#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2axx n LYS 2 N 0.00 0.00 -1.17 -1.24 5.02 -1.26 -5.02 118.16 114.49 2axx n LYS 2 Ca 0.00 0.00 0.16 0.00 -2.02 0.00 0.00 58.31 56.45 2axx n LYS 2 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 2axx n LYS 2 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2axx n ASP 3 N -3.11 -7.16 -0.28 4.39 8.00 -1.26 -4.97 116.55 112.16 2axx n ASP 3 Ca 0.00 1.26 0.00 0.00 0.71 0.00 0.00 54.79 56.76 2axx n ASP 3 Cb 0.00 -3.53 0.00 0.00 -0.02 0.00 0.00 41.12 37.57 2axx n ASP 3 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2axx n VAL 4 N -3.65 0.00 -3.43 2.53 0.24 -1.26 -5.03 118.33 107.72 2axx n VAL 4 Ca 0.01 0.00 -0.44 0.00 -2.04 0.00 0.00 64.34 61.87 2axx n VAL 4 Cb 0.53 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.84 2axx n VAL 4 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2axx s LYS 5 N 3.59 2.83 -0.25 7.34 -0.14 -1.26 -5.05 119.74 126.81 2axx s LYS 5 Ca 0.00 -1.86 -0.06 0.00 -1.36 0.00 0.00 55.97 52.69 2axx s LYS 5 Cb 0.00 -4.14 -0.02 0.00 -1.68 0.00 0.00 37.83 31.99 2axx s LYS 5 CO 0.00 -1.26 0.04 0.71 -0.76 0.00 0.00 175.35 174.08 2axx s TYR 6 N 1.26 3.06 -0.06 3.18 2.02 -1.26 0.09 117.35 125.63 2axx s TYR 6 Ca 0.06 -0.60 0.05 0.00 -0.37 0.00 0.00 57.07 56.22 2axx s TYR 6 Cb -0.26 -2.21 -0.02 0.00 -0.40 0.00 0.00 41.96 39.08 2axx s TYR 6 CO -0.00 -0.43 -0.21 0.71 -1.57 0.00 0.00 175.55 174.06 2axx s TYR 7 N 1.57 2.54 0.73 2.71 2.02 -0.08 -4.78 117.35 122.07 2axx s TYR 7 Ca 0.06 -0.53 -0.10 0.00 -0.37 0.00 0.00 57.07 56.12 2axx s TYR 7 Cb -0.15 -1.63 0.16 0.00 -0.40 0.00 0.00 41.96 39.94 2axx s TYR 7 CO 0.02 -0.09 1.00 0.25 -1.57 0.00 0.00 175.55 175.15 2axx n THR 8 N 2.80 0.00 0.08 -0.71 -2.24 -1.26 -0.34 114.28 112.61 2axx n THR 8 Ca -0.17 -0.87 -0.07 0.00 -2.27 0.00 0.00 64.05 60.66 2axx n THR 8 Cb 0.52 -1.48 -0.05 0.00 -2.10 0.00 0.00 70.33 67.22 2axx n THR 8 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2axx h LEU 9 N 0.00 -0.26 -1.44 3.22 -0.00 -1.99 -1.82 115.31 113.02 2axx h LEU 9 Ca -0.32 -0.14 0.11 0.00 -0.00 0.00 0.00 57.88 57.52 2axx h LEU 9 Cb 0.94 0.07 -0.05 0.00 -0.00 0.00 0.00 40.66 41.62 2axx h LEU 9 CO 0.25 0.25 0.49 1.05 -0.00 0.00 0.00 178.44 180.48 2axx h GLU 10 N -1.02 0.60 0.86 1.13 9.09 -1.96 0.13 114.58 123.40 2axx h GLU 10 Ca -0.03 -0.04 -0.04 0.00 0.05 0.00 0.00 59.36 59.30 2axx h GLU 10 Cb 0.38 -0.13 0.01 0.00 -1.65 0.00 0.00 28.75 27.36 2axx h GLU 10 CO 0.05 0.39 -0.41 1.49 0.05 0.00 0.00 179.01 180.58 2axx h GLU 11 N 0.61 -1.12 -0.79 1.06 4.57 -1.94 -1.37 114.58 115.60 2axx h GLU 11 Ca 0.35 0.08 0.04 0.00 -1.18 0.00 0.00 59.36 58.65 2axx h GLU 11 Cb 0.54 0.25 -0.05 0.00 -0.16 0.00 0.00 28.75 29.33 2axx h GLU 11 CO -0.13 -0.74 0.49 0.82 -1.18 0.00 0.00 179.01 178.27 2axx h ILE 12 N -1.18 1.08 0.00 2.32 1.08 -0.42 0.08 117.51 120.47 2axx h ILE 12 Ca -0.12 -0.32 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2axx h ILE 12 Cb 0.89 0.06 0.00 0.00 -3.07 0.00 0.00 36.82 34.70 2axx h ILE 12 CO 0.19 0.17 0.00 -0.61 -0.69 0.00 0.00 178.15 177.21 2axx h GLN 13 N 0.93 0.00 0.00 2.37 4.15 -0.67 0.45 115.11 122.35 2axx h GLN 13 Ca 0.33 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.66 2axx h GLN 13 Cb 0.08 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 2axx h GLN 13 CO -0.14 0.00 -0.54 0.87 -1.93 0.00 0.00 178.83 177.09 2axx h LYS 14 N 0.00 0.00 -3.02 1.69 1.57 0.19 -3.39 116.57 113.61 2axx h LYS 14 Ca 0.00 0.00 -0.79 0.00 -1.87 0.00 0.00 60.65 57.99 2axx h LYS 14 Cb 0.07 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 32.16 2axx h LYS 14 CO 0.00 0.37 1.37 0.72 -0.57 0.00 0.00 179.45 181.34 2axx n HIS 15 N -3.14 2.54 -2.69 -1.35 8.25 0.15 -4.50 115.22 114.48 2axx n HIS 15 Ca 0.01 -2.66 -0.06 0.00 -0.26 0.00 0.00 57.72 54.76 2axx n HIS 15 Cb 0.70 -1.53 0.12 0.00 1.12 0.00 0.00 29.99 30.40 2axx n HIS 15 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2axx n LYS 16 N 2.09 1.20 0.00 -0.41 2.85 -1.26 -3.10 118.16 119.52 2axx n LYS 16 Ca 0.36 -1.63 0.00 0.00 -1.05 0.00 0.00 58.31 55.99 2axx n LYS 16 Cb 0.33 0.07 0.00 0.00 -0.65 0.00 0.00 35.03 34.78 2axx n LYS 16 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2axx n ASP 17 N -0.82 0.00 -2.11 -5.58 8.00 -1.26 -4.91 116.55 109.88 2axx n ASP 17 Ca -0.07 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.40 2axx n ASP 17 Cb 0.85 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 42.02 2axx n ASP 17 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2axx n SER 18 N 0.00 -1.10 0.00 -2.24 2.88 -1.26 -5.01 113.62 106.88 2axx n SER 18 Ca 0.00 -1.90 0.00 0.00 -1.33 0.00 0.00 58.87 55.64 2axx n SER 18 Cb 0.00 0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2axx n SER 18 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2axx n LYS 19 N -0.98 0.00 -1.45 -1.46 0.00 -1.26 -5.01 118.16 107.99 2axx n LYS 19 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 57.73 2axx n LYS 19 Cb 0.76 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.76 2axx n LYS 19 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2axx n SER 20 N -1.97 3.08 -4.56 3.14 7.64 -1.26 -4.70 113.62 114.98 2axx n SER 20 Ca 0.00 -2.74 -0.39 0.00 1.01 0.00 0.00 58.87 56.74 2axx n SER 20 Cb 0.00 -1.35 -0.03 0.00 -1.01 0.00 0.00 64.21 61.82 2axx n SER 20 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2axx s THR 21 N 4.80 3.40 0.19 0.44 2.01 -1.26 -4.11 115.64 121.10 2axx s THR 21 Ca 0.55 0.28 0.04 0.00 0.31 0.00 0.00 61.69 62.87 2axx s THR 21 Cb 0.13 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.71 2axx s THR 21 CO 0.05 -0.81 0.26 0.26 -0.69 0.00 0.00 174.62 173.70 2axx s TRP 22 N 8.58 3.36 0.13 4.92 0.52 -1.18 -1.97 118.94 133.29 2axx s TRP 22 Ca 0.69 0.02 -0.19 0.00 0.02 0.00 0.00 56.10 56.64 2axx s TRP 22 Cb -0.14 -1.57 0.05 0.00 -1.15 0.00 0.00 33.47 30.66 2axx s TRP 22 CO 0.23 0.50 0.48 0.14 0.02 0.00 0.00 176.95 178.33 2axx s VAL 23 N -1.87 0.04 -0.25 4.03 -7.23 -1.02 0.18 120.40 114.29 2axx s VAL 23 Ca 0.33 -0.33 0.01 0.00 -1.81 0.00 0.00 61.98 60.19 2axx s VAL 23 Cb -0.10 -1.08 0.06 0.00 0.56 0.00 0.00 36.38 35.82 2axx s VAL 23 CO 0.27 -0.18 -0.06 0.27 -0.31 0.00 0.00 175.10 175.09 2axx s ILE 24 N -3.62 1.70 -0.32 -0.62 -5.25 -1.26 -0.93 121.20 110.91 2axx s ILE 24 Ca 0.01 -1.37 -0.03 0.00 -0.99 0.00 0.00 60.65 58.27 2axx s ILE 24 Cb 0.01 -1.95 0.05 0.00 2.95 0.00 0.00 42.46 43.52 2axx s ILE 24 CO -0.11 -0.12 0.03 -0.76 -1.79 0.00 0.00 174.94 172.20 2axx s LEU 25 N 1.31 4.07 -0.95 0.37 1.43 0.41 -3.18 118.68 122.14 2axx s LEU 25 Ca -0.06 -1.30 -0.06 0.00 -1.03 0.00 0.00 54.13 51.69 2axx s LEU 25 Cb -0.19 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2axx s LEU 25 CO -0.06 -0.29 0.83 1.41 0.23 0.00 0.00 176.35 178.46 2axx n HIS 26 N 4.66 -2.56 -4.01 0.29 8.25 -1.26 -3.14 115.22 117.44 2axx n HIS 26 Ca -0.12 0.90 -0.27 0.00 -0.26 0.00 0.00 57.72 57.97 2axx n HIS 26 Cb 0.43 -4.02 -0.02 0.00 1.12 0.00 0.00 29.99 27.51 2axx n HIS 26 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2axx n HIS 27 N -2.85 -1.67 -3.67 4.41 8.25 -1.26 -4.96 115.22 113.47 2axx n HIS 27 Ca -0.06 0.76 -0.08 0.00 -0.26 0.00 0.00 57.72 58.07 2axx n HIS 27 Cb 0.58 -3.59 -0.09 0.00 1.12 0.00 0.00 29.99 28.01 2axx n HIS 27 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2axx s LYS 28 N -6.65 0.38 -0.17 -0.41 2.47 -1.19 -4.21 119.74 109.97 2axx s LYS 28 Ca 0.14 1.01 -0.18 0.00 -1.56 0.00 0.00 55.97 55.39 2axx s LYS 28 Cb -0.08 0.27 -0.04 0.00 -1.46 0.00 0.00 37.83 36.53 2axx s LYS 28 CO 0.90 -0.22 0.47 0.08 0.16 0.00 0.00 175.35 176.74 2axx s VAL 29 N 2.27 5.16 -0.02 4.02 1.01 0.78 -0.44 120.40 133.17 2axx s VAL 29 Ca -0.05 0.89 0.08 0.00 0.00 0.00 0.00 61.98 62.90 2axx s VAL 29 Cb -0.11 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2axx s VAL 29 CO -0.14 0.25 -0.26 -0.31 0.00 0.00 0.00 175.10 174.65 2axx s TYR 30 N 1.16 2.35 -0.23 5.22 2.02 -0.10 -1.32 117.35 126.44 2axx s TYR 30 Ca 0.24 -0.46 -0.16 0.00 -0.37 0.00 0.00 57.07 56.32 2axx s TYR 30 Cb -0.15 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 39.86 2axx s TYR 30 CO 0.09 -0.05 0.43 0.34 -1.57 0.00 0.00 175.55 174.79 2axx s ASP 31 N -0.57 6.40 -0.24 2.29 -1.08 -0.72 -2.43 116.67 120.31 2axx s ASP 31 Ca 0.09 0.47 0.11 0.00 -0.52 0.00 0.00 52.55 52.69 2axx s ASP 31 Cb -0.10 -2.24 0.46 0.00 -1.46 0.00 0.00 42.92 39.57 2axx s ASP 31 CO -0.01 -0.16 1.33 0.18 0.52 0.00 0.00 175.17 177.04 2axx n LEU 32 N 4.97 3.36 -0.03 -1.34 4.77 -0.83 -4.78 117.00 123.11 2axx n LEU 32 Ca -0.07 -3.79 -0.11 0.00 -0.03 0.00 0.00 56.01 52.01 2axx n LEU 32 Cb 0.51 -0.57 -0.06 0.00 -2.33 0.00 0.00 43.42 40.96 2axx n LEU 32 CO 0.39 1.29 0.81 0.74 -1.33 0.00 0.00 177.39 179.30 2axx h THR 33 N 0.97 1.18 -0.50 -5.08 2.02 -1.84 -1.45 112.91 108.21 2axx h THR 33 Ca 0.10 -0.55 -0.08 0.00 0.77 0.00 0.00 66.41 66.66 2axx h THR 33 Cb 1.31 1.29 -0.05 0.00 -1.74 0.00 0.00 68.15 68.96 2axx h THR 33 CO 0.18 0.16 0.10 0.29 0.37 0.00 0.00 175.52 176.62 2axx n LYS 34 N -4.86 3.58 0.00 6.66 5.02 -1.26 -3.97 118.16 123.32 2axx n LYS 34 Ca -0.05 -2.38 0.02 0.00 -2.02 0.00 0.00 58.31 53.89 2axx n LYS 34 Cb 0.14 -2.05 0.01 0.00 -0.02 0.00 0.00 35.03 33.11 2axx n LYS 34 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2axx n PHE 35 N 0.23 0.00 0.04 2.13 7.35 -0.57 -4.62 117.46 122.02 2axx n PHE 35 Ca 0.26 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.84 2axx n PHE 35 Cb 1.06 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.85 2axx n PHE 35 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2axx h LEU 36 N 0.73 -0.53 0.02 -2.13 3.38 -1.62 0.20 115.31 115.37 2axx h LEU 36 Ca 0.00 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2axx h LEU 36 Cb 0.18 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2axx h LEU 36 CO 0.00 -0.24 -0.20 -0.33 0.09 0.00 0.00 178.44 177.77 2axx h GLU 37 N -0.27 0.09 -0.97 1.13 4.39 -1.86 -2.62 114.58 114.47 2axx h GLU 37 Ca 0.07 -0.13 0.18 0.00 0.34 0.00 0.00 59.36 59.82 2axx h GLU 37 Cb 0.36 0.04 -0.10 0.00 -0.10 0.00 0.00 28.75 28.95 2axx h GLU 37 CO -0.19 1.00 0.57 0.93 -1.16 0.00 0.00 179.01 180.15 2axx h GLU 38 N -0.75 0.71 -6.02 2.33 4.39 -1.79 -3.42 114.58 110.02 2axx h GLU 38 Ca -0.03 -0.04 -0.69 0.00 0.34 0.00 0.00 59.36 58.93 2axx h GLU 38 Cb 1.09 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 2axx h GLU 38 CO 0.04 0.47 1.32 1.58 -1.16 0.00 0.00 179.01 181.25 2axx n HIS 39 N -4.80 1.63 -1.91 4.33 -0.00 0.69 -4.80 115.22 110.36 2axx n HIS 39 Ca 0.22 0.38 -0.35 0.00 0.46 0.00 0.00 57.72 58.42 2axx n HIS 39 Cb 0.54 -2.49 -0.05 0.00 -0.12 0.00 0.00 29.99 27.88 2axx n HIS 39 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2axx n PRO 40 N 7.62 1.92 0.00 1.57 -0.04 -1.26 -1.27 135.00 143.54 2axx n PRO 40 Ca 0.40 -2.46 0.00 0.00 -0.04 0.00 0.00 63.50 61.40 2axx n PRO 40 Cb 0.18 -3.47 0.00 0.00 -0.04 0.00 0.00 33.50 30.17 2axx n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2axx n GLY 41 N 5.31 0.47 0.00 0.55 0.00 -1.26 -5.17 105.19 105.09 2axx n GLY 41 Ca 0.47 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2axx n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2axx n GLY 42 N 0.00 2.29 0.11 -0.02 0.00 -0.40 -4.90 105.19 102.27 2axx n GLY 42 Ca 0.00 -1.98 -0.24 0.00 0.00 0.00 0.00 46.02 43.81 2axx n GLY 42 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2axx n GLU 43 N -1.57 0.57 -0.08 1.61 0.00 -0.99 -4.46 120.64 115.72 2axx n GLU 43 Ca 0.00 0.51 -0.08 0.00 0.00 0.00 0.00 57.16 57.59 2axx n GLU 43 Cb 0.00 -1.69 -0.00 0.00 0.00 0.00 0.00 31.44 29.74 2axx n GLU 43 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2axx h GLU 44 N -1.00 0.27 -1.15 5.31 4.81 -1.93 0.34 114.58 121.23 2axx h GLU 44 Ca -0.43 -0.02 0.33 0.00 -0.13 0.00 0.00 59.36 59.12 2axx h GLU 44 Cb 1.37 -0.06 -0.10 0.00 0.63 0.00 0.00 28.75 30.59 2axx h GLU 44 CO -0.26 0.18 0.75 -0.39 -0.73 0.00 0.00 179.01 178.56 2axx h VAL 45 N 0.28 0.37 0.21 0.32 -1.51 -1.91 0.19 116.25 114.20 2axx h VAL 45 Ca 0.13 -0.09 -0.32 0.00 -1.23 0.00 0.00 66.70 65.19 2axx h VAL 45 Cb 0.07 0.09 0.03 0.00 -2.13 0.00 0.00 31.29 29.35 2axx h VAL 45 CO -0.11 0.05 -1.47 -0.07 -1.23 0.00 0.00 177.57 174.74 2axx h LEU 46 N 0.25 0.70 -0.17 4.19 3.38 -0.66 -3.29 115.31 119.72 2axx h LEU 46 Ca 0.67 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2axx h LEU 46 Cb 1.95 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.47 2axx h LEU 46 CO -0.32 1.69 0.00 -1.14 0.09 0.00 0.00 178.44 178.76 2axx n ARG 47 N -3.76 1.09 0.14 1.13 0.00 -0.00 -3.34 116.66 111.92 2axx n ARG 47 Ca -0.19 -0.14 -0.08 0.00 -0.00 0.00 0.00 57.85 57.43 2axx n ARG 47 Cb 1.04 -1.04 -0.04 0.00 0.00 0.00 0.00 32.46 32.42 2axx n ARG 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2axx h GLU 48 N 0.23 -0.42 0.00 -0.14 4.39 -0.79 -3.42 114.58 114.43 2axx h GLU 48 Ca 0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2axx h GLU 48 Cb 0.06 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2axx h GLU 48 CO 0.00 -0.22 0.00 1.04 -1.16 0.00 0.00 179.01 178.67 2axx n GLN 49 N -5.07 0.00 -1.05 2.33 1.13 -1.25 -5.09 117.38 108.38 2axx n GLN 49 Ca -0.06 0.24 0.12 0.00 -1.94 0.00 0.00 57.00 55.36 2axx n GLN 49 Cb 0.20 -0.71 -0.04 0.00 0.11 0.00 0.00 30.24 29.81 2axx n GLN 49 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2axx n ALA 50 N -2.02 -3.15 -2.86 -1.58 0.00 -1.21 -4.86 120.51 104.83 2axx n ALA 50 Ca 0.00 0.40 -0.21 0.00 0.00 0.00 0.00 53.44 53.62 2axx n ALA 50 Cb 0.00 -1.08 0.02 0.00 0.00 0.00 0.00 19.45 18.39 2axx n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2axx n GLY 51 N -3.28 -0.51 0.00 0.00 0.00 0.13 -4.56 105.19 96.96 2axx n GLY 51 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2axx n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2axx n GLY 52 N -1.30 -0.84 3.97 -0.02 0.00 -1.22 -3.93 105.19 101.85 2axx n GLY 52 Ca -0.14 -1.98 -0.28 0.00 0.00 0.00 0.00 46.02 43.62 2axx n GLY 52 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2axx n ASP 53 N 0.00 0.14 -0.00 1.61 9.92 -1.26 -4.38 116.55 122.57 2axx n ASP 53 Ca 0.00 -1.03 0.06 0.00 -0.53 0.00 0.00 54.79 53.29 2axx n ASP 53 Cb 0.00 -1.29 -0.08 0.00 -0.64 0.00 0.00 41.12 39.11 2axx n ASP 53 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2axx n ALA 54 N -3.75 2.67 -0.17 2.24 0.00 -1.25 -4.57 120.51 115.67 2axx n ALA 54 Ca -0.16 -0.29 -0.07 0.00 0.00 0.00 0.00 53.44 52.92 2axx n ALA 54 Cb 0.51 -0.40 -0.02 0.00 0.00 0.00 0.00 19.45 19.54 2axx n ALA 54 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2axx h THR 55 N 0.00 0.15 -0.86 0.00 2.02 -1.86 0.16 112.91 112.53 2axx h THR 55 Ca 0.00 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.39 2axx h THR 55 Cb 0.47 0.15 -0.12 0.00 -1.74 0.00 0.00 68.15 66.91 2axx h THR 55 CO 0.00 0.00 0.33 -0.08 0.37 0.00 0.00 175.52 176.14 2axx h GLU 56 N -0.22 0.34 0.12 6.66 4.81 -1.92 0.22 114.58 124.60 2axx h GLU 56 Ca 0.19 -0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 59.18 2axx h GLU 56 Cb 0.56 -0.08 0.02 0.00 0.63 0.00 0.00 28.75 29.88 2axx h GLU 56 CO -0.64 0.23 -0.97 -0.97 -0.73 0.00 0.00 179.01 175.93 2axx h ASN 57 N 0.35 0.63 -0.71 1.04 -0.00 -1.58 -1.27 115.58 114.05 2axx h ASN 57 Ca 0.53 -0.88 0.02 0.00 -0.00 0.00 0.00 56.30 55.97 2axx h ASN 57 Cb 0.98 -0.20 -0.04 0.00 -0.00 0.00 0.00 38.32 39.06 2axx h ASN 57 CO -0.54 1.46 0.45 0.15 -0.00 0.00 0.00 177.43 178.95 2axx h PHE 58 N -0.10 0.85 -0.09 0.67 3.04 0.22 -2.90 116.94 118.63 2axx h PHE 58 Ca -0.16 0.02 -0.23 0.00 3.98 0.00 0.00 57.97 61.59 2axx h PHE 58 Cb 1.71 -0.28 0.01 0.00 2.56 0.00 0.00 35.95 39.95 2axx h PHE 58 CO 0.16 0.50 -0.85 0.93 -2.02 0.00 0.00 178.31 177.04 2axx h GLU 59 N 0.90 0.67 -0.83 1.11 4.39 -0.67 -0.27 114.58 119.88 2axx h GLU 59 Ca 0.28 -0.60 0.15 0.00 0.34 0.00 0.00 59.36 59.53 2axx h GLU 59 Cb -0.02 0.14 -0.15 0.00 -0.10 0.00 0.00 28.75 28.62 2axx h GLU 59 CO -0.09 1.21 -0.28 0.22 -1.16 0.00 0.00 179.01 178.91 2axx h ASP 60 N 0.43 -1.02 0.15 1.42 1.82 -1.13 0.16 116.42 118.25 2axx h ASP 60 Ca -0.07 0.26 -0.01 0.00 -0.39 0.00 0.00 57.03 56.83 2axx h ASP 60 Cb 1.47 0.59 0.00 0.00 0.68 0.00 0.00 39.33 42.08 2axx h ASP 60 CO 0.17 -0.29 -0.07 0.58 -1.61 0.00 0.00 179.24 178.02 2axx h VAL 61 N -0.03 0.95 -3.21 2.25 2.07 -1.39 -3.49 116.25 113.40 2axx h VAL 61 Ca 0.36 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 2axx h VAL 61 Cb 0.61 1.19 0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2axx h VAL 61 CO -0.87 0.09 -0.06 0.61 0.02 0.00 0.00 177.57 177.37 2axx n GLY 62 N -0.67 0.56 3.57 2.17 0.00 0.04 -4.99 105.19 105.88 2axx n GLY 62 Ca -0.09 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2axx n GLY 62 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2axx n HIS 63 N -1.55 0.23 -0.76 1.61 8.25 -1.25 -5.02 115.22 116.74 2axx n HIS 63 Ca -0.00 0.38 -0.29 0.00 -0.26 0.00 0.00 57.72 57.55 2axx n HIS 63 Cb 0.51 -2.03 0.24 0.00 1.12 0.00 0.00 29.99 29.83 2axx n HIS 63 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2axx s SER 64 N -1.60 0.96 0.15 0.41 0.01 -1.26 -4.91 113.70 107.46 2axx s SER 64 Ca 0.71 1.16 -0.03 0.00 1.31 0.00 0.00 55.95 59.10 2axx s SER 64 Cb -0.35 -1.77 -0.02 0.00 0.21 0.00 0.00 66.02 64.09 2axx s SER 64 CO 0.53 -4.16 1.37 0.00 0.41 0.00 0.00 173.24 171.38 2axx h THR 65 N -2.60 1.39 -0.73 1.44 1.03 -1.99 -3.03 112.91 108.42 2axx h THR 65 Ca -0.55 -2.29 0.15 0.00 -0.01 0.00 0.00 66.41 63.70 2axx h THR 65 Cb 1.33 2.26 -0.14 0.00 -1.07 0.00 0.00 68.15 70.53 2axx h THR 65 CO 0.47 0.69 -0.19 0.44 -0.01 0.00 0.00 175.52 176.91 2axx h ASP 66 N 0.26 -0.71 -0.50 0.00 5.19 -2.00 0.28 116.42 118.94 2axx h ASP 66 Ca -0.05 0.22 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 2axx h ASP 66 Cb 1.44 0.46 -0.02 0.00 0.18 0.00 0.00 39.33 41.39 2axx h ASP 66 CO 0.14 -0.25 0.33 0.00 -3.12 0.00 0.00 179.24 176.34 2axx h ALA 67 N 1.70 0.64 -0.06 3.45 0.00 -1.92 -1.30 119.26 121.77 2axx h ALA 67 Ca 0.35 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.24 2axx h ALA 67 Cb 0.54 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2axx h ALA 67 CO -0.76 0.10 -0.10 0.00 0.00 0.00 0.00 179.25 178.49 2axx h ARG 68 N 0.68 -0.13 -0.64 0.00 3.08 -0.41 0.34 114.38 117.31 2axx h ARG 68 Ca 0.18 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 2axx h ARG 68 Cb -0.06 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 2axx h ARG 68 CO -0.04 -0.09 0.37 1.05 -1.07 0.00 0.00 179.97 180.19 2axx h GLU 69 N -0.14 0.88 -0.59 0.04 4.11 -0.96 -2.35 114.58 115.57 2axx h GLU 69 Ca 0.06 -0.09 -0.02 0.00 0.07 0.00 0.00 59.36 59.37 2axx h GLU 69 Cb 0.22 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2axx h GLU 69 CO -0.14 0.65 0.28 1.25 0.07 0.00 0.00 179.01 181.11 2axx h LEU 70 N 0.87 0.75 -0.66 3.06 7.12 -0.76 -1.55 115.31 124.13 2axx h LEU 70 Ca 0.23 -0.07 0.14 0.00 0.13 0.00 0.00 57.88 58.30 2axx h LEU 70 Cb 0.01 -0.19 -0.11 0.00 -0.53 0.00 0.00 40.66 39.84 2axx h LEU 70 CO -0.04 0.64 0.04 -1.28 -0.13 0.00 0.00 178.44 177.68 2axx h SER 71 N 0.83 -0.21 -0.61 1.25 0.87 0.23 0.31 113.55 116.21 2axx h SER 71 Ca 0.21 0.16 0.07 0.00 -1.23 0.00 0.00 61.79 60.99 2axx h SER 71 Cb 0.09 0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 62.26 2axx h SER 71 CO -0.03 -0.10 0.30 0.11 -0.53 0.00 0.00 176.83 176.58 2axx h LYS 72 N 0.15 0.53 -0.03 2.24 6.56 -1.14 0.15 116.57 125.03 2axx h LYS 72 Ca 0.36 -0.03 0.01 0.00 -1.06 0.00 0.00 60.65 59.92 2axx h LYS 72 Cb 0.59 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 32.13 2axx h LYS 72 CO -0.54 0.35 0.24 1.15 -2.06 0.00 0.00 179.45 178.59 2axx h THR 73 N 0.54 0.05 -0.10 -0.16 2.02 -0.88 -0.34 112.91 114.04 2axx h THR 73 Ca 0.29 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.47 2axx h THR 73 Cb 0.25 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2axx h THR 73 CO -0.22 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.45 2axx n TYR 74 N -3.03 0.11 -1.71 3.16 4.01 0.47 -4.97 117.16 115.20 2axx n TYR 74 Ca -0.02 -0.07 -0.42 0.00 -0.16 0.00 0.00 57.90 57.23 2axx n TYR 74 Cb 0.30 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.30 2axx n TYR 74 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 2axx s ILE 75 N -1.48 3.13 -0.14 -0.72 -1.16 -0.14 -1.75 121.20 118.94 2axx s ILE 75 Ca 0.24 0.12 0.09 0.00 -0.51 0.00 0.00 60.65 60.60 2axx s ILE 75 Cb 0.16 -3.19 -0.23 0.00 0.61 0.00 0.00 42.46 39.81 2axx s ILE 75 CO 0.24 -0.14 0.28 2.30 -2.81 0.00 0.00 174.94 174.81 2axx n ILE 76 N 7.70 1.55 -3.22 2.00 -5.35 -0.43 -4.94 119.36 116.66 2axx n ILE 76 Ca 0.29 -0.76 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 2axx n ILE 76 Cb 0.47 -1.03 0.00 0.00 -1.74 0.00 0.00 39.64 37.34 2axx n ILE 76 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2axx n GLY 77 N 1.81 0.89 3.15 3.28 0.00 -1.02 -4.58 105.19 108.72 2axx n GLY 77 Ca -0.29 -0.70 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 2axx n GLY 77 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2axx s GLU 78 N -0.11 0.82 0.26 1.61 -1.05 0.11 -0.16 118.70 120.18 2axx s GLU 78 Ca 0.00 -1.29 -0.30 0.00 -0.15 0.00 0.00 54.97 53.23 2axx s GLU 78 Cb 0.00 0.25 -0.11 0.00 -0.44 0.00 0.00 34.13 33.83 2axx s GLU 78 CO 0.00 -0.22 1.60 -1.17 0.95 0.00 0.00 175.26 176.43 2axx s LEU 79 N -2.97 4.36 0.30 1.83 1.98 -1.26 -0.90 118.68 122.01 2axx s LEU 79 Ca 0.15 2.88 -0.27 0.00 -2.89 0.00 0.00 54.13 54.00 2axx s LEU 79 Cb 0.07 -3.62 -0.14 0.00 0.66 0.00 0.00 46.19 43.16 2axx s LEU 79 CO -0.04 -0.90 0.94 1.57 -1.89 0.00 0.00 176.35 176.03 2axx n HIS 80 N 2.69 1.02 1.11 5.38 -0.00 0.53 -4.71 115.22 121.25 2axx n HIS 80 Ca 0.10 0.71 0.08 0.00 -0.00 0.00 0.00 57.72 58.61 2axx n HIS 80 Cb 0.37 -2.21 0.47 0.00 -0.00 0.00 0.00 29.99 28.63 2axx n HIS 80 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2axx n PRO 81 N 0.69 0.56 -0.09 1.57 -0.04 -1.26 -1.36 135.00 135.06 2axx n PRO 81 Ca 0.10 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.44 2axx n PRO 81 Cb 0.32 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.29 2axx n PRO 81 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2axx h ASP 82 N 0.00 0.59 -0.90 3.54 3.58 -1.98 -3.36 116.42 117.89 2axx h ASP 82 Ca 0.00 -0.43 -0.58 0.00 0.42 0.00 0.00 57.03 56.44 2axx h ASP 82 Cb 0.00 -0.16 -0.40 0.00 1.72 0.00 0.00 39.33 40.48 2axx h ASP 82 CO 0.00 0.89 -0.49 -0.67 -2.88 0.00 0.00 179.24 176.09 2axx n ASP 83 N -4.42 5.41 -0.04 2.28 2.03 -0.47 -4.55 116.55 116.80 2axx n ASP 83 Ca -0.04 -3.76 -0.05 0.00 0.52 0.00 0.00 54.79 51.46 2axx n ASP 83 Cb 0.38 -0.47 -0.14 0.00 -0.72 0.00 0.00 41.12 40.17 2axx n ASP 83 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2axx n ARG 84 N -0.72 0.65 -2.48 -0.67 1.85 -1.21 -4.53 116.66 109.56 2axx n ARG 84 Ca 0.47 0.13 -0.31 0.00 -1.00 0.00 0.00 57.85 57.13 2axx n ARG 84 Cb 0.87 -1.68 0.00 0.00 -1.05 0.00 0.00 32.46 30.61 2axx n ARG 84 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2axx n SER 85 N -2.84 5.53 0.08 2.89 2.88 -1.26 -4.56 113.62 116.34 2axx n SER 85 Ca -0.20 -3.74 0.00 0.00 -1.33 0.00 0.00 58.87 53.61 2axx n SER 85 Cb 1.00 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 2axx n SER 85 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2axx n LYS 86 N -0.40 0.00 -1.71 -1.46 4.01 -1.26 -5.08 118.16 112.26 2axx n LYS 86 Ca 0.41 0.00 -0.43 0.00 -0.51 0.00 0.00 58.31 57.78 2axx n LYS 86 Cb 0.47 -0.14 -0.02 0.00 -0.51 0.00 0.00 35.03 34.83 2axx n LYS 86 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 2axx n ILE 87 N -3.22 0.87 -3.58 -0.18 5.41 -1.26 -4.98 119.36 112.41 2axx n ILE 87 Ca 0.00 -0.22 -0.09 0.00 1.00 0.00 0.00 62.75 63.44 2axx n ILE 87 Cb 0.05 -1.77 -0.02 0.00 -0.71 0.00 0.00 39.64 37.19 2axx n ILE 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2axx s ALA 88 N 0.11 -1.56 0.07 -1.39 0.00 -1.26 -5.09 121.76 112.64 2axx s ALA 88 Ca 0.67 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.99 2axx s ALA 88 Cb -0.56 0.76 0.00 0.00 0.00 0.00 0.00 23.12 23.32 2axx s ALA 88 CO 0.47 -0.85 0.00 1.17 0.00 0.00 0.00 175.76 176.55 2axx n LYS 89 N -0.38 -1.94 -2.12 0.00 4.81 -1.26 -4.98 118.16 112.28 2axx n LYS 89 Ca -0.11 1.70 -0.34 0.00 -0.87 0.00 0.00 58.31 58.69 2axx n LYS 89 Cb 0.62 -1.51 0.01 0.00 0.02 0.00 0.00 35.03 34.17 2axx n LYS 89 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2axx s PRO 90 N -2.14 3.21 0.85 1.64 0.04 -1.26 -5.05 135.00 132.29 2axx s PRO 90 Ca 0.00 1.53 -0.08 0.00 0.04 0.00 0.00 61.00 62.49 2axx s PRO 90 Cb 0.00 -1.99 0.18 0.00 0.04 0.00 0.00 34.50 32.72 2axx s PRO 90 CO 0.00 -0.95 1.17 0.45 0.04 0.00 0.00 177.00 177.71 2axx s SER 91 N -2.02 3.63 0.40 6.66 0.15 -1.26 -5.05 113.70 116.20 2axx s SER 91 Ca 0.71 -0.14 -0.25 0.00 0.70 0.00 0.00 55.95 56.97 2axx s SER 91 Cb -0.23 -0.02 -0.08 0.00 -1.71 0.00 0.00 66.02 63.98 2axx s SER 91 CO 0.31 -2.37 1.18 -0.70 1.20 0.00 0.00 173.24 172.87 2axx s GLU 92 N -5.53 4.05 0.00 5.44 2.12 -1.26 -5.00 118.70 118.52 2axx s GLU 92 Ca 0.71 1.87 0.00 0.00 0.36 0.00 0.00 54.97 57.92 2axx s GLU 92 Cb -0.04 -2.69 0.00 0.00 0.26 0.00 0.00 34.13 31.66 2axx s GLU 92 CO 0.49 -0.33 0.00 2.41 -0.54 0.00 0.00 175.26 177.29 2axx n THR 93 N 0.10 0.00 -0.71 -1.70 -1.04 -1.26 -5.04 114.28 104.63 2axx n THR 93 Ca 0.04 0.50 0.00 0.00 -2.04 0.00 0.00 64.05 62.55 2axx n THR 93 Cb 0.46 -1.50 0.00 0.00 -1.82 0.00 0.00 70.33 67.47 2axx n THR 93 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32