#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ax5 s VAL 2 N 0.00 2.37 -0.21 1.12 0.11 -1.26 -4.83 120.40 117.70 2ax5 s VAL 2 Ca 0.00 -1.48 -0.07 0.00 -2.93 0.00 0.00 61.98 57.50 2ax5 s VAL 2 Cb 0.00 -2.34 -0.03 0.00 -1.53 0.00 0.00 36.38 32.47 2ax5 s VAL 2 CO 0.00 0.02 0.05 0.20 -3.33 0.00 0.00 175.10 172.05 2ax5 s ASN 3 N 1.16 5.28 -0.24 3.54 0.02 -1.26 -3.94 114.94 119.52 2ax5 s ASN 3 Ca -0.06 -0.09 0.01 0.00 -1.02 0.00 0.00 52.86 51.70 2ax5 s ASN 3 Cb -0.19 -1.92 0.06 0.00 0.02 0.00 0.00 41.25 39.22 2ax5 s ASN 3 CO -0.05 0.07 -0.06 -0.69 0.02 0.00 0.00 177.10 176.39 2ax5 s VAL 4 N 0.98 1.59 -0.40 1.60 1.01 -0.77 -0.57 120.40 123.84 2ax5 s VAL 4 Ca 0.03 -1.26 -0.26 0.00 0.00 0.00 0.00 61.98 60.49 2ax5 s VAL 4 Cb -0.14 -1.84 0.02 0.00 0.00 0.00 0.00 36.38 34.42 2ax5 s VAL 4 CO 0.03 -0.09 0.97 -0.75 0.00 0.00 0.00 175.10 175.26 2ax5 s LYS 5 N 1.37 3.78 -0.05 2.72 2.36 -1.20 -1.13 119.74 127.58 2ax5 s LYS 5 Ca -0.06 0.52 0.03 0.00 -2.55 0.00 0.00 55.97 53.91 2ax5 s LYS 5 Cb -0.19 -3.84 -0.03 0.00 -1.05 0.00 0.00 37.83 32.73 2ax5 s LYS 5 CO -0.06 -1.06 -0.13 0.14 1.55 0.00 0.00 175.35 175.79 2ax5 s VAL 6 N 3.68 3.20 -0.27 4.02 -7.23 -0.55 -1.25 120.40 122.00 2ax5 s VAL 6 Ca 0.40 -0.67 -0.05 0.00 -1.81 0.00 0.00 61.98 59.85 2ax5 s VAL 6 Cb -0.11 -2.27 0.01 0.00 0.56 0.00 0.00 36.38 34.58 2ax5 s VAL 6 CO 0.22 0.59 0.03 -1.61 -0.31 0.00 0.00 175.10 174.02 2ax5 s GLU 7 N -0.73 3.05 -0.23 4.82 2.02 -0.87 0.02 118.70 126.78 2ax5 s GLU 7 Ca 0.11 -0.87 -0.14 0.00 0.02 0.00 0.00 54.97 54.10 2ax5 s GLU 7 Cb -0.11 -3.22 -0.04 0.00 0.10 0.00 0.00 34.13 30.86 2ax5 s GLU 7 CO 0.01 -0.40 0.32 -0.06 0.02 0.00 0.00 175.26 175.14 2ax5 s PHE 8 N 1.45 3.33 0.21 1.61 0.08 -0.40 0.77 117.98 125.03 2ax5 s PHE 8 Ca 0.02 0.45 0.08 0.00 0.12 0.00 0.00 56.93 57.60 2ax5 s PHE 8 Cb -0.17 -2.45 -0.05 0.00 -0.57 0.00 0.00 43.02 39.78 2ax5 s PHE 8 CO -0.00 -0.03 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.42 2ax5 s LEU 9 N 1.39 2.55 0.00 -0.37 1.02 0.54 -4.46 118.68 119.35 2ax5 s LEU 9 Ca 0.14 -1.01 0.00 0.00 0.02 0.00 0.00 54.13 53.28 2ax5 s LEU 9 Cb -0.15 -0.75 0.00 0.00 0.02 0.00 0.00 46.19 45.32 2ax5 s LEU 9 CO 0.07 -0.13 0.00 0.61 0.02 0.00 0.00 176.35 176.92 2ax5 n GLY 10 N -0.37 1.34 1.68 -3.19 0.00 -1.26 -2.13 105.19 101.25 2ax5 n GLY 10 Ca -0.08 -0.58 -0.06 0.00 0.00 0.00 0.00 46.02 45.30 2ax5 n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ax5 n GLY 11 N 0.00 4.28 0.17 -0.02 0.00 -1.26 -4.78 105.19 103.58 2ax5 n GLY 11 Ca 0.00 -1.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.18 2ax5 n GLY 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ax5 n LEU 12 N -0.61 2.54 0.25 0.99 4.77 -1.25 -4.49 117.00 119.19 2ax5 n LEU 12 Ca 0.23 0.01 0.11 0.00 -0.03 0.00 0.00 56.01 56.34 2ax5 n LEU 12 Cb 0.88 -0.70 0.73 0.00 -2.33 0.00 0.00 43.42 42.00 2ax5 n LEU 12 CO 0.14 0.73 1.10 -2.24 -1.33 0.00 0.00 177.39 175.78 2ax5 h ASP 13 N -0.25 0.00 -0.39 -1.43 3.04 -1.82 -1.53 116.42 114.04 2ax5 h ASP 13 Ca -0.49 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.27 2ax5 h ASP 13 Cb 1.64 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.91 2ax5 h ASP 13 CO -0.16 0.00 0.15 0.00 -2.04 0.00 0.00 179.24 177.19 2ax5 h ALA 14 N 1.96 1.43 -0.10 4.15 0.00 -1.90 0.12 119.26 124.93 2ax5 h ALA 14 Ca 0.03 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.58 2ax5 h ALA 14 Cb 0.11 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.72 2ax5 h ALA 14 CO -0.00 0.43 -0.81 0.82 0.00 0.00 0.00 179.25 179.69 2ax5 h ILE 15 N 0.64 1.32 0.00 0.00 2.04 -1.52 -3.38 117.51 116.61 2ax5 h ILE 15 Ca 0.15 -2.10 0.00 0.00 1.00 0.00 0.00 64.86 63.91 2ax5 h ILE 15 Cb 0.17 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 2ax5 h ILE 15 CO -0.01 0.65 0.00 0.49 0.00 0.00 0.00 178.15 179.28 2ax5 n PHE 16 N -3.88 0.00 0.00 1.37 3.72 -1.00 -4.94 117.46 112.73 2ax5 n PHE 16 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 2ax5 n PHE 16 Cb 0.76 -0.48 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 2ax5 n PHE 16 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ax5 n GLY 17 N 0.47 0.00 2.90 1.37 0.00 -0.53 -4.97 105.19 104.44 2ax5 n GLY 17 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2ax5 n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ax5 n LYS 18 N 0.00 -3.58 -4.95 1.61 4.76 0.32 -4.97 118.16 111.34 2ax5 n LYS 18 Ca 0.00 0.78 -0.30 0.00 -2.87 0.00 0.00 58.31 55.92 2ax5 n LYS 18 Cb 0.00 -5.53 -0.17 0.00 -1.84 0.00 0.00 35.03 27.49 2ax5 n LYS 18 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2ax5 s GLN 19 N -5.56 2.65 -0.07 1.97 -1.52 -1.25 -5.00 119.66 110.88 2ax5 s GLN 19 Ca 0.23 -0.74 -0.02 0.00 -1.95 0.00 0.00 55.36 52.88 2ax5 s GLN 19 Cb -0.11 -2.06 -0.01 0.00 -0.22 0.00 0.00 33.01 30.62 2ax5 s GLN 19 CO 0.28 0.10 -0.04 0.00 -0.25 0.00 0.00 175.29 175.39 2ax5 h ARG 20 N 6.90 0.00 -6.56 2.91 3.08 -1.92 -3.43 114.38 115.36 2ax5 h ARG 20 Ca -0.24 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.26 2ax5 h ARG 20 Cb 1.22 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.19 2ax5 h ARG 20 CO 0.48 0.00 0.99 0.08 -1.07 0.00 0.00 179.97 180.45 2ax5 s VAL 21 N -1.46 3.98 0.47 2.04 1.01 -1.26 -1.28 120.40 123.91 2ax5 s VAL 21 Ca -0.03 0.87 0.06 0.00 0.00 0.00 0.00 61.98 62.88 2ax5 s VAL 21 Cb 0.00 -4.71 -0.01 0.00 0.00 0.00 0.00 36.38 31.67 2ax5 s VAL 21 CO 0.04 -1.34 0.30 -1.00 0.00 0.00 0.00 175.10 173.10 2ax5 s HIS 22 N 5.08 2.22 -0.03 5.22 3.76 0.10 -4.95 115.29 126.70 2ax5 s HIS 22 Ca 0.44 -0.68 0.03 0.00 -0.15 0.00 0.00 55.06 54.69 2ax5 s HIS 22 Cb -0.08 -1.97 0.00 0.00 1.11 0.00 0.00 32.58 31.64 2ax5 s HIS 22 CO 0.25 -0.13 -0.10 -1.59 -0.85 0.00 0.00 174.74 172.33 2ax5 s LYS 23 N -4.09 1.02 0.15 1.40 -2.85 -1.26 -1.49 119.74 112.63 2ax5 s LYS 23 Ca 0.38 -0.34 0.10 0.00 -1.00 0.00 0.00 55.97 55.11 2ax5 s LYS 23 Cb -0.00 -0.95 -0.04 0.00 -2.06 0.00 0.00 37.83 34.78 2ax5 s LYS 23 CO 0.22 0.14 -0.20 0.42 0.10 0.00 0.00 175.35 176.03 2ax5 s ILE 24 N 0.13 2.63 -0.29 3.79 -1.09 -0.29 -4.93 121.20 121.15 2ax5 s ILE 24 Ca -0.02 -1.75 0.01 0.00 -2.23 0.00 0.00 60.65 56.66 2ax5 s ILE 24 Cb -0.08 -2.23 0.15 0.00 -1.58 0.00 0.00 42.46 38.71 2ax5 s ILE 24 CO 0.00 -0.01 0.36 -0.75 -1.23 0.00 0.00 174.94 173.32 2ax5 s LYS 25 N -2.41 0.39 -0.06 2.79 2.20 -1.25 -1.85 119.74 119.54 2ax5 s LYS 25 Ca 0.19 -0.03 -0.21 0.00 -0.36 0.00 0.00 55.97 55.56 2ax5 s LYS 25 Cb -0.09 -0.46 -0.17 0.00 -1.51 0.00 0.00 37.83 35.60 2ax5 s LYS 25 CO 0.10 -1.04 0.87 1.98 -0.36 0.00 0.00 175.35 176.90 2ax5 h MET 26 N 8.15 -0.16 -5.54 4.03 4.05 -1.95 -3.50 114.93 120.01 2ax5 h MET 26 Ca -0.10 0.01 -0.07 0.00 -0.28 0.00 0.00 59.70 59.26 2ax5 h MET 26 Cb 1.10 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.94 2ax5 h MET 26 CO 0.29 0.31 -0.46 -0.25 0.23 0.00 0.00 176.91 177.04 2ax5 n ASP 27 N -4.88 -7.45 0.03 1.39 8.00 -1.26 -5.00 116.55 107.39 2ax5 n ASP 27 Ca -0.08 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.59 2ax5 n ASP 27 Cb 0.27 -4.73 0.00 0.00 -0.02 0.00 0.00 41.12 36.64 2ax5 n ASP 27 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2ax5 n LYS 28 N -0.91 0.00 -3.28 -1.24 4.81 -1.26 -5.09 118.16 111.19 2ax5 n LYS 28 Ca 0.03 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.36 2ax5 n LYS 28 Cb 0.51 -0.02 -0.04 0.00 0.02 0.00 0.00 35.03 35.50 2ax5 n LYS 28 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2ax5 n GLU 29 N -2.74 0.26 -0.05 1.64 1.02 -1.26 -5.11 120.64 114.40 2ax5 n GLU 29 Ca 0.00 -1.93 -0.01 0.00 -0.02 0.00 0.00 57.16 55.20 2ax5 n GLU 29 Cb 0.00 1.61 -0.01 0.00 -0.02 0.00 0.00 31.44 33.02 2ax5 n GLU 29 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2ax5 h ASP 30 N 1.20 0.00 0.00 1.62 3.32 -2.03 -3.38 116.42 117.15 2ax5 h ASP 30 Ca -0.14 -0.04 -0.55 0.00 0.02 0.00 0.00 57.03 56.32 2ax5 h ASP 30 Cb 0.71 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.28 2ax5 h ASP 30 CO 0.20 0.57 3.33 -0.81 -1.72 0.00 0.00 179.24 180.81 2ax5 n PRO 31 N -4.75 3.01 -2.66 3.56 -0.04 -1.26 -4.93 135.00 127.94 2ax5 n PRO 31 Ca -0.02 -1.91 -0.39 0.00 -0.04 0.00 0.00 63.50 61.15 2ax5 n PRO 31 Cb 0.06 -2.67 -0.05 0.00 -0.04 0.00 0.00 33.50 30.80 2ax5 n PRO 31 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2ax5 s VAL 32 N 2.73 3.91 0.16 0.52 1.01 -1.26 -4.94 120.40 122.52 2ax5 s VAL 32 Ca 0.57 1.74 0.03 0.00 0.00 0.00 0.00 61.98 64.32 2ax5 s VAL 32 Cb 0.15 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 2ax5 s VAL 32 CO -0.05 0.28 0.27 -0.89 0.00 0.00 0.00 175.10 174.71 2ax5 s THR 33 N -1.38 5.20 0.37 3.92 2.01 -1.26 -0.19 115.64 124.30 2ax5 s THR 33 Ca 0.47 -0.76 0.06 0.00 0.31 0.00 0.00 61.69 61.77 2ax5 s THR 33 Cb -0.25 -3.68 0.29 0.00 0.01 0.00 0.00 72.50 68.87 2ax5 s THR 33 CO 0.31 -0.11 1.97 1.62 -0.69 0.00 0.00 174.62 177.72 2ax5 h VAL 34 N 1.66 1.02 0.00 3.82 3.04 -1.78 -0.54 116.25 123.47 2ax5 h VAL 34 Ca -0.49 -0.25 -0.01 0.00 -1.01 0.00 0.00 66.70 64.95 2ax5 h VAL 34 Cb 1.20 0.25 -0.00 0.00 -2.01 0.00 0.00 31.29 30.72 2ax5 h VAL 34 CO 0.67 0.13 -0.02 1.23 -1.01 0.00 0.00 177.57 178.57 2ax5 h GLY 35 N 0.71 0.00 1.25 3.17 0.00 -1.86 -1.57 103.07 104.77 2ax5 h GLY 35 Ca 0.29 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.41 2ax5 h GLY 35 CO -0.09 0.00 -0.75 -0.55 0.00 0.00 0.00 176.54 175.14 2ax5 h ASP 36 N 0.00 0.88 -0.14 0.19 5.19 -1.50 -2.68 116.42 118.36 2ax5 h ASP 36 Ca -0.00 -0.57 0.04 0.00 -0.62 0.00 0.00 57.03 55.89 2ax5 h ASP 36 Cb 0.05 -0.26 -0.04 0.00 0.18 0.00 0.00 39.33 39.26 2ax5 h ASP 36 CO 0.00 1.36 -0.13 0.25 -3.12 0.00 0.00 179.24 177.60 2ax5 h LEU 37 N 0.51 -0.40 -0.66 1.55 7.12 -1.17 -0.16 115.31 122.10 2ax5 h LEU 37 Ca -0.04 0.08 -0.00 0.00 0.13 0.00 0.00 57.88 58.05 2ax5 h LEU 37 Cb 1.37 0.20 -0.03 0.00 -0.53 0.00 0.00 40.66 41.67 2ax5 h LEU 37 CO 0.15 -0.17 0.41 0.40 -0.13 0.00 0.00 178.44 179.10 2ax5 h ILE 38 N -0.15 1.19 -0.71 4.05 1.08 -1.54 -2.46 117.51 118.97 2ax5 h ILE 38 Ca 0.09 -0.40 0.07 0.00 -0.39 0.00 0.00 64.86 64.23 2ax5 h ILE 38 Cb 0.28 0.26 -0.06 0.00 -3.07 0.00 0.00 36.82 34.24 2ax5 h ILE 38 CO -0.23 0.19 0.39 -0.78 -0.69 0.00 0.00 178.15 177.03 2ax5 h ASP 39 N 0.90 0.57 -0.36 1.72 1.82 -1.03 -2.08 116.42 117.95 2ax5 h ASP 39 Ca 0.24 0.04 0.01 0.00 -0.39 0.00 0.00 57.03 56.92 2ax5 h ASP 39 Cb -0.04 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 39.87 2ax5 h ASP 39 CO -0.05 0.35 0.23 -0.74 -1.61 0.00 0.00 179.24 177.43 2ax5 h HIS 40 N 0.70 0.43 -0.20 0.28 2.76 -0.60 0.56 115.15 119.08 2ax5 h HIS 40 Ca 0.33 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.52 2ax5 h HIS 40 Cb 0.24 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.05 2ax5 h HIS 40 CO -0.08 0.26 0.14 0.82 -1.30 0.00 0.00 177.93 177.77 2ax5 h ILE 41 N 0.47 1.01 -0.02 6.26 2.04 -1.03 -1.12 117.51 125.12 2ax5 h ILE 41 Ca 0.14 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.92 2ax5 h ILE 41 Cb -0.03 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2ax5 h ILE 41 CO -0.04 0.04 -0.36 0.52 0.00 0.00 0.00 178.15 178.30 2ax5 n VAL 42 N -4.50 0.00 -0.01 1.67 0.31 -0.77 -1.30 118.33 113.73 2ax5 n VAL 42 Ca 0.01 -0.26 -0.01 0.00 -0.01 0.00 0.00 64.34 64.07 2ax5 n VAL 42 Cb 0.13 1.06 -0.00 0.00 -0.91 0.00 0.00 33.84 34.11 2ax5 n VAL 42 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2ax5 n SER 43 N -0.01 0.22 -0.13 4.52 7.64 0.19 -4.56 113.62 121.50 2ax5 n SER 43 Ca 0.11 0.23 -0.20 0.00 1.01 0.00 0.00 58.87 60.02 2ax5 n SER 43 Cb 0.45 -0.54 -0.12 0.00 -1.01 0.00 0.00 64.21 63.00 2ax5 n SER 43 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2ax5 n THR 44 N -2.59 1.48 -0.36 0.44 -2.24 -0.95 -4.47 114.28 105.59 2ax5 n THR 44 Ca -0.01 -0.54 0.07 0.00 -2.27 0.00 0.00 64.05 61.30 2ax5 n THR 44 Cb 0.04 -1.48 0.24 0.00 -2.10 0.00 0.00 70.33 67.03 2ax5 n THR 44 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 2ax5 h MET 45 N -0.15 0.98 -4.27 -0.78 -1.53 -1.64 -3.40 114.93 104.14 2ax5 h MET 45 Ca -0.59 -0.06 -0.46 0.00 -3.44 0.00 0.00 59.70 55.15 2ax5 h MET 45 Cb 1.85 -0.22 -0.34 0.00 -0.55 0.00 0.00 31.60 32.34 2ax5 h MET 45 CO -0.14 0.65 -0.79 0.42 0.14 0.00 0.00 176.91 177.19 2ax5 s ILE 46 N -5.95 0.82 -0.34 1.77 1.01 -0.42 -4.99 121.20 113.10 2ax5 s ILE 46 Ca -0.12 -0.29 0.15 0.00 0.00 0.00 0.00 60.65 60.39 2ax5 s ILE 46 Cb 0.22 -0.79 0.43 0.00 0.01 0.00 0.00 42.46 42.33 2ax5 s ILE 46 CO 0.81 0.29 1.00 0.59 0.00 0.00 0.00 174.94 177.62 2ax5 n ASN 47 N 3.93 0.70 -3.68 3.58 4.13 -1.26 -3.97 115.26 118.69 2ax5 n ASN 47 Ca -0.24 -2.73 -0.17 0.00 1.68 0.00 0.00 54.58 53.12 2ax5 n ASN 47 Cb 0.51 -0.21 -0.16 0.00 -1.54 0.00 0.00 39.78 38.38 2ax5 n ASN 47 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 2ax5 s ASN 48 N -2.67 0.67 -0.63 6.41 2.47 -1.26 -5.06 114.94 114.87 2ax5 s ASN 48 Ca 0.27 0.29 -0.27 0.00 0.42 0.00 0.00 52.86 53.58 2ax5 s ASN 48 Cb 0.43 0.21 -0.26 0.00 -1.45 0.00 0.00 41.25 40.18 2ax5 s ASN 48 CO 0.00 -0.23 1.86 -2.65 -3.72 0.00 0.00 177.10 172.36 2ax5 n PRO 49 N 5.15 0.53 0.13 0.43 -0.02 -1.26 -3.05 135.00 136.91 2ax5 n PRO 49 Ca -0.08 -1.58 0.00 0.00 -2.02 0.00 0.00 63.50 59.83 2ax5 n PRO 49 Cb 0.50 -3.18 0.00 0.00 -0.02 0.00 0.00 33.50 30.80 2ax5 n PRO 49 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2ax5 n ASN 50 N 12.78 -2.32 0.12 2.55 4.05 -1.26 -4.82 115.26 126.36 2ax5 n ASN 50 Ca 0.45 0.65 -0.19 0.00 0.45 0.00 0.00 54.58 55.95 2ax5 n ASN 50 Cb 0.44 2.35 -0.14 0.00 1.23 0.00 0.00 39.78 43.65 2ax5 n ASN 50 CO 0.00 0.00 0.00 -2.24 -3.05 0.00 0.00 177.26 171.97 2ax5 h ASP 51 N 0.00 0.56 0.34 1.20 3.04 -1.96 -3.26 116.42 116.34 2ax5 h ASP 51 Ca 0.00 -0.59 -0.32 0.00 -3.24 0.00 0.00 57.03 52.87 2ax5 h ASP 51 Cb 0.00 -0.18 -0.03 0.00 -1.04 0.00 0.00 39.33 38.08 2ax5 h ASP 51 CO 0.00 1.46 -1.78 0.58 -2.04 0.00 0.00 179.24 177.47 2ax5 h VAL 52 N 0.10 0.83 -0.85 4.15 2.07 -1.93 -3.14 116.25 117.49 2ax5 h VAL 52 Ca -0.17 -2.58 0.14 0.00 0.82 0.00 0.00 66.70 64.91 2ax5 h VAL 52 Cb 2.03 2.54 -0.06 0.00 -1.52 0.00 0.00 31.29 34.27 2ax5 h VAL 52 CO 0.23 0.73 0.55 0.28 0.02 0.00 0.00 177.57 179.38 2ax5 h SER 53 N 0.04 0.57 0.33 0.57 0.02 -1.76 0.49 113.55 113.82 2ax5 h SER 53 Ca -0.33 0.03 -0.33 0.00 -0.84 0.00 0.00 61.79 60.33 2ax5 h SER 53 Cb 2.02 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 64.49 2ax5 h SER 53 CO 0.10 0.29 -1.61 0.40 -1.14 0.00 0.00 176.83 174.87 2ax5 h ILE 54 N 0.61 1.08 -0.55 3.27 2.04 -1.70 -3.36 117.51 118.90 2ax5 h ILE 54 Ca 0.42 -2.67 -0.11 0.00 1.00 0.00 0.00 64.86 63.49 2ax5 h ILE 54 Cb 0.75 2.80 -0.02 0.00 -0.74 0.00 0.00 36.82 39.61 2ax5 h ILE 54 CO -0.18 0.83 -0.10 0.15 0.00 0.00 0.00 178.15 178.86 2ax5 h PHE 55 N 0.09 1.17 -3.32 1.37 3.57 -1.31 -3.42 116.94 115.09 2ax5 h PHE 55 Ca -0.29 -0.24 -0.59 0.00 3.53 0.00 0.00 57.97 60.39 2ax5 h PHE 55 Cb 2.07 -0.29 -0.37 0.00 2.79 0.00 0.00 35.95 40.15 2ax5 h PHE 55 CO 0.09 1.07 -0.81 0.42 -2.23 0.00 0.00 178.31 176.85 2ax5 s ILE 56 N -4.86 1.41 -0.12 1.41 -1.09 0.17 -3.47 121.20 114.64 2ax5 s ILE 56 Ca -0.12 -0.76 0.01 0.00 -2.23 0.00 0.00 60.65 57.55 2ax5 s ILE 56 Cb 0.13 -1.48 -0.01 0.00 -1.58 0.00 0.00 42.46 39.52 2ax5 s ILE 56 CO 0.87 0.22 -0.15 -0.70 -1.23 0.00 0.00 174.94 173.95 2ax5 s GLU 57 N 1.51 3.25 -1.33 2.79 2.12 0.13 -4.41 118.70 122.77 2ax5 s GLU 57 Ca 0.01 -0.72 -0.06 0.00 0.36 0.00 0.00 54.97 54.56 2ax5 s GLU 57 Cb -0.15 -2.56 0.01 0.00 0.26 0.00 0.00 34.13 31.70 2ax5 s GLU 57 CO -0.08 0.25 1.07 -0.25 -0.54 0.00 0.00 175.26 175.71 2ax5 n ASP 58 N 3.41 -4.52 -2.87 -1.70 9.92 -1.26 -1.75 116.55 117.78 2ax5 n ASP 58 Ca -0.18 -0.61 -0.21 0.00 -0.53 0.00 0.00 54.79 53.26 2ax5 n ASP 58 Cb 0.53 -4.87 0.01 0.00 -0.64 0.00 0.00 41.12 36.15 2ax5 n ASP 58 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2ax5 n ASP 59 N -3.04 -5.24 -3.65 -2.24 8.00 -1.26 -4.96 116.55 104.17 2ax5 n ASP 59 Ca -0.10 -0.17 -0.16 0.00 0.71 0.00 0.00 54.79 55.07 2ax5 n ASP 59 Cb 0.60 -4.30 -0.07 0.00 -0.02 0.00 0.00 41.12 37.32 2ax5 n ASP 59 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2ax5 s SER 60 N -2.46 -0.42 0.62 -2.24 0.15 -0.72 -5.15 113.70 103.48 2ax5 s SER 60 Ca 0.21 0.41 -0.18 0.00 0.70 0.00 0.00 55.95 57.10 2ax5 s SER 60 Cb -0.10 0.44 -0.02 0.00 -1.71 0.00 0.00 66.02 64.63 2ax5 s SER 60 CO 0.26 -0.51 1.17 -0.63 1.20 0.00 0.00 173.24 174.73 2ax5 s ILE 61 N -1.21 2.81 -0.13 6.45 1.09 -1.26 0.18 121.20 129.13 2ax5 s ILE 61 Ca -0.12 0.46 -0.17 0.00 -1.10 0.00 0.00 60.65 59.72 2ax5 s ILE 61 Cb -0.03 -3.11 -0.04 0.00 -1.06 0.00 0.00 42.46 38.22 2ax5 s ILE 61 CO 0.07 -0.15 0.42 -0.60 -0.10 0.00 0.00 174.94 174.58 2ax5 s ARG 62 N -3.55 4.31 -0.14 2.79 3.52 -1.23 -4.77 118.95 119.88 2ax5 s ARG 62 Ca 0.74 0.35 -0.34 0.00 -0.13 0.00 0.00 55.73 56.34 2ax5 s ARG 62 Cb -0.27 -3.43 -0.12 0.00 -1.56 0.00 0.00 34.95 29.58 2ax5 s ARG 62 CO 0.35 0.19 1.92 -2.30 -0.81 0.00 0.00 175.30 174.65 2ax5 n PRO 63 N 3.60 1.99 0.00 5.12 -0.02 -1.26 -3.55 135.00 140.88 2ax5 n PRO 63 Ca -0.09 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2ax5 n PRO 63 Cb 0.52 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 2ax5 n PRO 63 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ax5 n GLY 64 N 4.65 2.94 3.70 -1.23 0.00 -1.26 -4.99 105.19 109.00 2ax5 n GLY 64 Ca 0.25 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 2ax5 n GLY 64 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ax5 s ILE 65 N 0.00 4.06 -0.20 -0.61 1.01 -1.23 -3.78 121.20 120.44 2ax5 s ILE 65 Ca 0.00 1.45 -0.08 0.00 0.00 0.00 0.00 60.65 62.02 2ax5 s ILE 65 Cb 0.00 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 2ax5 s ILE 65 CO 0.00 0.06 0.09 -0.63 0.00 0.00 0.00 174.94 174.46 2ax5 s ILE 66 N 1.59 4.88 -0.06 2.92 -1.09 0.91 -4.94 121.20 125.42 2ax5 s ILE 66 Ca 0.58 0.01 0.05 0.00 -2.23 0.00 0.00 60.65 59.06 2ax5 s ILE 66 Cb -0.28 -3.23 -0.01 0.00 -1.58 0.00 0.00 42.46 37.36 2ax5 s ILE 66 CO 0.27 0.42 -0.22 -0.89 -1.23 0.00 0.00 174.94 173.28 2ax5 s THR 67 N 0.68 1.85 -0.47 2.92 2.01 -1.26 0.10 115.64 121.48 2ax5 s THR 67 Ca 0.05 -0.95 -0.05 0.00 0.31 0.00 0.00 61.69 61.04 2ax5 s THR 67 Cb -0.13 -1.58 0.12 0.00 0.01 0.00 0.00 72.50 70.92 2ax5 s THR 67 CO 0.02 0.52 0.30 -0.76 -0.69 0.00 0.00 174.62 174.00 2ax5 s LEU 68 N -0.05 5.44 -0.67 4.42 2.01 -0.92 -2.66 118.68 126.25 2ax5 s LEU 68 Ca -0.05 -2.11 -0.27 0.00 0.01 0.00 0.00 54.13 51.71 2ax5 s LEU 68 Cb -0.13 -1.90 0.03 0.00 0.01 0.00 0.00 46.19 44.20 2ax5 s LEU 68 CO 0.04 -0.57 1.20 -0.63 1.01 0.00 0.00 176.35 177.39 2ax5 s ILE 69 N 1.04 3.91 -1.27 -0.59 1.01 -0.60 -2.50 121.20 122.20 2ax5 s ILE 69 Ca 0.09 0.49 -0.02 0.00 0.00 0.00 0.00 60.65 61.21 2ax5 s ILE 69 Cb -0.23 -4.81 0.01 0.00 0.01 0.00 0.00 42.46 37.43 2ax5 s ILE 69 CO -0.03 -1.61 0.92 0.59 0.00 0.00 0.00 174.94 174.81 2ax5 n ASN 70 N 8.81 -2.35 -2.40 3.58 4.13 -0.47 -1.73 115.26 124.83 2ax5 n ASN 70 Ca 0.04 -0.69 -0.19 0.00 1.68 0.00 0.00 54.58 55.42 2ax5 n ASN 70 Cb 0.49 -4.70 0.01 0.00 -1.54 0.00 0.00 39.78 34.04 2ax5 n ASN 70 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2ax5 n ASP 71 N -3.08 -5.55 -4.35 6.41 2.03 -1.25 -5.00 116.55 105.77 2ax5 n ASP 71 Ca -0.24 -0.12 -0.18 0.00 0.52 0.00 0.00 54.79 54.76 2ax5 n ASP 71 Cb 0.65 -4.50 -0.10 0.00 -0.72 0.00 0.00 41.12 36.45 2ax5 n ASP 71 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2ax5 s THR 72 N -3.02 1.40 0.12 5.18 2.01 -0.70 -5.11 115.64 115.52 2ax5 s THR 72 Ca 0.12 -2.11 -0.30 0.00 0.31 0.00 0.00 61.69 59.71 2ax5 s THR 72 Cb -0.05 -2.21 -0.06 0.00 0.01 0.00 0.00 72.50 70.19 2ax5 s THR 72 CO 0.15 -0.46 0.98 -1.81 -0.69 0.00 0.00 174.62 172.78 2ax5 s ASP 73 N -3.32 7.47 0.10 3.53 1.11 -1.26 -1.56 116.67 122.74 2ax5 s ASP 73 Ca 0.25 1.82 -0.26 0.00 0.18 0.00 0.00 52.55 54.54 2ax5 s ASP 73 Cb 0.03 -2.59 -0.11 0.00 1.07 0.00 0.00 42.92 41.32 2ax5 s ASP 73 CO 0.08 -0.09 1.67 -0.25 1.18 0.00 0.00 175.17 177.75 2ax5 h TRP 74 N 5.56 -0.50 -0.39 4.23 7.01 -1.89 -1.66 115.95 128.31 2ax5 h TRP 74 Ca -0.43 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.48 2ax5 h TRP 74 Cb 1.21 0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 28.45 2ax5 h TRP 74 CO 0.65 -0.28 -0.13 1.05 -2.79 0.00 0.00 178.44 176.93 2ax5 h GLU 75 N -0.40 0.71 0.03 2.65 4.11 -1.92 0.48 114.58 120.23 2ax5 h GLU 75 Ca 0.01 -0.23 0.02 0.00 0.07 0.00 0.00 59.36 59.22 2ax5 h GLU 75 Cb 0.39 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2ax5 h GLU 75 CO -0.06 0.81 -0.16 1.25 0.07 0.00 0.00 179.01 180.92 2ax5 h LEU 76 N 0.64 -0.46 -0.99 3.06 6.46 -1.89 -2.35 115.31 119.78 2ax5 h LEU 76 Ca 0.11 0.06 -0.07 0.00 -0.12 0.00 0.00 57.88 57.86 2ax5 h LEU 76 Cb 0.58 0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.68 2ax5 h LEU 76 CO 0.04 -0.22 -0.08 -0.33 -0.62 0.00 0.00 178.44 177.23 2ax5 h GLU 77 N -0.28 0.64 0.00 1.25 4.39 -1.25 -3.47 114.58 115.86 2ax5 h GLU 77 Ca 0.04 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.56 2ax5 h GLU 77 Cb 0.33 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2ax5 h GLU 77 CO -0.13 0.71 0.00 0.41 -1.16 0.00 0.00 179.01 178.84 2ax5 n GLY 78 N -0.61 1.34 5.07 -3.84 0.00 -0.76 -4.49 105.19 101.90 2ax5 n GLY 78 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2ax5 n GLY 78 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ax5 n GLU 79 N 0.00 0.00 -0.42 1.61 1.02 0.16 -1.77 120.64 121.24 2ax5 n GLU 79 Ca 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.22 2ax5 n GLU 79 Cb 0.00 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 31.67 2ax5 n GLU 79 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2ax5 n LYS 80 N 0.00 3.13 -1.48 3.49 4.81 -1.26 -4.68 118.16 122.17 2ax5 n LYS 80 Ca 0.00 -2.66 -0.29 0.00 -0.87 0.00 0.00 58.31 54.49 2ax5 n LYS 80 Cb 0.00 -1.72 -0.01 0.00 0.02 0.00 0.00 35.03 33.32 2ax5 n LYS 80 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2ax5 n ASP 81 N 0.01 6.83 -3.81 3.14 -0.08 -0.73 -4.72 116.55 117.19 2ax5 n ASP 81 Ca 0.20 -3.39 -0.13 0.00 -1.51 0.00 0.00 54.79 49.96 2ax5 n ASP 81 Cb 0.79 -1.15 -0.13 0.00 2.34 0.00 0.00 41.12 42.97 2ax5 n ASP 81 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 2ax5 s TYR 82 N -2.47 -0.17 -0.13 -0.67 6.14 -1.26 -4.67 117.35 114.12 2ax5 s TYR 82 Ca 0.54 0.43 -0.17 0.00 0.64 0.00 0.00 57.07 58.51 2ax5 s TYR 82 Cb 0.39 0.04 -0.04 0.00 0.42 0.00 0.00 41.96 42.76 2ax5 s TYR 82 CO -0.22 -0.10 0.43 0.42 0.64 0.00 0.00 175.55 176.73 2ax5 s ILE 83 N 0.28 5.22 1.31 3.14 1.09 -1.26 -2.54 121.20 128.44 2ax5 s ILE 83 Ca -0.02 0.85 -0.18 0.00 -1.10 0.00 0.00 60.65 60.21 2ax5 s ILE 83 Cb -0.03 -3.77 0.33 0.00 -1.06 0.00 0.00 42.46 37.93 2ax5 s ILE 83 CO -0.01 0.34 0.94 0.18 -0.10 0.00 0.00 174.94 176.29 2ax5 n LEU 84 N 3.66 -1.33 -3.15 2.97 4.77 0.73 -4.88 117.00 119.77 2ax5 n LEU 84 Ca -0.08 -0.47 0.04 0.00 -0.03 0.00 0.00 56.01 55.47 2ax5 n LEU 84 Cb 0.52 -1.14 -0.00 0.00 -2.33 0.00 0.00 43.42 40.46 2ax5 n LEU 84 CO 0.42 -3.88 0.15 -0.70 -1.33 0.00 0.00 177.39 172.06 2ax5 s GLU 85 N -4.62 0.51 -0.69 3.23 2.12 -1.26 -4.83 118.70 113.16 2ax5 s GLU 85 Ca 0.68 0.53 -0.36 0.00 0.36 0.00 0.00 54.97 56.18 2ax5 s GLU 85 Cb -0.20 0.24 -0.18 0.00 0.26 0.00 0.00 34.13 34.25 2ax5 s GLU 85 CO 0.62 -0.94 2.40 -0.40 -0.54 0.00 0.00 175.26 176.40 2ax5 n ASP 86 N 5.39 0.87 0.00 -1.70 5.75 -1.26 -0.66 116.55 124.94 2ax5 n ASP 86 Ca 0.05 0.34 0.00 0.00 -0.01 0.00 0.00 54.79 55.17 2ax5 n ASP 86 Cb 0.54 -1.01 0.00 0.00 -1.03 0.00 0.00 41.12 39.62 2ax5 n ASP 86 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ax5 n GLY 87 N 6.83 1.81 4.00 6.12 0.00 0.26 -4.76 105.19 119.46 2ax5 n GLY 87 Ca 0.56 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.37 2ax5 n GLY 87 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2ax5 s ASP 88 N -2.00 4.97 -0.10 1.61 1.47 0.17 -5.01 116.67 117.78 2ax5 s ASP 88 Ca 0.00 -0.40 0.04 0.00 1.18 0.00 0.00 52.55 53.37 2ax5 s ASP 88 Cb 0.00 -0.26 -0.00 0.00 -0.34 0.00 0.00 42.92 42.32 2ax5 s ASP 88 CO 0.00 -1.39 -0.23 -0.63 0.68 0.00 0.00 175.17 173.60 2ax5 s ILE 89 N -2.81 2.15 0.08 2.11 -1.09 -1.26 -3.21 121.20 117.16 2ax5 s ILE 89 Ca 0.61 -0.99 0.04 0.00 -2.23 0.00 0.00 60.65 58.08 2ax5 s ILE 89 Cb -0.07 -1.82 -0.03 0.00 -1.58 0.00 0.00 42.46 38.95 2ax5 s ILE 89 CO 0.40 0.56 -0.10 -0.63 -1.23 0.00 0.00 174.94 173.93 2ax5 s ILE 90 N 0.30 0.87 0.16 2.92 1.01 -0.38 -1.36 121.20 124.71 2ax5 s ILE 90 Ca -0.17 -1.45 0.07 0.00 0.00 0.00 0.00 60.65 59.10 2ax5 s ILE 90 Cb -0.17 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 2ax5 s ILE 90 CO 0.08 -0.46 -0.15 -0.44 0.00 0.00 0.00 174.94 173.97 2ax5 s SER 91 N -2.12 2.33 -0.24 3.58 0.01 -1.04 -2.05 113.70 114.17 2ax5 s SER 91 Ca 0.00 -0.89 -0.03 0.00 1.31 0.00 0.00 55.95 56.34 2ax5 s SER 91 Cb -0.06 -0.11 0.10 0.00 0.21 0.00 0.00 66.02 66.17 2ax5 s SER 91 CO 0.00 -0.13 0.20 -0.36 0.41 0.00 0.00 173.24 173.36 2ax5 s PHE 92 N -2.39 -0.14 -0.04 2.43 0.08 0.23 -2.17 117.98 115.99 2ax5 s PHE 92 Ca 0.15 -0.16 0.01 0.00 0.12 0.00 0.00 56.93 57.05 2ax5 s PHE 92 Cb -0.04 -0.54 -0.03 0.00 -0.57 0.00 0.00 43.02 41.84 2ax5 s PHE 92 CO 0.05 -0.71 -0.05 0.99 -0.10 0.00 0.00 175.22 175.40 2ax5 s THR 93 N 2.26 3.86 -0.42 0.64 2.01 0.11 -0.34 115.64 123.76 2ax5 s THR 93 Ca 0.07 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.52 2ax5 s THR 93 Cb -0.15 -2.64 0.11 0.00 0.01 0.00 0.00 72.50 69.83 2ax5 s THR 93 CO -0.21 0.49 0.18 -0.55 -0.69 0.00 0.00 174.62 173.84 2ax5 s SER 94 N -1.15 4.94 -0.02 3.53 0.15 -0.91 -0.06 113.70 120.19 2ax5 s SER 94 Ca 0.15 -2.31 -0.04 0.00 0.70 0.00 0.00 55.95 54.46 2ax5 s SER 94 Cb -0.11 -1.73 -0.02 0.00 -1.71 0.00 0.00 66.02 62.45 2ax5 s SER 94 CO 0.05 -0.42 0.37 0.71 1.20 0.00 0.00 173.24 175.16 2ax5 h THR 95 N 6.22 0.00 -4.78 6.45 1.35 -1.90 -3.39 112.91 116.85 2ax5 h THR 95 Ca -0.08 -0.21 0.01 0.00 -0.55 0.00 0.00 66.41 65.58 2ax5 h THR 95 Cb 1.00 0.00 -0.10 0.00 -1.73 0.00 0.00 68.15 67.32 2ax5 h THR 95 CO 0.63 0.00 -1.39 0.18 -0.25 0.00 0.00 175.52 174.69 2ax5 n LEU 96 N -2.95 -5.97 -0.85 3.87 4.77 -1.26 -3.96 117.00 110.65 2ax5 n LEU 96 Ca -0.02 2.29 -0.11 0.00 -0.03 0.00 0.00 56.01 58.15 2ax5 n LEU 96 Cb 0.05 -3.14 -0.05 0.00 -2.33 0.00 0.00 43.42 37.95 2ax5 n LEU 96 CO 0.04 -3.58 -0.11 1.41 -1.33 0.00 0.00 177.39 173.82 2ax5 n HIS 97 N 1.63 0.00 -3.26 -1.77 8.25 -1.26 -3.78 115.22 115.03 2ax5 n HIS 97 Ca -0.32 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.07 2ax5 n HIS 97 Cb 0.49 -2.35 0.00 0.00 1.12 0.00 0.00 29.99 29.26 2ax5 n HIS 97 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ax5 n GLY 98 N -0.80 -1.26 3.06 -1.41 0.00 -1.26 -5.30 105.19 98.21 2ax5 n GLY 98 Ca -0.11 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2ax5 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93