#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aqc s SER -1 N 0.00 -0.18 0.69 1.61 1.04 -1.26 -5.18 113.70 110.43 2aqc s SER -1 Ca 0.00 0.00 0.02 0.00 0.48 0.00 0.00 55.95 56.45 2aqc s SER -1 Cb 0.00 0.33 0.12 0.00 0.10 0.00 0.00 66.02 66.57 2aqc s SER -1 CO 0.00 -0.51 0.95 -1.00 0.98 0.00 0.00 173.24 173.66 2aqc s HIS 0 N -1.76 1.51 -0.12 5.02 0.09 -1.26 -5.07 115.29 113.70 2aqc s HIS 0 Ca -0.10 -0.39 -0.22 0.00 -0.00 0.00 0.00 55.06 54.34 2aqc s HIS 0 Cb -0.04 -2.82 -0.03 0.00 -0.00 0.00 0.00 32.58 29.69 2aqc s HIS 0 CO 0.02 -1.60 0.67 -1.64 -0.00 0.00 0.00 174.74 172.18 2aqc s MET 1 N -5.04 4.35 0.52 1.40 1.00 -1.26 -5.06 119.30 115.21 2aqc s MET 1 Ca 0.65 0.77 -0.13 0.00 0.00 0.00 0.00 55.69 56.98 2aqc s MET 1 Cb -0.05 -3.49 -0.06 0.00 0.00 0.00 0.00 34.83 31.22 2aqc s MET 1 CO 0.43 -0.04 0.94 0.14 0.00 0.00 0.00 175.02 176.49 2aqc s VAL 2 N 1.20 4.65 -0.03 -6.03 -7.23 -1.26 -5.00 120.40 106.69 2aqc s VAL 2 Ca 0.34 0.96 0.12 0.00 -1.81 0.00 0.00 61.98 61.59 2aqc s VAL 2 Cb -0.17 -3.77 -0.23 0.00 0.56 0.00 0.00 36.38 32.78 2aqc s VAL 2 CO 0.14 -0.77 0.72 -0.33 -0.31 0.00 0.00 175.10 174.55 2aqc h GLU 3 N 0.65 0.00 -6.60 4.82 5.08 -2.07 -3.47 114.58 112.99 2aqc h GLU 3 Ca -0.46 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.31 2aqc h GLU 3 Cb 1.19 0.00 0.09 0.00 0.50 0.00 0.00 28.75 30.53 2aqc h GLU 3 CO 0.62 0.53 0.48 -1.33 -1.00 0.00 0.00 179.01 178.31 2aqc n MET 4 N -3.07 1.88 -1.13 2.33 2.81 -1.26 -4.90 117.12 113.79 2aqc n MET 4 Ca -0.15 0.67 -0.35 0.00 -1.81 0.00 0.00 57.70 56.05 2aqc n MET 4 Cb 1.04 -2.24 0.09 0.00 -0.71 0.00 0.00 33.22 31.39 2aqc n MET 4 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 2aqc n ARG 5 N 1.37 0.14 -2.19 0.03 0.00 -1.26 -4.99 116.66 109.75 2aqc n ARG 5 Ca 0.09 0.09 0.00 0.00 -0.00 0.00 0.00 57.85 58.04 2aqc n ARG 5 Cb 0.32 -1.85 0.00 0.00 -0.00 0.00 0.00 32.46 30.93 2aqc n ARG 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2aqc n MET 6 N -1.06 0.07 -4.55 2.89 0.00 -1.26 -4.99 117.12 108.21 2aqc n MET 6 Ca 0.09 -0.20 -0.25 0.00 0.00 0.00 0.00 57.70 57.33 2aqc n MET 6 Cb 0.51 0.31 -0.11 0.00 0.00 0.00 0.00 33.22 33.93 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 -2.01 1.82 0.03 3.17 0.00 -0.50 -4.58 119.74 117.67 2aqc s LYS 7 Ca 0.06 -2.00 0.01 0.00 0.00 0.00 0.00 55.97 54.03 2aqc s LYS 7 Cb -0.00 -1.42 -0.02 0.00 0.00 0.00 0.00 37.83 36.39 2aqc s LYS 7 CO 0.00 -0.04 -0.05 0.21 0.00 0.00 0.00 175.35 175.47 2aqc s LYS 8 N -3.74 0.38 -0.21 1.78 2.20 0.72 -0.88 119.74 119.99 2aqc s LYS 8 Ca 0.34 -0.61 -0.29 0.00 -0.36 0.00 0.00 55.97 55.05 2aqc s LYS 8 Cb 0.08 -0.08 -0.02 0.00 -1.51 0.00 0.00 37.83 36.30 2aqc s LYS 8 CO 0.17 0.00 1.47 0.00 -0.36 0.00 0.00 175.35 176.62 2aqc n PRO 10 N 7.29 0.23 -0.10 0.00 -0.04 -1.26 0.07 135.00 141.19 2aqc n PRO 10 Ca 0.17 0.13 -0.23 0.00 -0.04 0.00 0.00 63.50 63.53 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 -1.26 0.64 -0.06 0.54 4.01 -1.26 -4.82 118.16 115.95 2aqc n LYS 11 Ca 0.07 0.27 -0.10 0.00 -0.51 0.00 0.00 58.31 58.05 2aqc n LYS 11 Cb 0.11 -1.58 -0.03 0.00 -0.51 0.00 0.00 35.03 33.02 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 2.10 1.96 3.75 0.00 0.00 0.11 -5.00 105.19 108.11 2aqc n GLY 13 Ca -0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.47 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 4.33 0.28 0.99 2.96 -1.26 -4.73 118.68 121.25 2aqc s LEU 14 Ca 0.00 0.85 -0.21 0.00 -0.22 0.00 0.00 54.13 54.55 2aqc s LEU 14 Cb 0.00 -2.66 -0.09 0.00 0.50 0.00 0.00 46.19 43.94 2aqc s LEU 14 CO 0.00 0.10 0.80 -0.31 -1.32 0.00 0.00 176.35 175.61 2aqc s TYR 15 N 0.14 3.60 0.01 5.38 2.02 -1.26 -1.30 117.35 125.93 2aqc s TYR 15 Ca 0.25 1.48 -0.28 0.00 -0.37 0.00 0.00 57.07 58.15 2aqc s TYR 15 Cb -0.16 -2.70 0.10 0.00 -0.40 0.00 0.00 41.96 38.81 2aqc s TYR 15 CO 0.11 0.24 1.25 -0.08 -1.57 0.00 0.00 175.55 175.50 2aqc s THR 16 N -1.66 0.00 0.00 -0.71 -1.32 -0.06 -4.99 115.64 106.90 2aqc s THR 16 Ca 0.48 -0.24 0.00 0.00 -1.21 0.00 0.00 61.69 60.72 2aqc s THR 16 Cb -0.16 -2.65 0.00 0.00 -1.51 0.00 0.00 72.50 68.18 2aqc s THR 16 CO 0.21 0.00 0.51 0.18 -2.21 0.00 0.00 174.62 173.31 2aqc n LEU 17 N -0.75 0.92 -0.04 9.08 4.77 -1.26 -1.42 117.00 128.30 2aqc n LEU 17 Ca -0.01 -0.92 0.15 0.00 -0.03 0.00 0.00 56.01 55.21 2aqc n LEU 17 Cb 0.60 0.00 0.83 0.00 -2.33 0.00 0.00 43.42 42.52 2aqc n LEU 17 CO 0.15 0.23 1.04 0.29 -1.33 0.00 0.00 177.39 177.77 2aqc n LYS 18 N -0.12 0.85 -1.06 3.23 4.76 -1.26 -4.87 118.16 119.69 2aqc n LYS 18 Ca 0.00 -0.09 -0.02 0.00 -2.87 0.00 0.00 58.31 55.33 2aqc n LYS 18 Cb 0.16 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 31.85 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 -1.00 -1.71 -3.76 1.97 1.02 -1.26 -4.92 120.64 110.98 2aqc n GLU 19 Ca 0.20 0.52 -0.13 0.00 -0.02 0.00 0.00 57.16 57.73 2aqc n GLU 19 Cb 0.18 -4.83 -0.13 0.00 -0.02 0.00 0.00 31.44 26.64 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 -1.29 -0.03 -0.29 -3.67 -1.09 -1.26 -1.59 121.20 111.98 2aqc s ILE 20 Ca 0.00 0.11 -0.29 0.00 -2.23 0.00 0.00 60.65 58.24 2aqc s ILE 20 Cb 0.00 -0.30 -0.00 0.00 -1.58 0.00 0.00 42.46 40.58 2aqc s ILE 20 CO 0.00 0.04 1.37 0.00 -1.23 0.00 0.00 174.94 175.12 2aqc n PRO 22 N 7.41 0.15 -0.06 0.00 -0.04 -1.26 0.33 135.00 141.53 2aqc n PRO 22 Ca 0.16 0.18 -0.03 0.00 -0.04 0.00 0.00 63.50 63.77 2aqc n PRO 22 Cb 0.46 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.41 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 3.64 -1.96 -3.44 116.57 115.35 2aqc h LYS 23 Ca 0.00 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.08 2aqc h LYS 23 Cb 0.17 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 2aqc h LYS 23 CO 0.00 0.00 -2.12 0.00 -2.27 0.00 0.00 179.45 175.06 2aqc n GLY 25 N 2.56 1.07 3.59 0.00 0.00 0.15 -5.03 105.19 107.53 2aqc n GLY 25 Ca -0.35 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.18 2aqc n GLY 25 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2aqc n GLU 26 N 0.00 1.26 -1.69 1.61 4.07 -1.26 -3.74 120.64 120.89 2aqc n GLU 26 Ca 0.00 0.45 -0.39 0.00 -0.06 0.00 0.00 57.16 57.16 2aqc n GLU 26 Cb 0.00 -1.99 0.03 0.00 -0.06 0.00 0.00 31.44 29.42 2aqc n GLU 26 CO 0.00 0.00 0.00 0.36 -0.06 0.00 0.00 177.13 177.43 2aqc n LYS 27 N 1.95 1.59 -3.46 5.31 0.00 -1.26 -0.93 118.16 121.36 2aqc n LYS 27 Ca 0.15 0.58 -0.32 0.00 -0.00 0.00 0.00 58.31 58.72 2aqc n LYS 27 Cb 0.24 -2.38 -0.05 0.00 -0.00 0.00 0.00 35.03 32.84 2aqc n LYS 27 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2aqc s THR 28 N -1.30 4.98 0.08 0.58 -4.23 -0.62 -4.52 115.64 110.61 2aqc s THR 28 Ca 0.68 0.37 0.06 0.00 -1.18 0.00 0.00 61.69 61.62 2aqc s THR 28 Cb -0.46 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 69.73 2aqc s THR 28 CO 0.53 -0.06 -0.16 0.68 -0.54 0.00 0.00 174.62 175.06 2aqc s VAL 29 N -1.80 1.27 -0.18 2.29 -7.23 0.89 -4.76 120.40 110.88 2aqc s VAL 29 Ca 0.46 -1.35 -0.28 0.00 -1.81 0.00 0.00 61.98 59.00 2aqc s VAL 29 Cb -0.11 -1.20 -0.05 0.00 0.56 0.00 0.00 36.38 35.58 2aqc s VAL 29 CO 0.22 -0.17 2.11 -0.63 -0.31 0.00 0.00 175.10 176.32 2aqc s ILE 30 N -1.22 3.08 -1.12 -0.62 -1.09 -1.26 -0.20 121.20 118.77 2aqc s ILE 30 Ca 0.00 0.09 0.14 0.00 -2.23 0.00 0.00 60.65 58.66 2aqc s ILE 30 Cb -0.10 -3.10 0.16 0.00 -1.58 0.00 0.00 42.46 37.84 2aqc s ILE 30 CO 0.03 -0.05 1.44 -0.81 -1.23 0.00 0.00 174.94 174.32 2aqc n PRO 31 N 8.45 0.06 -3.59 2.79 -0.04 -1.26 -3.85 135.00 137.56 2aqc n PRO 31 Ca 0.27 0.22 -0.27 0.00 -0.04 0.00 0.00 63.50 63.68 2aqc n PRO 31 Cb 0.44 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.30 2aqc n PRO 31 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2aqc n LYS 32 N -1.44 1.64 -1.18 0.54 5.02 -1.26 -5.11 118.16 116.38 2aqc n LYS 32 Ca 0.04 -4.18 -0.29 0.00 -2.02 0.00 0.00 58.31 51.86 2aqc n LYS 32 Cb 0.15 -2.05 0.16 0.00 -0.02 0.00 0.00 35.03 33.27 2aqc n LYS 32 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2aqc s PRO 33 N -1.49 0.78 0.35 1.97 0.04 -1.25 -5.06 135.00 130.34 2aqc s PRO 33 Ca 0.32 0.65 -0.06 0.00 0.04 0.00 0.00 61.00 61.95 2aqc s PRO 33 Cb 0.05 -1.77 0.09 0.00 0.04 0.00 0.00 34.50 32.91 2aqc s PRO 33 CO -0.12 -2.53 0.31 -0.35 0.04 0.00 0.00 177.00 174.35 2aqc n PRO 34 N -4.06 -1.62 -2.69 0.56 -0.04 -1.26 -5.01 135.00 120.89 2aqc n PRO 34 Ca 0.06 -0.49 -0.35 0.00 -0.04 0.00 0.00 63.50 62.67 2aqc n PRO 34 Cb 0.56 -0.46 -0.06 0.00 -0.04 0.00 0.00 33.50 33.51 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 -3.70 4.26 0.25 0.54 3.01 -1.26 -4.96 119.74 117.87 2aqc s LYS 35 Ca 0.20 1.33 0.03 0.00 -1.01 0.00 0.00 55.97 56.52 2aqc s LYS 35 Cb -0.02 -2.46 0.29 0.00 -1.01 0.00 0.00 37.83 34.64 2aqc s LYS 35 CO 0.15 -0.02 1.61 0.74 0.51 0.00 0.00 175.35 178.34 2aqc h PHE 36 N 2.41 0.42 -2.85 3.18 0.04 -2.00 -3.44 116.94 114.69 2aqc h PHE 36 Ca -0.48 -0.13 -0.61 0.00 2.80 0.00 0.00 57.97 59.54 2aqc h PHE 36 Cb 1.20 -0.08 -0.13 0.00 2.20 0.00 0.00 35.95 39.14 2aqc h PHE 36 CO 0.60 0.77 -0.69 -1.12 -0.60 0.00 0.00 178.31 177.26 2aqc s SER 37 N -6.89 4.43 0.27 2.17 0.01 -1.26 -5.03 113.70 107.40 2aqc s SER 37 Ca -0.05 -0.54 0.03 0.00 1.31 0.00 0.00 55.95 56.69 2aqc s SER 37 Cb 0.12 -0.81 0.37 0.00 0.21 0.00 0.00 66.02 65.91 2aqc s SER 37 CO 0.80 0.09 1.68 -0.07 0.41 0.00 0.00 173.24 176.14 2aqc h LEU 38 N 2.71 0.45 -6.65 2.44 3.38 -2.04 -3.41 115.31 112.18 2aqc h LEU 38 Ca -0.46 -0.17 -0.30 0.00 0.09 0.00 0.00 57.88 57.03 2aqc h LEU 38 Cb 1.21 -0.12 -0.34 0.00 0.09 0.00 0.00 40.66 41.49 2aqc h LEU 38 CO 0.56 0.76 -0.61 -1.61 0.09 0.00 0.00 178.44 177.63 2aqc s GLU 39 N -4.32 0.25 0.02 1.13 2.02 -1.26 -5.12 118.70 111.42 2aqc s GLU 39 Ca -0.06 0.14 0.01 0.00 0.02 0.00 0.00 54.97 55.08 2aqc s GLU 39 Cb 0.13 -0.94 -0.04 0.00 0.10 0.00 0.00 34.13 33.38 2aqc s GLU 39 CO 0.79 -0.77 0.06 0.16 0.02 0.00 0.00 175.26 175.52 2aqc s ASP 40 N 2.36 5.47 0.02 -0.19 1.47 -1.26 -5.05 116.67 119.50 2aqc s ASP 40 Ca 0.09 0.06 -0.18 0.00 1.18 0.00 0.00 52.55 53.70 2aqc s ASP 40 Cb -0.15 -1.50 -0.10 0.00 -0.34 0.00 0.00 42.92 40.83 2aqc s ASP 40 CO -0.19 0.25 1.14 -0.09 0.68 0.00 0.00 175.17 176.95 2aqc h ARG 41 N 3.94 -0.61 0.00 2.11 9.65 -2.01 -3.38 114.38 124.08 2aqc h ARG 41 Ca -0.48 0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.34 2aqc h ARG 41 Cb 1.18 0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 29.88 2aqc h ARG 41 CO 0.62 -0.41 -1.87 0.91 2.80 0.00 0.00 179.97 182.02 2aqc n TRP 42 N -3.89 0.00 0.00 2.20 7.02 -1.26 -5.02 117.44 116.49 2aqc n TRP 42 Ca -0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.40 2aqc n TRP 42 Cb 0.25 -0.51 0.00 0.00 -2.42 0.00 0.00 31.31 28.63 2aqc n TRP 42 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2aqc n GLY 43 N 1.73 1.25 0.43 6.99 0.00 -1.26 -3.79 105.19 110.55 2aqc n GLY 43 Ca -0.11 0.39 0.25 0.00 0.00 0.00 0.00 46.02 46.56 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 0.00 -0.22 1.61 2.10 -1.97 0.24 116.57 118.34 2aqc h LYS 44 Ca 0.00 0.00 0.06 0.00 -2.00 0.00 0.00 60.65 58.71 2aqc h LYS 44 Cb 0.00 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.32 2aqc h LYS 44 CO 0.00 0.00 0.18 -0.92 -2.00 0.00 0.00 179.45 176.71 2aqc h TYR 45 N 0.00 0.00 -0.84 0.07 5.03 -1.99 -1.78 116.97 117.46 2aqc h TYR 45 Ca 0.36 0.00 0.15 0.00 2.58 0.00 0.00 58.73 61.81 2aqc h TYR 45 Cb 1.45 0.00 -0.09 0.00 1.55 0.00 0.00 36.73 39.64 2aqc h TYR 45 CO 0.00 0.00 0.42 -0.09 -1.32 0.00 0.00 178.16 177.17 2aqc h ARG 46 N 0.00 0.58 -0.41 1.82 9.65 -0.84 -0.24 114.38 124.93 2aqc h ARG 46 Ca 0.10 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.86 2aqc h ARG 46 Cb 0.46 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.90 2aqc h ARG 46 CO -0.00 0.38 -0.07 -0.09 2.80 0.00 0.00 179.97 182.99 2aqc h ARG 47 N 0.59 0.78 0.00 0.20 9.65 -1.50 -2.66 114.38 121.45 2aqc h ARG 47 Ca 0.46 -0.29 -0.01 0.00 -1.10 0.00 0.00 59.98 59.04 2aqc h ARG 47 Cb 0.66 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.18 2aqc h ARG 47 CO -0.37 0.89 -0.06 0.52 2.80 0.00 0.00 179.97 183.75 2aqc h MET 48 N 0.60 0.00 -0.67 0.20 2.86 -1.21 -2.43 114.93 114.29 2aqc h MET 48 Ca 0.11 0.00 0.19 0.00 -2.06 0.00 0.00 59.70 57.94 2aqc h MET 48 Cb 0.59 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.22 2aqc h MET 48 CO 0.04 0.06 0.51 1.25 1.06 0.00 0.00 176.91 179.83 2aqc h LEU 49 N 0.00 0.00 -9.31 1.22 6.46 -0.72 -3.41 115.31 109.54 2aqc h LEU 49 Ca -0.00 0.00 -0.65 0.00 -0.12 0.00 0.00 57.88 57.11 2aqc h LEU 49 Cb 0.24 0.00 0.04 0.00 -0.73 0.00 0.00 40.66 40.21 2aqc h LEU 49 CO 0.01 0.00 0.79 2.29 -0.62 0.00 0.00 178.44 180.91 2aqc n LYS 50 N -4.18 1.68 -4.54 1.25 2.85 -0.92 -4.97 118.16 109.34 2aqc n LYS 50 Ca 0.13 0.61 -0.25 0.00 -1.05 0.00 0.00 58.31 57.75 2aqc n LYS 50 Cb 0.77 -2.34 -0.10 0.00 -0.65 0.00 0.00 35.03 32.70 2aqc n LYS 50 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 2aqc s ARG 51 N 2.05 1.82 0.06 -1.58 1.70 -1.26 -5.06 118.95 116.67 2aqc s ARG 51 Ca 0.88 -2.03 0.04 0.00 -0.47 0.00 0.00 55.73 54.14 2aqc s ARG 51 Cb -0.84 -1.19 -0.24 0.00 -0.57 0.00 0.00 34.95 32.12 2aqc s ARG 51 CO 0.49 -0.16 1.05 0.00 -1.08 0.00 0.00 175.30 175.59 2aqc h ALA 52 N 1.92 0.37 -1.91 7.88 0.00 -2.00 -3.44 119.26 122.09 2aqc h ALA 52 Ca -0.42 -1.06 -0.57 0.00 0.00 0.00 0.00 54.91 52.86 2aqc h ALA 52 Cb 1.25 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 2aqc h ALA 52 CO 0.74 1.25 0.86 -1.17 0.00 0.00 0.00 179.25 180.92 2aqc s LEU 53 N -6.72 3.88 -0.23 0.00 1.98 -1.26 -5.02 118.68 111.31 2aqc s LEU 53 Ca -0.03 0.95 -0.09 0.00 -2.89 0.00 0.00 54.13 52.07 2aqc s LEU 53 Cb 0.08 -3.54 -0.04 0.00 0.66 0.00 0.00 46.19 43.35 2aqc s LEU 53 CO 0.84 -0.94 0.13 -0.54 -1.89 0.00 0.00 176.35 173.94 2aqc s LYS 54 N 3.79 3.98 0.63 1.98 3.01 -1.26 -5.07 119.74 126.79 2aqc s LYS 54 Ca 0.46 -0.32 -0.18 0.00 -1.01 0.00 0.00 55.97 54.92 2aqc s LYS 54 Cb -0.11 -3.44 -0.04 0.00 -1.01 0.00 0.00 37.83 33.23 2aqc s LYS 54 CO 0.18 0.06 0.92 -1.71 0.51 0.00 0.00 175.35 175.31 2aqc n ASN 55 N 4.25 0.53 -4.65 2.83 2.85 -1.26 -4.94 115.26 114.87 2aqc n ASN 55 Ca -0.15 0.76 -0.31 0.00 -0.11 0.00 0.00 54.58 54.77 2aqc n ASN 55 Cb 0.52 -1.37 0.17 0.00 1.24 0.00 0.00 39.78 40.34 2aqc n ASN 55 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2aqc n LYS 56 N -1.13 -0.57 -3.60 1.20 5.02 -1.26 -4.98 118.16 112.84 2aqc n LYS 56 Ca 0.14 -0.10 -0.38 0.00 -2.02 0.00 0.00 58.31 55.94 2aqc n LYS 56 Cb 0.48 -2.36 -0.11 0.00 -0.02 0.00 0.00 35.03 33.02 2aqc n LYS 56 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2aqc s ASN 57 N -2.61 5.90 -0.13 4.39 2.20 -1.26 -5.06 114.94 118.37 2aqc s ASN 57 Ca 0.67 -0.16 -0.06 0.00 -0.94 0.00 0.00 52.86 52.37 2aqc s ASN 57 Cb -0.23 -2.09 0.06 0.00 -2.00 0.00 0.00 41.25 36.98 2aqc s ASN 57 CO 0.59 -0.10 0.29 -0.75 -2.94 0.00 0.00 177.10 174.18 2aqc s LYS 58 N 1.72 0.22 0.16 3.55 2.47 -1.26 -5.15 119.74 121.46 2aqc s LYS 58 Ca 0.07 0.66 -0.27 0.00 -1.56 0.00 0.00 55.97 54.87 2aqc s LYS 58 Cb -0.16 -0.05 -0.08 0.00 -1.46 0.00 0.00 37.83 36.08 2aqc s LYS 58 CO 0.10 -0.20 0.84 0.00 0.16 0.00 0.00 175.35 176.24 2aqc s ALA 59 N 1.70 3.38 -0.93 3.13 0.00 -1.26 -5.30 121.76 122.48 2aqc s ALA 59 Ca -0.06 0.44 0.07 0.00 0.00 0.00 0.00 51.96 52.42 2aqc s ALA 59 Cb -0.11 -3.07 0.06 0.00 0.00 0.00 0.00 23.12 20.00 2aqc s ALA 59 CO -0.09 0.19 0.74 0.39 0.00 0.00 0.00 175.76 176.99