#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2axx h LYS 2 N 0.00 -0.14 0.00 0.11 1.79 -2.11 -3.48 116.57 112.74 2axx h LYS 2 Ca 0.00 0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.58 2axx h LYS 2 Cb 0.00 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.66 2axx h LYS 2 CO 0.00 -0.09 -0.13 -0.25 -1.08 0.00 0.00 179.45 177.89 2axx n ASP 3 N -2.77 -6.49 0.00 0.86 8.00 -1.26 -4.91 116.55 109.99 2axx n ASP 3 Ca -0.02 0.40 0.00 0.00 0.71 0.00 0.00 54.79 55.88 2axx n ASP 3 Cb 0.07 -1.13 0.00 0.00 -0.02 0.00 0.00 41.12 40.04 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 -2.52 0.00 -2.93 2.53 0.24 -1.26 -5.08 118.33 109.30 2axx n VAL 4 Ca 0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.16 2axx n VAL 4 Cb 0.17 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 2axx n VAL 4 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2axx n LYS 5 N 0.00 0.76 -1.93 7.34 5.02 -1.26 -4.96 118.16 123.13 2axx n LYS 5 Ca 0.00 -2.37 -0.43 0.00 -2.02 0.00 0.00 58.31 53.50 2axx n LYS 5 Cb 0.00 -1.36 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 2axx n LYS 5 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2axx s TYR 6 N -0.13 1.76 -0.07 2.13 2.02 -1.26 -0.74 117.35 121.07 2axx s TYR 6 Ca 0.33 0.32 0.03 0.00 -0.37 0.00 0.00 57.07 57.38 2axx s TYR 6 Cb 0.21 -4.02 -0.02 0.00 -0.40 0.00 0.00 41.96 37.73 2axx s TYR 6 CO -0.19 -3.73 -0.13 0.71 -1.57 0.00 0.00 175.55 170.64 2axx s TYR 7 N 5.54 2.75 0.59 2.71 2.02 0.36 -4.78 117.35 126.53 2axx s TYR 7 Ca 0.80 -0.24 -0.10 0.00 -0.37 0.00 0.00 57.07 57.17 2axx s TYR 7 Cb -0.30 -1.68 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 2axx s TYR 7 CO 0.33 0.12 0.97 0.95 -1.57 0.00 0.00 175.55 176.34 2axx s THR 8 N -0.51 4.75 0.07 -0.71 -4.23 -1.26 -0.10 115.64 113.64 2axx s THR 8 Ca 0.07 0.70 -0.27 0.00 -1.18 0.00 0.00 61.69 61.01 2axx s THR 8 Cb -0.12 -3.86 -0.12 0.00 1.34 0.00 0.00 72.50 69.74 2axx s THR 8 CO 0.02 -1.07 1.42 -0.07 -0.54 0.00 0.00 174.62 174.38 2axx h LEU 9 N -0.19 -1.14 -0.76 4.79 -0.00 -1.99 -1.09 115.31 114.93 2axx h LEU 9 Ca -0.45 0.11 0.13 0.00 -0.00 0.00 0.00 57.88 57.67 2axx h LEU 9 Cb 1.19 0.40 -0.14 0.00 -0.00 0.00 0.00 40.66 42.12 2axx h LEU 9 CO 0.62 -0.47 -0.34 -0.33 -0.00 0.00 0.00 178.44 177.92 2axx h GLU 10 N -0.68 -0.08 -0.08 1.13 3.07 -1.95 0.36 114.58 116.34 2axx h GLU 10 Ca -0.03 0.01 0.04 0.00 -0.50 0.00 0.00 59.36 58.88 2axx h GLU 10 Cb 0.63 0.02 -0.06 0.00 -0.84 0.00 0.00 28.75 28.50 2axx h GLU 10 CO -0.13 -0.05 -0.39 1.49 -1.40 0.00 0.00 179.01 178.52 2axx h GLU 11 N -0.09 -0.48 -0.93 2.33 4.57 -1.79 0.38 114.58 118.57 2axx h GLU 11 Ca 0.29 0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.53 2axx h GLU 11 Cb 0.57 0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 29.22 2axx h GLU 11 CO -0.81 -0.32 0.61 0.82 -1.18 0.00 0.00 179.01 178.13 2axx h ILE 12 N -0.50 1.20 0.00 2.32 2.04 0.05 0.52 117.51 123.14 2axx h ILE 12 Ca 0.07 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2axx h ILE 12 Cb 0.62 -0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 2axx h ILE 12 CO -0.36 0.22 0.00 1.67 0.00 0.00 0.00 178.15 179.69 2axx n GLN 13 N -4.46 0.14 0.07 2.37 7.27 0.11 -1.14 117.38 121.75 2axx n GLN 13 Ca 0.11 0.41 0.12 0.00 0.07 0.00 0.00 57.00 57.72 2axx n GLN 13 Cb 0.05 -1.79 0.14 0.00 2.41 0.00 0.00 30.24 31.05 2axx n GLN 13 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 2axx h LYS 14 N 0.00 0.00 -2.96 3.69 6.56 0.20 -3.39 116.57 120.67 2axx h LYS 14 Ca 0.00 0.00 -0.74 0.00 -1.06 0.00 0.00 60.65 58.85 2axx h LYS 14 Cb 0.29 0.00 -0.33 0.00 -0.57 0.00 0.00 32.23 31.62 2axx h LYS 14 CO 0.00 0.00 0.26 0.72 -2.06 0.00 0.00 179.45 178.37 2axx n HIS 15 N -2.25 3.45 -2.71 -1.35 8.25 -0.29 -4.70 115.22 115.61 2axx n HIS 15 Ca 0.03 -3.46 -0.07 0.00 -0.26 0.00 0.00 57.72 53.96 2axx n HIS 15 Cb 0.46 -1.16 0.09 0.00 1.12 0.00 0.00 29.99 30.51 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 1.65 0.89 0.00 -0.41 2.85 -0.72 -2.63 118.16 119.80 2axx n LYS 16 Ca 0.25 -1.67 0.00 0.00 -1.05 0.00 0.00 58.31 55.84 2axx n LYS 16 Cb 0.36 -0.65 0.00 0.00 -0.65 0.00 0.00 35.03 34.09 2axx n LYS 16 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2axx n ASP 17 N 0.14 0.00 -3.71 -5.58 -0.08 -1.22 -4.93 116.55 101.16 2axx n ASP 17 Ca 0.01 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.17 2axx n ASP 17 Cb 0.74 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 44.09 2axx n ASP 17 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2axx s SER 18 N -3.46 -0.46 -1.47 1.67 0.01 -1.26 -4.91 113.70 103.82 2axx s SER 18 Ca 0.00 0.82 -0.06 0.00 1.31 0.00 0.00 55.95 58.02 2axx s SER 18 Cb 0.00 0.74 0.05 0.00 0.21 0.00 0.00 66.02 67.01 2axx s SER 18 CO 0.00 -0.17 0.64 0.29 0.41 0.00 0.00 173.24 174.41 2axx n LYS 19 N 3.86 -3.96 -2.68 12.44 5.02 -1.26 -4.88 118.16 126.69 2axx n LYS 19 Ca -0.21 0.47 -0.03 0.00 -2.02 0.00 0.00 58.31 56.52 2axx n LYS 19 Cb 0.56 -4.93 0.03 0.00 -0.02 0.00 0.00 35.03 30.67 2axx n LYS 19 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2axx s SER 20 N -3.97 -0.41 -0.38 4.39 0.01 -1.26 -4.97 113.70 107.11 2axx s SER 20 Ca 0.26 -0.49 -0.03 0.00 1.31 0.00 0.00 55.95 57.01 2axx s SER 20 Cb -0.14 0.54 0.09 0.00 0.21 0.00 0.00 66.02 66.72 2axx s SER 20 CO 0.87 -0.01 0.15 -0.89 0.41 0.00 0.00 173.24 173.77 2axx s THR 21 N 0.97 3.23 0.19 1.44 2.01 -1.26 -1.75 115.64 120.47 2axx s THR 21 Ca 0.24 -1.88 0.07 0.00 0.31 0.00 0.00 61.69 60.43 2axx s THR 21 Cb 0.11 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 2axx s THR 21 CO -0.10 -0.55 0.07 0.26 -0.69 0.00 0.00 174.62 173.61 2axx s TRP 22 N 1.17 2.96 0.10 4.92 0.52 -1.08 -0.45 118.94 127.08 2axx s TRP 22 Ca 0.05 -0.10 -0.24 0.00 0.02 0.00 0.00 56.10 55.83 2axx s TRP 22 Cb -0.22 -1.40 0.06 0.00 -1.15 0.00 0.00 33.47 30.76 2axx s TRP 22 CO -0.03 0.53 0.59 0.14 0.02 0.00 0.00 176.95 178.19 2axx s VAL 23 N -1.85 0.01 -0.29 4.03 -7.23 -0.99 -0.29 120.40 113.79 2axx s VAL 23 Ca 0.30 -0.09 0.03 0.00 -1.81 0.00 0.00 61.98 60.41 2axx s VAL 23 Cb -0.09 -1.01 0.07 0.00 0.56 0.00 0.00 36.38 35.91 2axx s VAL 23 CO 0.21 -0.05 -0.06 -0.63 -0.31 0.00 0.00 175.10 174.27 2axx s ILE 24 N -3.02 2.19 -0.73 -0.62 -1.09 -1.21 -0.45 121.20 116.28 2axx s ILE 24 Ca -0.02 -1.87 -0.04 0.00 -2.23 0.00 0.00 60.65 56.49 2axx s ILE 24 Cb -0.01 -2.41 0.19 0.00 -1.58 0.00 0.00 42.46 38.66 2axx s ILE 24 CO -0.06 -0.22 0.58 -0.76 -1.23 0.00 0.00 174.94 173.25 2axx s LEU 25 N 1.04 5.55 -0.43 2.97 1.43 -0.97 -1.96 118.68 126.31 2axx s LEU 25 Ca -0.02 -3.07 -0.05 0.00 -1.03 0.00 0.00 54.13 49.95 2axx s LEU 25 Cb -0.20 -1.92 0.01 0.00 0.03 0.00 0.00 46.19 44.11 2axx s LEU 25 CO -0.06 -0.35 0.47 1.41 0.23 0.00 0.00 176.35 178.05 2axx n HIS 26 N 3.23 -2.29 -3.67 0.29 8.25 -1.26 -4.39 115.22 115.38 2axx n HIS 26 Ca 0.12 0.90 -0.27 0.00 -0.26 0.00 0.00 57.72 58.21 2axx n HIS 26 Cb 0.39 -3.36 0.02 0.00 1.12 0.00 0.00 29.99 28.16 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 -1.03 -2.03 -3.25 4.41 8.25 -1.26 -4.98 115.22 115.33 2axx n HIS 27 Ca 0.04 0.59 0.03 0.00 -0.26 0.00 0.00 57.72 58.12 2axx n HIS 27 Cb 0.43 -3.28 -0.04 0.00 1.12 0.00 0.00 29.99 28.21 2axx n HIS 27 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2axx s LYS 28 N -5.50 0.10 -0.13 -0.41 1.02 -1.26 -4.68 119.74 108.88 2axx s LYS 28 Ca 0.30 0.26 -0.25 0.00 0.02 0.00 0.00 55.97 56.29 2axx s LYS 28 Cb -0.12 0.15 -0.02 0.00 -0.52 0.00 0.00 37.83 37.32 2axx s LYS 28 CO 0.87 -0.04 0.79 0.08 -0.92 0.00 0.00 175.35 176.14 2axx s VAL 29 N 2.12 4.94 -0.22 3.17 1.01 -1.21 -2.28 120.40 127.92 2axx s VAL 29 Ca -0.01 1.59 -0.04 0.00 0.00 0.00 0.00 61.98 63.52 2axx s VAL 29 Cb -0.02 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 2axx s VAL 29 CO -0.16 0.11 -0.03 -0.31 0.00 0.00 0.00 175.10 174.70 2axx s TYR 30 N 1.66 2.97 -0.45 5.22 1.51 0.41 -2.77 117.35 125.89 2axx s TYR 30 Ca 0.39 -0.87 -0.25 0.00 -1.01 0.00 0.00 57.07 55.32 2axx s TYR 30 Cb -0.17 -2.11 0.03 0.00 -0.11 0.00 0.00 41.96 39.59 2axx s TYR 30 CO 0.15 -0.52 0.91 0.34 -1.11 0.00 0.00 175.55 175.32 2axx s ASP 31 N 1.47 6.50 -0.39 2.29 -1.08 -1.12 -2.36 116.67 121.98 2axx s ASP 31 Ca 0.06 0.12 0.05 0.00 -0.52 0.00 0.00 52.55 52.26 2axx s ASP 31 Cb -0.14 -2.44 0.45 0.00 -1.46 0.00 0.00 42.92 39.32 2axx s ASP 31 CO -0.02 -1.03 1.31 0.18 0.52 0.00 0.00 175.17 176.13 2axx n LEU 32 N 7.10 5.33 -0.03 -1.34 4.77 0.41 -4.77 117.00 128.47 2axx n LEU 32 Ca 0.06 -4.80 -0.17 0.00 -0.03 0.00 0.00 56.01 51.07 2axx n LEU 32 Cb 0.48 -0.48 -0.07 0.00 -2.33 0.00 0.00 43.42 41.02 2axx n LEU 32 CO 0.63 2.05 0.30 0.74 -1.33 0.00 0.00 177.39 179.78 2axx h THR 33 N 2.12 1.30 -0.63 -5.08 2.02 -1.91 -3.03 112.91 107.70 2axx h THR 33 Ca 0.39 -1.91 -0.07 0.00 0.77 0.00 0.00 66.41 65.59 2axx h THR 33 Cb 1.25 2.03 -0.04 0.00 -1.74 0.00 0.00 68.15 69.65 2axx h THR 33 CO 0.91 0.60 0.09 0.29 0.37 0.00 0.00 175.52 177.78 2axx n LYS 34 N -4.03 4.53 0.00 6.66 5.02 -1.26 -4.11 118.16 124.96 2axx n LYS 34 Ca -0.08 -3.11 0.00 0.00 -2.02 0.00 0.00 58.31 53.11 2axx n LYS 34 Cb 0.70 -2.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 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 0.39 0.00 0.22 2.13 7.35 -1.15 -4.64 117.46 121.75 2axx n PHE 35 Ca 0.32 -0.15 -0.15 0.00 -0.76 0.00 0.00 57.45 56.70 2axx n PHE 35 Cb 1.26 -0.02 -0.07 0.00 0.35 0.00 0.00 39.48 41.00 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 0.00 -0.88 0.14 -2.13 3.38 -1.69 -1.03 115.31 113.11 2axx h LEU 36 Ca 0.00 0.07 -0.20 0.00 0.09 0.00 0.00 57.88 57.84 2axx h LEU 36 Cb 0.23 0.29 0.02 0.00 0.09 0.00 0.00 40.66 41.29 2axx h LEU 36 CO 0.00 -0.47 -0.92 -0.33 0.09 0.00 0.00 178.44 176.81 2axx h GLU 37 N -0.70 0.30 -0.88 1.13 4.39 -1.87 -2.64 114.58 114.31 2axx h GLU 37 Ca -0.02 -0.51 0.20 0.00 0.34 0.00 0.00 59.36 59.37 2axx h GLU 37 Cb 0.63 0.19 -0.12 0.00 -0.10 0.00 0.00 28.75 29.35 2axx h GLU 37 CO -0.05 1.25 0.39 0.93 -1.16 0.00 0.00 179.01 180.37 2axx h GLU 38 N -0.35 0.43 -6.13 2.33 4.39 -1.82 -3.42 114.58 110.00 2axx h GLU 38 Ca -0.17 -0.03 -0.76 0.00 0.34 0.00 0.00 59.36 58.75 2axx h GLU 38 Cb 1.68 -0.10 0.02 0.00 -0.10 0.00 0.00 28.75 30.25 2axx h GLU 38 CO 0.14 0.28 0.78 1.58 -1.16 0.00 0.00 179.01 180.64 2axx n HIS 39 N -5.01 1.89 -1.40 4.33 -0.00 -0.39 -4.79 115.22 109.85 2axx n HIS 39 Ca 0.21 0.67 -0.42 0.00 0.46 0.00 0.00 57.72 58.63 2axx n HIS 39 Cb 0.60 -2.39 -0.04 0.00 -0.12 0.00 0.00 29.99 28.04 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 4.67 1.92 0.00 1.57 -0.04 -1.26 -1.36 135.00 140.50 2axx n PRO 40 Ca 0.26 -2.13 0.00 0.00 -0.04 0.00 0.00 63.50 61.59 2axx n PRO 40 Cb 0.10 -3.08 0.00 0.00 -0.04 0.00 0.00 33.50 30.48 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 4.51 0.01 0.00 0.55 0.00 -1.26 -5.17 105.19 103.83 2axx n GLY 41 Ca 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -0.24 0.93 0.16 -0.02 0.00 -0.46 -4.90 105.19 100.66 2axx n GLY 42 Ca 0.00 -1.95 -0.14 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.12 0.43 0.09 1.61 0.00 -0.99 -4.49 120.64 117.16 2axx n GLU 43 Ca 0.00 0.12 -0.12 0.00 0.00 0.00 0.00 57.16 57.16 2axx n GLU 43 Cb 0.00 -1.31 -0.05 0.00 0.00 0.00 0.00 31.44 30.08 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 -0.15 -0.31 -0.84 5.31 4.81 -1.91 0.33 114.58 121.82 2axx h GLU 44 Ca -0.41 0.02 0.20 0.00 -0.13 0.00 0.00 59.36 59.04 2axx h GLU 44 Cb 1.56 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.96 2axx h GLU 44 CO -0.11 -0.20 0.57 -0.39 -0.73 0.00 0.00 179.01 178.14 2axx h VAL 45 N -0.32 0.67 -0.04 0.32 -1.51 -1.90 0.41 116.25 113.89 2axx h VAL 45 Ca 0.03 -0.09 -0.14 0.00 -1.23 0.00 0.00 66.70 65.27 2axx h VAL 45 Cb 0.35 0.38 0.01 0.00 -2.13 0.00 0.00 31.29 29.89 2axx h VAL 45 CO -0.11 0.05 -0.51 -0.07 -1.23 0.00 0.00 177.57 175.70 2axx h LEU 46 N 0.27 0.51 0.00 4.19 4.07 -1.01 -3.25 115.31 120.09 2axx h LEU 46 Ca 0.42 -0.71 0.00 0.00 0.08 0.00 0.00 57.88 57.67 2axx h LEU 46 Cb 1.23 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.81 2axx h LEU 46 CO -0.11 1.15 0.00 0.54 -1.08 0.00 0.00 178.44 178.94 2axx n ARG 47 N -4.27 0.87 -0.10 1.13 1.74 0.86 -2.18 116.66 114.72 2axx n ARG 47 Ca -0.09 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.79 2axx n ARG 47 Cb 0.62 -1.42 -0.11 0.00 -1.02 0.00 0.00 32.46 30.53 2axx n ARG 47 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2axx h GLU 48 N 0.00 0.00 0.00 5.56 4.39 -0.36 -3.38 114.58 120.80 2axx h GLU 48 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2axx h GLU 48 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2axx h GLU 48 CO 0.00 0.94 -0.60 0.94 -1.16 0.00 0.00 179.01 179.13 2axx n GLN 49 N -4.47 0.29 -1.47 2.33 0.00 -1.23 -4.95 117.38 107.89 2axx n GLN 49 Ca -0.28 0.09 -0.48 0.00 -0.00 0.00 0.00 57.00 56.33 2axx n GLN 49 Cb 0.63 -1.69 -0.03 0.00 0.00 0.00 0.00 30.24 29.15 2axx n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2axx n ALA 50 N -1.82 -2.12 -2.15 1.69 0.00 -0.92 -3.92 120.51 111.26 2axx n ALA 50 Ca 0.03 0.44 -0.02 0.00 0.00 0.00 0.00 53.44 53.89 2axx n ALA 50 Cb 0.44 -1.75 0.00 0.00 0.00 0.00 0.00 19.45 18.14 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 1.77 -0.87 0.00 0.00 0.00 0.61 -4.88 105.19 101.82 2axx n GLY 51 Ca 0.16 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -0.81 4.11 3.55 -0.02 0.00 -1.25 -4.85 105.19 105.92 2axx n GLY 52 Ca 0.03 -1.47 -0.45 0.00 0.00 0.00 0.00 46.02 44.13 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 2.90 -1.12 1.61 9.92 -1.26 -3.31 116.55 125.29 2axx n ASP 53 Ca 0.00 0.27 0.12 0.00 -0.53 0.00 0.00 54.79 54.64 2axx n ASP 53 Cb 0.00 -1.46 0.24 0.00 -0.64 0.00 0.00 41.12 39.25 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 11.13 2.43 -0.10 2.24 0.00 -0.83 -4.49 120.51 130.89 2axx n ALA 54 Ca 0.34 -0.97 -0.10 0.00 0.00 0.00 0.00 53.44 52.70 2axx n ALA 54 Cb 0.38 -0.90 -0.05 0.00 0.00 0.00 0.00 19.45 18.88 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 4.25 0.12 0.00 0.00 2.02 -1.77 -0.84 112.91 116.70 2axx h THR 55 Ca 0.00 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.98 2axx h THR 55 Cb 0.94 0.12 -0.05 0.00 -1.74 0.00 0.00 68.15 67.42 2axx h THR 55 CO 0.00 0.00 0.09 -0.62 0.37 0.00 0.00 175.52 175.36 2axx n GLU 56 N -5.42 1.84 0.06 6.66 1.02 -1.26 -2.27 120.64 121.27 2axx n GLU 56 Ca -0.01 -0.95 0.00 0.00 -0.02 0.00 0.00 57.16 56.17 2axx n GLU 56 Cb 0.35 -2.00 0.00 0.00 -0.02 0.00 0.00 31.44 29.78 2axx n GLU 56 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2axx n ASN 57 N 2.69 -0.93 0.05 1.62 2.85 -0.42 -4.89 115.26 116.23 2axx n ASN 57 Ca 0.40 0.23 -0.10 0.00 -0.11 0.00 0.00 54.58 54.99 2axx n ASN 57 Cb 0.73 1.16 0.03 0.00 1.24 0.00 0.00 39.78 42.93 2axx n ASN 57 CO 0.00 0.00 0.00 2.19 -2.11 0.00 0.00 177.26 177.34 2axx h PHE 58 N 0.00 0.56 -0.13 1.20 -5.15 -1.25 -3.26 116.94 108.92 2axx h PHE 58 Ca 0.00 -0.25 -0.12 0.00 -0.20 0.00 0.00 57.97 57.40 2axx h PHE 58 Cb 0.00 -0.09 -0.01 0.00 0.22 0.00 0.00 35.95 36.07 2axx h PHE 58 CO 0.00 1.00 -0.47 0.93 -2.00 0.00 0.00 178.31 177.77 2axx h GLU 59 N 0.29 0.32 -0.63 6.09 4.39 -1.68 -2.47 114.58 120.89 2axx h GLU 59 Ca -0.03 -0.17 0.11 0.00 0.34 0.00 0.00 59.36 59.61 2axx h GLU 59 Cb 1.29 0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 29.83 2axx h GLU 59 CO 0.12 0.72 -0.33 0.22 -1.16 0.00 0.00 179.01 178.59 2axx h ASP 60 N 0.26 -1.14 -0.53 1.42 3.58 -1.79 0.81 116.42 119.02 2axx h ASP 60 Ca 0.02 0.23 -0.01 0.00 0.42 0.00 0.00 57.03 57.69 2axx h ASP 60 Cb 0.92 0.58 -0.02 0.00 1.72 0.00 0.00 39.33 42.53 2axx h ASP 60 CO 0.08 -0.30 0.28 0.58 -2.88 0.00 0.00 179.24 177.00 2axx h VAL 61 N -0.14 1.18 0.00 2.25 2.07 -1.66 -3.48 116.25 116.47 2axx h VAL 61 Ca 0.25 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.29 2axx h VAL 61 Cb 0.55 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 2axx h VAL 61 CO -0.70 0.20 0.00 0.61 0.02 0.00 0.00 177.57 177.69 2axx n GLY 62 N -1.00 2.20 1.67 2.17 0.00 0.27 -5.05 105.19 105.46 2axx n GLY 62 Ca 0.03 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 0.00 -4.46 -4.00 1.61 8.25 -1.26 -4.50 115.22 110.87 2axx n HIS 63 Ca 0.00 2.39 0.00 0.00 -0.26 0.00 0.00 57.72 59.85 2axx n HIS 63 Cb 0.00 -3.57 0.00 0.00 1.12 0.00 0.00 29.99 27.55 2axx n HIS 63 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2axx n SER 64 N -1.34 -0.09 0.00 0.41 2.88 -1.26 -4.86 113.62 109.36 2axx n SER 64 Ca 0.00 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.54 2axx n SER 64 Cb 0.12 0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 2axx n SER 64 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2axx n THR 65 N -0.09 0.00 -0.00 2.46 -1.04 -1.26 -2.91 114.28 111.44 2axx n THR 65 Ca 0.01 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.98 2axx n THR 65 Cb 0.05 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.55 2axx n THR 65 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2axx n ASP 66 N 2.74 1.20 -0.36 8.00 8.00 -1.26 -4.69 116.55 130.17 2axx n ASP 66 Ca 0.00 0.18 0.27 0.00 0.71 0.00 0.00 54.79 55.94 2axx n ASP 66 Cb 0.00 -0.41 0.54 0.00 -0.02 0.00 0.00 41.12 41.23 2axx n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2axx h ALA 67 N -0.30 2.32 0.16 2.24 0.00 -1.90 0.74 119.26 122.53 2axx h ALA 67 Ca -0.04 0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2axx h ALA 67 Cb 0.48 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 2axx h ALA 67 CO -0.03 -0.82 -0.51 0.00 0.00 0.00 0.00 179.25 177.90 2axx h ARG 68 N 0.31 -0.74 -0.22 0.00 -0.00 -1.87 0.17 114.38 112.03 2axx h ARG 68 Ca 0.68 0.05 0.00 0.00 -0.50 0.00 0.00 59.98 60.21 2axx h ARG 68 Cb 1.82 0.17 0.00 0.00 0.00 0.00 0.00 29.97 31.95 2axx h ARG 68 CO -0.38 -0.49 0.00 -0.85 0.00 0.00 0.00 179.97 178.25 2axx n GLU 69 N -5.49 1.60 -0.04 0.04 0.28 0.23 -4.09 120.64 113.16 2axx n GLU 69 Ca -0.09 -0.92 -0.07 0.00 -0.16 0.00 0.00 57.16 55.92 2axx n GLU 69 Cb 0.41 -1.27 -0.03 0.00 1.43 0.00 0.00 31.44 31.99 2axx n GLU 69 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2axx n LEU 70 N 0.20 1.47 -0.19 -1.84 7.94 0.66 -4.14 117.00 121.10 2axx n LEU 70 Ca 0.11 0.04 -0.00 0.00 -1.11 0.00 0.00 56.01 55.06 2axx n LEU 70 Cb 0.24 -0.23 0.09 0.00 0.53 0.00 0.00 43.42 44.05 2axx n LEU 70 CO 0.08 0.33 0.84 0.77 -1.11 0.00 0.00 177.39 178.31 2axx h SER 71 N -0.17 -0.25 -0.81 1.96 4.64 -0.84 0.10 113.55 118.18 2axx h SER 71 Ca -0.18 0.14 0.06 0.00 -0.47 0.00 0.00 61.79 61.35 2axx h SER 71 Cb 1.20 0.25 -0.06 0.00 -0.31 0.00 0.00 62.40 63.47 2axx h SER 71 CO -0.08 -0.10 0.49 0.11 -0.87 0.00 0.00 176.83 176.38 2axx h LYS 72 N 0.12 0.86 0.00 4.77 1.79 -1.77 0.31 116.57 122.65 2axx h LYS 72 Ca 0.30 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.72 2axx h LYS 72 Cb 0.47 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 2axx h LYS 72 CO -0.49 0.57 0.05 1.15 -1.08 0.00 0.00 179.45 179.65 2axx h THR 73 N 0.89 0.00 -0.06 -0.16 2.02 -1.16 -0.81 112.91 113.64 2axx h THR 73 Ca 0.36 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.54 2axx h THR 73 Cb 0.20 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2axx h THR 73 CO -0.18 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.49 2axx n TYR 74 N -2.60 0.05 -1.98 3.16 4.01 0.97 -4.99 117.16 115.79 2axx n TYR 74 Ca -0.02 -0.04 -0.42 0.00 -0.16 0.00 0.00 57.90 57.26 2axx n TYR 74 Cb 0.10 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.10 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 -1.29 3.06 -0.24 -0.72 -1.16 -0.31 -2.79 121.20 117.74 2axx s ILE 75 Ca 0.20 0.58 -0.08 0.00 -0.51 0.00 0.00 60.65 60.84 2axx s ILE 75 Cb 0.13 -3.37 -0.12 0.00 0.61 0.00 0.00 42.46 39.71 2axx s ILE 75 CO 0.20 0.01 -0.28 2.30 -2.81 0.00 0.00 174.94 174.36 2axx n ILE 76 N 4.54 1.34 0.00 2.00 -5.35 -1.12 -4.95 119.36 115.82 2axx n ILE 76 Ca 0.15 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 2axx n ILE 76 Cb 0.41 -1.66 0.00 0.00 -1.74 0.00 0.00 39.64 36.65 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 1.78 2.34 3.75 3.28 0.00 -1.23 -4.39 105.19 110.71 2axx n GLY 77 Ca -0.46 0.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.59 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 4.06 1.67 0.32 1.61 -1.05 0.08 -3.31 118.70 122.08 2axx s GLU 78 Ca 0.00 -0.95 -0.28 0.00 -0.15 0.00 0.00 54.97 53.58 2axx s GLU 78 Cb 0.00 0.58 -0.09 0.00 -0.44 0.00 0.00 34.13 34.18 2axx s GLU 78 CO 0.00 -0.75 1.13 -0.51 0.95 0.00 0.00 175.26 176.08 2axx s LEU 79 N -2.91 4.44 0.38 1.83 1.43 -1.26 -0.48 118.68 122.11 2axx s LEU 79 Ca 0.11 2.30 -0.25 0.00 -1.03 0.00 0.00 54.13 55.26 2axx s LEU 79 Cb -0.04 -3.75 -0.12 0.00 0.03 0.00 0.00 46.19 42.31 2axx s LEU 79 CO 0.04 -0.30 0.99 1.57 0.23 0.00 0.00 176.35 178.87 2axx n HIS 80 N 0.84 1.13 0.30 0.29 -0.00 0.86 -4.67 115.22 113.96 2axx n HIS 80 Ca 0.00 0.60 0.17 0.00 0.46 0.00 0.00 57.72 58.95 2axx n HIS 80 Cb 0.45 -2.22 0.76 0.00 -0.12 0.00 0.00 29.99 28.85 2axx n HIS 80 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2axx h PRO 81 N 1.65 0.00 -0.66 1.57 0.13 -1.93 -2.73 132.00 130.03 2axx h PRO 81 Ca -0.43 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.83 2axx h PRO 81 Cb 1.34 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.38 2axx h PRO 81 CO 0.58 0.00 0.15 0.22 -0.23 0.00 0.00 178.00 178.72 2axx h ASP 82 N 0.00 0.01 -0.43 1.44 3.58 -1.98 -2.56 116.42 116.48 2axx h ASP 82 Ca 0.00 0.12 -0.28 0.00 0.42 0.00 0.00 57.03 57.30 2axx h ASP 82 Cb 0.28 0.17 -0.18 0.00 1.72 0.00 0.00 39.33 41.32 2axx h ASP 82 CO 0.00 -0.00 -0.29 -0.67 -2.88 0.00 0.00 179.24 175.40 2axx n ASP 83 N -5.13 3.33 -0.06 2.28 2.03 -1.03 -4.63 116.55 113.33 2axx n ASP 83 Ca 0.11 -3.81 -0.21 0.00 0.52 0.00 0.00 54.79 51.40 2axx n ASP 83 Cb 0.37 -0.57 -0.12 0.00 -0.72 0.00 0.00 41.12 40.08 2axx n ASP 83 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2axx h ARG 84 N 1.38 0.09 -1.99 -0.67 2.43 -1.42 -3.30 114.38 110.90 2axx h ARG 84 Ca 0.25 -0.15 -0.27 0.00 -0.81 0.00 0.00 59.98 58.99 2axx h ARG 84 Cb 1.42 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 30.93 2axx h ARG 84 CO 0.50 1.07 -0.14 0.45 -1.51 0.00 0.00 179.97 180.34 2axx n SER 85 N -4.21 5.61 0.00 -3.80 2.88 -1.26 -3.99 113.62 108.86 2axx n SER 85 Ca -0.29 -2.69 0.00 0.00 -1.33 0.00 0.00 58.87 54.56 2axx n SER 85 Cb 0.76 -1.35 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 2axx n SER 85 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2axx n LYS 86 N 1.97 0.00 -3.42 -1.46 4.81 -1.26 -5.11 118.16 113.68 2axx n LYS 86 Ca 0.43 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.56 2axx n LYS 86 Cb 0.79 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.88 2axx n LYS 86 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2axx n ILE 87 N -2.12 -3.91 -3.65 3.15 2.08 -1.24 -5.02 119.36 108.65 2axx n ILE 87 Ca 0.00 0.20 -0.04 0.00 0.56 0.00 0.00 62.75 63.47 2axx n ILE 87 Cb 0.00 -3.61 -0.06 0.00 -0.75 0.00 0.00 39.64 35.22 2axx n ILE 87 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2axx s ALA 88 N -1.42 -1.77 0.03 -1.39 0.00 -1.26 -5.16 121.76 110.79 2axx s ALA 88 Ca 0.31 2.10 -0.17 0.00 0.00 0.00 0.00 51.96 54.20 2axx s ALA 88 Cb -0.03 -1.61 0.03 0.00 0.00 0.00 0.00 23.12 21.51 2axx s ALA 88 CO 0.72 -0.83 0.39 0.15 0.00 0.00 0.00 175.76 176.19 2axx s LYS 89 N 2.71 0.87 -0.57 0.00 1.02 -1.26 -5.11 119.74 117.39 2axx s LYS 89 Ca -0.05 -0.33 -0.27 0.00 0.02 0.00 0.00 55.97 55.34 2axx s LYS 89 Cb -0.11 0.39 -0.00 0.00 -0.52 0.00 0.00 37.83 37.58 2axx s LYS 89 CO -0.17 -0.28 1.63 -1.25 -0.92 0.00 0.00 175.35 174.35 2axx s PRO 90 N -2.23 3.02 0.76 -1.68 0.04 -1.26 -5.00 135.00 128.65 2axx s PRO 90 Ca -0.07 0.56 -0.12 0.00 0.04 0.00 0.00 61.00 61.41 2axx s PRO 90 Cb -0.01 -4.25 0.05 0.00 0.04 0.00 0.00 34.50 30.33 2axx s PRO 90 CO -0.01 -2.28 1.11 -1.54 0.04 0.00 0.00 177.00 174.33 2axx s SER 91 N 6.06 4.44 0.46 6.66 1.04 -1.26 -5.08 113.70 126.02 2axx s SER 91 Ca 0.60 1.95 0.07 0.00 0.48 0.00 0.00 55.95 59.05 2axx s SER 91 Cb -0.13 -2.54 -0.00 0.00 0.10 0.00 0.00 66.02 63.45 2axx s SER 91 CO 0.23 -2.08 0.36 -1.83 0.98 0.00 0.00 173.24 170.90 2axx s GLU 92 N -4.59 2.39 -0.06 4.02 -1.05 -1.26 -5.14 118.70 113.00 2axx s GLU 92 Ca 0.64 -1.74 0.06 0.00 -0.15 0.00 0.00 54.97 53.78 2axx s GLU 92 Cb -0.20 -2.23 -0.01 0.00 -0.44 0.00 0.00 34.13 31.25 2axx s GLU 92 CO 0.52 -0.33 -0.24 0.99 0.95 0.00 0.00 175.26 177.14 2axx s THR 93 N -2.59 2.13 0.00 1.83 2.01 -1.26 -5.20 115.64 112.56 2axx s THR 93 Ca 0.43 -1.04 0.00 0.00 0.31 0.00 0.00 61.69 61.39 2axx s THR 93 Cb -0.02 -1.78 0.00 0.00 0.01 0.00 0.00 72.50 70.72 2axx s THR 93 CO 0.25 0.57 0.00 -0.11 -0.69 0.00 0.00 174.62 174.64