0.14 0.00 0.00 0.00 176.91 177.28 2aqc s VAL 2 N -4.53 2.00 -1.84 -2.22 -7.23 -1.26 -4.45 120.40 100.87 2aqc s VAL 2 Ca -0.04 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 2aqc s VAL 2 Cb 0.15 -2.34 0.00 0.00 0.56 0.00 0.00 36.38 34.75 2aqc s VAL 2 CO 0.65 0.00 0.00 -0.62 -0.31 0.00 0.00 175.10 174.82 2aqc n GLU 3 N -2.84 -1.65 0.23 4.82 1.02 -1.26 -4.83 120.64 116.12 2aqc n GLU 3 Ca 0.17 1.04 0.18 0.00 -0.02 0.00 0.00 57.16 58.53 2aqc n GLU 3 Cb 0.61 -5.68 0.86 0.00 -0.02 0.00 0.00 31.44 27.21 2aqc n GLU 3 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2aqc h MET 4 N 0.00 0.00 -0.11 3.49 2.86 -1.86 -0.08 114.93 119.24 2aqc h MET 4 Ca -0.49 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.18 2aqc h MET 4 Cb 1.37 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.02 2aqc h MET 4 CO 0.59 0.00 0.15 0.07 1.06 0.00 0.00 176.91 178.78 2aqc h ARG 5 N 0.00 0.00 0.00 1.72 0.11 -1.97 -3.42 114.38 110.82 2aqc h ARG 5 Ca 0.07 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.10 2aqc h ARG 5 Cb 0.48 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.58 2aqc h ARG 5 CO -0.00 0.00 0.03 0.00 0.10 0.00 0.00 179.97 180.10 2aqc n MET 6 N -3.63 -0.91 -4.46 0.08 0.00 -0.04 -5.09 117.12 103.05 2aqc n MET 6 Ca -0.00 -0.23 -0.24 0.00 0.00 0.00 0.00 57.70 57.22 2aqc n MET 6 Cb 0.25 -0.19 -0.08 0.00 0.00 0.00 0.00 33.22 33.20 2aqc n MET 6 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 2aqc s LYS 7 N -3.33 1.90 -0.00 3.17 -2.85 -0.53 -4.78 119.74 113.32 2aqc s LYS 7 Ca 0.09 -2.15 -0.06 0.00 -1.00 0.00 0.00 55.97 52.85 2aqc s LYS 7 Cb -0.01 -0.38 0.00 0.00 -2.06 0.00 0.00 37.83 35.38 2aqc s LYS 7 CO 0.07 -0.53 0.12 0.21 0.10 0.00 0.00 175.35 175.31 2aqc s LYS 8 N -3.64 0.43 -0.22 1.78 2.20 0.81 -1.30 119.74 119.80 2aqc s LYS 8 Ca 0.27 -0.37 -0.29 0.00 -0.36 0.00 0.00 55.97 55.22 2aqc s LYS 8 Cb 0.02 0.18 -0.02 0.00 -1.51 0.00 0.00 37.83 36.50 2aqc s LYS 8 CO 0.17 -0.10 1.43 0.00 -0.36 0.00 0.00 175.35 176.50 2aqc n PRO 10 N 7.26 0.19 -0.10 0.00 -0.04 -1.26 0.07 135.00 141.12 2aqc n PRO 10 Ca 0.16 0.16 -0.23 0.00 -0.04 0.00 0.00 63.50 63.54 2aqc n PRO 10 Cb 0.45 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.30 2aqc n PRO 10 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2aqc n LYS 11 N -1.30 0.63 -0.06 0.54 4.01 -1.26 -4.82 118.16 115.90 2aqc n LYS 11 Ca 0.07 0.34 -0.11 0.00 -0.51 0.00 0.00 58.31 58.09 2aqc n LYS 11 Cb 0.12 -1.62 -0.04 0.00 -0.51 0.00 0.00 35.03 32.98 2aqc n LYS 11 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2aqc n GLY 13 N 2.02 1.98 3.76 0.00 0.00 0.11 -5.01 105.19 108.06 2aqc n GLY 13 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 2aqc n GLY 13 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2aqc s LEU 14 N 0.00 4.32 0.24 0.99 2.96 -1.26 -4.74 118.68 121.20 2aqc s LEU 14 Ca 0.00 0.73 -0.21 0.00 -0.22 0.00 0.00 54.13 54.43 2aqc s LEU 14 Cb 0.00 -2.52 -0.09 0.00 0.50 0.00 0.00 46.19 44.08 2aqc s LEU 14 CO 0.00 0.14 0.77 -0.31 -1.32 0.00 0.00 176.35 175.63 2aqc s TYR 15 N 0.03 3.66 0.02 5.38 2.02 -1.26 -1.27 117.35 125.92 2aqc s TYR 15 Ca 0.21 1.47 -0.28 0.00 -0.37 0.00 0.00 57.07 58.11 2aqc s TYR 15 Cb -0.15 -2.68 0.10 0.00 -0.40 0.00 0.00 41.96 38.83 2aqc s TYR 15 CO 0.08 0.31 1.24 -0.08 -1.57 0.00 0.00 175.55 175.54 2aqc s THR 16 N -1.54 0.00 0.00 -0.71 -1.32 -0.42 -4.99 115.64 106.66 2aqc s THR 16 Ca 0.44 -0.26 0.00 0.00 -1.21 0.00 0.00 61.69 60.66 2aqc s THR 16 Cb -0.17 -2.50 0.00 0.00 -1.51 0.00 0.00 72.50 68.31 2aqc s THR 16 CO 0.22 0.00 0.51 0.18 -2.21 0.00 0.00 174.62 173.32 2aqc n LEU 17 N -0.69 0.94 0.00 9.08 4.77 -1.26 -1.45 117.00 128.40 2aqc n LEU 17 Ca -0.03 -0.94 0.15 0.00 -0.03 0.00 0.00 56.01 55.16 2aqc n LEU 17 Cb 0.61 0.00 0.86 0.00 -2.33 0.00 0.00 43.42 42.56 2aqc n LEU 17 CO 0.15 0.24 1.05 0.29 -1.33 0.00 0.00 177.39 177.78 2aqc n LYS 18 N -0.10 0.82 -0.93 3.23 4.76 -1.26 -4.86 118.16 119.82 2aqc n LYS 18 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2aqc n LYS 18 Cb 0.14 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.83 2aqc n LYS 18 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2aqc n GLU 19 N -1.07 -1.17 -3.87 1.97 1.02 -1.26 -4.93 120.64 111.32 2aqc n GLU 19 Ca 0.21 0.29 -0.11 0.00 -0.02 0.00 0.00 57.16 57.53 2aqc n GLU 19 Cb 0.14 -4.37 -0.11 0.00 -0.02 0.00 0.00 31.44 27.08 2aqc n GLU 19 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2aqc s ILE 20 N -1.37 0.05 -0.42 -3.67 -1.09 -1.26 -1.69 121.20 111.75 2aqc s ILE 20 Ca 0.00 -0.42 -0.24 0.00 -2.23 0.00 0.00 60.65 57.76 2aqc s ILE 20 Cb 0.00 -0.30 0.02 0.00 -1.58 0.00 0.00 42.46 40.60 2aqc s ILE 20 CO 0.00 -0.23 0.84 0.00 -1.23 0.00 0.00 174.94 174.32 2aqc n PRO 22 N 6.77 0.19 -0.05 0.00 -0.04 -1.26 0.52 135.00 141.14 2aqc n PRO 22 Ca 0.04 0.16 -0.02 0.00 -0.04 0.00 0.00 63.50 63.64 2aqc n PRO 22 Cb 0.48 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.44 2aqc n PRO 22 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2aqc h LYS 23 N 0.00 0.00 0.00 0.54 1.63 -1.97 -3.43 116.57 113.35 2aqc h LYS 23 Ca 0.00 0.00 -0.38 0.00 -0.85 0.00 0.00 60.65 59.42 2aqc h LYS 23 Cb 0.15 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 31.71 2aqc h LYS 23 CO 0.00 0.00 -2.44 0.00 -3.45 0.00 0.00 179.45 173.56 2aqc n GLY 25 N 2.06 1.96 3.59 0.00 0.00 0.19 -5.05 105.19 107.94 2aqc n GLY 25 Ca -0.41 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 2aqc n GLY 25 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2aqc s GLU 26 N -0.70 2.86 0.31 1.61 2.56 -1.24 -4.76 118.70 119.35 2aqc s GLU 26 Ca 0.00 -0.52 -0.27 0.00 0.00 0.00 0.00 54.97 54.17 2aqc s GLU 26 Cb 0.00 -2.65 -0.13 0.00 2.00 0.00 0.00 34.13 33.35 2aqc s GLU 26 CO 0.00 0.63 1.03 1.17 -0.56 0.00 0.00 175.26 177.53 2aqc n LYS 27 N 2.32 1.42 -3.21 4.30 4.81 -1.26 -0.69 118.16 125.84 2aqc n LYS 27 Ca -0.18 0.50 -0.26 0.00 -0.87 0.00 0.00 58.31 57.50 2aqc n LYS 27 Cb 0.53 -1.91 -0.01 0.00 0.02 0.00 0.00 35.03 33.66 2aqc n LYS 27 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2aqc s THR 28 N -1.10 5.04 0.10 3.15 -4.23 -0.68 -4.59 115.64 113.34 2aqc s THR 28 Ca 0.59 -0.19 0.02 0.00 -1.18 0.00 0.00 61.69 60.92 2aqc s THR 28 Cb -0.67 -3.83 -0.04 0.00 1.34 0.00 0.00 72.50 69.30 2aqc s THR 28 CO 0.60 -0.56 -0.06 0.68 -0.54 0.00 0.00 174.62 174.74 2aqc s VAL 29 N -2.35 0.67 -0.20 2.29 -7.23 0.91 -4.83 120.40 109.66 2aqc s VAL 29 Ca 0.42 -1.93 -0.29 0.00 -1.81 0.00 0.00 61.98 58.37 2aqc s VAL 29 Cb -0.10 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.10 2aqc s VAL 29 CO 0.36 -0.86 1.89 -0.63 -0.31 0.00 0.00 175.10 175.56 2aqc s ILE 30 N -3.64 3.33 -0.99 -0.62 -1.09 -1.26 -0.13 121.20 116.80 2aqc s ILE 30 Ca 0.12 0.36 0.15 0.00 -2.23 0.00 0.00 60.65 59.05 2aqc s ILE 30 Cb 0.05 -3.37 0.12 0.00 -1.58 0.00 0.00 42.46 37.69 2aqc s ILE 30 CO -0.04 -0.18 1.46 -0.81 -1.23 0.00 0.00 174.94 174.14 2aqc n PRO 31 N 8.12 0.01 -3.52 2.79 -0.04 -1.26 -3.92 135.00 137.17 2aqc n PRO 31 Ca 0.23 0.26 -0.33 0.00 -0.04 0.00 0.00 63.50 63.62 2aqc n PRO 31 Cb 0.45 -1.51 -0.07 0.00 -0.04 0.00 0.00 33.50 32.33 2aqc n PRO 31 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2aqc n LYS 32 N -1.52 2.78 -1.18 0.54 2.85 -1.26 -5.08 118.16 115.29 2aqc n LYS 32 Ca 0.03 -4.55 -0.29 0.00 -1.05 0.00 0.00 58.31 52.45 2aqc n LYS 32 Cb 0.17 -2.37 0.16 0.00 -0.65 0.00 0.00 35.03 32.35 2aqc n LYS 32 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2aqc s PRO 33 N -1.94 0.74 0.29 -1.58 0.04 -1.25 -5.06 135.00 126.24 2aqc s PRO 33 Ca 0.31 0.64 -0.05 0.00 0.04 0.00 0.00 61.00 61.95 2aqc s PRO 33 Cb 0.02 -1.76 0.07 0.00 0.04 0.00 0.00 34.50 32.87 2aqc s PRO 33 CO -0.06 -2.55 0.26 -0.35 0.04 0.00 0.00 177.00 174.33 2aqc n PRO 34 N -4.07 -1.53 -1.44 0.56 -0.04 -1.26 -5.03 135.00 122.19 2aqc n PRO 34 Ca 0.06 -0.42 -0.29 0.00 -0.04 0.00 0.00 63.50 62.81 2aqc n PRO 34 Cb 0.56 -0.39 0.19 0.00 -0.04 0.00 0.00 33.50 33.82 2aqc n PRO 34 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2aqc s LYS 35 N -3.59 0.15 -1.45 0.54 -0.14 -1.26 -4.13 119.74 109.87 2aqc s LYS 35 Ca 0.17 0.03 -0.09 0.00 -1.36 0.00 0.00 55.97 54.72 2aqc s LYS 35 Cb -0.02 -1.75 0.05 0.00 -1.68 0.00 0.00 37.83 34.44 2aqc s LYS 35 CO 0.13 -2.82 0.92 0.34 -0.76 0.00 0.00 175.35 173.16 2aqc n PHE 36 N -4.14 -2.24 -3.45 3.18 7.35 -1.26 -4.96 117.46 111.94 2aqc n PHE 36 Ca 0.11 0.90 -0.32 0.00 -0.76 0.00 0.00 57.45 57.37 2aqc n PHE 36 Cb 0.59 -4.22 -0.05 0.00 0.35 0.00 0.00 39.48 36.15 2aqc n PHE 36 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2aqc s SER 37 N -3.64 6.61 0.36 -2.13 0.01 -1.26 -4.99 113.70 108.66 2aqc s SER 37 Ca 0.45 0.88 0.17 0.00 1.31 0.00 0.00 55.95 58.76 2aqc s SER 37 Cb -0.22 -2.21 0.65 0.00 0.21 0.00 0.00 66.02 64.45 2aqc s SER 37 CO 0.81 -0.05 1.73 0.25 0.41 0.00 0.00 173.24 176.40 2aqc h LEU 38 N 2.61 0.00 -2.19 2.44 5.85 -1.95 -2.91 115.31 119.16 2aqc h LEU 38 Ca -0.47 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.31 2aqc h LEU 38 Cb 1.17 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 2aqc h LEU 38 CO 0.69 0.41 0.21 -0.33 -0.34 0.00 0.00 178.44 179.09 2aqc h GLU 39 N 0.00 0.00 -6.51 1.25 5.08 -2.00 -3.43 114.58 108.98 2aqc h GLU 39 Ca -0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.75 2aqc h GLU 39 Cb 0.89 0.00 0.09 0.00 0.50 0.00 0.00 28.75 30.23 2aqc h GLU 39 CO 0.05 0.00 0.41 -0.25 -1.00 0.00 0.00 179.01 178.23 2aqc n ASP 40 N -3.86 2.07 0.14 1.42 8.00 -1.10 -4.93 116.55 118.28 2aqc n ASP 40 Ca 0.02 1.16 -0.05 0.00 0.71 0.00 0.00 54.79 56.62 2aqc n ASP 40 Cb 0.34 -1.34 -0.03 0.00 -0.02 0.00 0.00 41.12 40.07 2aqc n ASP 40 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2aqc h ARG 41 N 3.40 -0.33 0.00 -1.24 3.08 -1.91 -3.35 114.38 114.03 2aqc h ARG 41 Ca -0.44 0.02 -0.13 0.00 0.07 0.00 0.00 59.98 59.51 2aqc h ARG 41 Cb 1.31 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.41 2aqc h ARG 41 CO 0.70 -0.22 -1.59 0.91 -1.07 0.00 0.00 179.97 178.70 2aqc n TRP 42 N -2.95 0.64 0.00 3.04 8.01 -1.26 -4.99 117.44 119.93 2aqc n TRP 42 Ca -0.04 0.21 0.00 0.00 -1.31 0.00 0.00 57.50 56.35 2aqc n TRP 42 Cb 0.14 -0.93 0.00 0.00 -2.01 0.00 0.00 31.31 28.51 2aqc n TRP 42 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2aqc n GLY 43 N 1.37 0.88 0.43 6.99 0.00 -1.26 -3.50 105.19 110.10 2aqc n GLY 43 Ca -0.10 0.47 0.23 0.00 0.00 0.00 0.00 46.02 46.62 2aqc n GLY 43 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2aqc h LYS 44 N 0.00 0.19 0.05 1.61 2.10 -1.95 0.14 116.57 118.70 2aqc h LYS 44 Ca 0.00 -0.01 -0.27 0.00 -2.00 0.00 0.00 60.65 58.37 2aqc h LYS 44 Cb 0.00 -0.04 -0.03 0.00 -0.90 0.00 0.00 32.23 31.26 2aqc h LYS 44 CO 0.00 0.12 -1.40 -0.92 -2.00 0.00 0.00 179.45 175.26 2aqc h TYR 45 N 0.19 0.18 0.00 0.07 5.03 -1.98 -3.30 116.97 117.17 2aqc h TYR 45 Ca 0.43 -0.13 -0.00 0.00 2.58 0.00 0.00 58.73 61.61 2aqc h TYR 45 Cb 1.39 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.66 2aqc h TYR 45 CO -0.00 1.15 -0.01 -0.09 -1.32 0.00 0.00 178.16 177.89 2aqc h ARG 46 N 0.03 0.00 -0.99 1.82 2.43 -0.99 -0.34 114.38 116.34 2aqc h ARG 46 Ca -0.18 0.00 0.18 0.00 -0.81 0.00 0.00 59.98 59.17 2aqc h ARG 46 Cb 1.93 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 31.39 2aqc h ARG 46 CO 0.13 0.01 0.61 -0.09 -1.51 0.00 0.00 179.97 179.12 2aqc h ARG 47 N 0.00 0.72 0.00 0.20 9.65 -1.51 0.05 114.38 123.50 2aqc h ARG 47 Ca -0.00 -0.04 -0.34 0.00 -1.10 0.00 0.00 59.98 58.49 2aqc h ARG 47 Cb 0.02 -0.16 -0.06 0.00 -1.39 0.00 0.00 29.97 28.38 2aqc h ARG 47 CO 0.00 0.48 -2.30 -1.33 2.80 0.00 0.00 179.97 179.62 2aqc n MET 48 N -4.69 0.88 0.28 0.20 2.81 -0.82 -4.34 117.12 111.45 2aqc n MET 48 Ca 0.22 0.02 0.13 0.00 -1.81 0.00 0.00 57.70 56.26 2aqc n MET 48 Cb 0.55 -1.48 0.82 0.00 -0.71 0.00 0.00 33.22 32.41 2aqc n MET 48 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2aqc h LEU 49 N 0.00 0.00-10.12 4.03 7.12 -0.74 -3.43 115.31 112.16 2aqc h LEU 49 Ca -0.51 0.00 -0.49 0.00 0.13 0.00 0.00 57.88 57.01 2aqc h LEU 49 Cb 2.09 0.00 0.21 0.00 -0.53 0.00 0.00 40.66 42.43 2aqc h LEU 49 CO 0.01 0.02 -0.04 2.29 -0.13 0.00 0.00 178.44 180.58 2aqc n LYS 50 N -4.00 -1.21 -4.63 1.25 -0.00 -0.02 -5.03 118.16 104.52 2aqc n LYS 50 Ca -0.03 -0.31 -0.26 0.00 -0.00 0.00 0.00 58.31 57.72 2aqc n LYS 50 Cb 0.11 -2.20 -0.17 0.00 -0.00 0.00 0.00 35.03 32.77 2aqc n LYS 50 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2aqc s ARG 51 N -4.36 1.92 -0.10 -1.58 1.70 -1.26 -5.00 118.95 110.27 2aqc s ARG 51 Ca 0.66 -0.48 0.08 0.00 -0.47 0.00 0.00 55.73 55.52 2aqc s ARG 51 Cb -0.23 -1.58 -0.12 0.00 -0.57 0.00 0.00 34.95 32.46 2aqc s ARG 51 CO 0.62 0.03 0.02 0.00 -1.08 0.00 0.00 175.30 174.89 2aqc n ALA 52 N 3.86 1.76 -1.68 7.88 0.00 -1.26 -4.99 120.51 126.08 2aqc n ALA 52 Ca -0.22 -0.63 -0.47 0.00 0.00 0.00 0.00 53.44 52.12 2aqc n ALA 52 Cb 0.52 0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 2aqc n ALA 52 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2aqc n LEU 53 N -2.39 3.52 -4.35 0.00 -0.00 -1.26 -4.97 117.00 107.56 2aqc n LEU 53 Ca -0.16 0.98 -0.33 0.00 -0.00 0.00 0.00 56.01 56.50 2aqc n LEU 53 Cb 0.81 -1.40 -0.15 0.00 -0.00 0.00 0.00 43.42 42.68 2aqc n LEU 53 CO 0.20 -0.04 -0.45 -0.54 -0.00 0.00 0.00 177.39 176.56 2aqc s LYS 54 N 3.68 3.35 0.86 1.96 1.02 -1.26 -5.12 119.74 124.24 2aqc s LYS 54 Ca 0.90 -0.70 -0.12 0.00 0.02 0.00 0.00 55.97 56.08 2aqc s LYS 54 Cb -0.65 -2.64 0.11 0.00 -0.52 0.00 0.00 37.83 34.12 2aqc s LYS 54 CO 0.48 0.16 1.10 -0.80 -0.92 0.00 0.00 175.35 175.38 2aqc s ASN 55 N 0.48 3.92 1.28 2.83 0.01 -1.26 -5.03 114.94 117.17 2aqc s ASN 55 Ca -0.09 1.25 -0.18 0.00 -0.71 0.00 0.00 52.86 53.13 2aqc s ASN 55 Cb -0.16 -1.94 0.30 0.00 0.41 0.00 0.00 41.25 39.87 2aqc s ASN 55 CO 0.04 -2.33 0.77 0.29 -1.51 0.00 0.00 177.10 174.37 2aqc n LYS 56 N -3.66 -3.38 -2.10 -0.60 5.02 -1.26 -4.86 118.16 107.33 2aqc n LYS 56 Ca 0.07 -0.98 -0.42 0.00 -2.02 0.00 0.00 58.31 54.95 2aqc n LYS 56 Cb 0.57 -1.94 -0.03 0.00 -0.02 0.00 0.00 35.03 33.61 2aqc n LYS 56 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2aqc s ASN 57 N -2.54 6.73 -0.37 4.39 0.01 -1.26 -4.98 114.94 116.91 2aqc s ASN 57 Ca 0.64 2.12 -0.12 0.00 -0.71 0.00 0.00 52.86 54.79 2aqc s ASN 57 Cb -0.17 -2.53 0.02 0.00 0.41 0.00 0.00 41.25 38.97 2aqc s ASN 57 CO 0.59 -0.89 0.23 -0.75 -1.51 0.00 0.00 177.10 174.77 2aqc s LYS 58 N 3.91 2.99 -0.05 -0.60 2.20 -1.26 -4.97 119.74 121.95 2aqc s LYS 58 Ca 0.69 -0.98 -0.25 0.00 -0.36 0.00 0.00 55.97 55.07 2aqc s LYS 58 Cb -0.31 -3.79 -0.21 0.00 -1.51 0.00 0.00 37.83 32.02 2aqc s LYS 58 CO 0.26 -0.66 1.07 0.00 -0.36 0.00 0.00 175.35 175.67 2aqc h ALA 59 N 8.48 -0.05 0.00 3.13 0.00 -2.05 -3.56 119.26 125.22 2aqc h ALA 59 Ca -0.27 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2aqc h ALA 59 Cb 1.12 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2aqc h ALA 59 CO 0.68 -0.21 0.00 -1.91 0.00 0.00 0.00 179.25 177.80