#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ekz s ASP 2 N 0.00 3.36 -0.10 6.12 1.11 -1.26 -5.06 116.67 120.84 1ekz s ASP 2 Ca 0.00 -0.48 -0.02 0.00 0.18 0.00 0.00 52.55 52.23 1ekz s ASP 2 Cb 0.00 -0.43 -0.01 0.00 1.07 0.00 0.00 42.92 43.55 1ekz s ASP 2 CO 0.00 0.29 -0.04 -0.33 1.18 0.00 0.00 175.17 176.27 1ekz h GLU 3 N 4.99 0.00 -2.74 8.23 4.39 -2.13 -3.46 114.58 123.86 1ekz h GLU 3 Ca -0.46 0.00 -0.43 0.00 0.34 0.00 0.00 59.36 58.81 1ekz h GLU 3 Cb 1.14 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 29.40 1ekz h GLU 3 CO 0.46 0.00 -0.72 0.20 -1.16 0.00 0.00 179.01 177.79 1ekz s GLY 4 N -3.58 0.25 -0.07 -3.84 0.00 -1.26 -5.01 107.32 93.82 1ekz s GLY 4 Ca -0.03 -0.41 -0.01 0.00 0.00 0.00 0.00 44.72 44.26 1ekz s GLY 4 CO 0.05 2.04 0.56 1.29 0.00 0.00 0.00 173.10 177.03 1ekz h ASP 5 N 8.37 0.32 -1.84 1.64 2.03 -2.04 -3.47 116.42 121.44 1ekz h ASP 5 Ca -0.17 -0.63 -0.04 0.00 -0.73 0.00 0.00 57.03 55.46 1ekz h ASP 5 Cb 1.10 -0.10 0.02 0.00 -0.83 0.00 0.00 39.33 39.51 1ekz h ASP 5 CO 0.34 1.56 0.02 0.29 -1.03 0.00 0.00 179.24 180.42 1ekz n LYS 6 N -3.37 -0.79 -3.75 4.15 5.02 -1.26 -5.09 118.16 113.07 1ekz n LYS 6 Ca -0.25 -0.16 -0.13 0.00 -2.02 0.00 0.00 58.31 55.76 1ekz n LYS 6 Cb 1.05 -0.13 -0.11 0.00 -0.02 0.00 0.00 35.03 35.82 1ekz n LYS 6 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ekz s LYS 7 N -3.23 0.39 -0.71 1.97 1.02 -1.26 -5.11 119.74 112.82 1ekz s LYS 7 Ca 0.06 0.52 -0.04 0.00 0.02 0.00 0.00 55.97 56.53 1ekz s LYS 7 Cb -0.00 0.15 0.18 0.00 -0.52 0.00 0.00 37.83 37.64 1ekz s LYS 7 CO 0.05 -0.07 0.56 -1.12 -0.92 0.00 0.00 175.35 173.85 1ekz s SER 8 N 0.40 5.62 -0.02 2.83 0.01 -1.26 -4.89 113.70 116.38 1ekz s SER 8 Ca -0.02 -3.00 -0.22 0.00 1.31 0.00 0.00 55.95 54.03 1ekz s SER 8 Cb -0.04 -1.92 -0.25 0.00 0.21 0.00 0.00 66.02 64.02 1ekz s SER 8 CO -0.02 -0.37 1.03 1.55 0.41 0.00 0.00 173.24 175.85 1ekz h PRO 9 N 6.95 0.31 -0.39 12.44 0.13 -1.99 -3.11 132.00 146.34 1ekz h PRO 9 Ca 0.04 -0.37 0.08 0.00 -0.87 0.00 0.00 66.00 64.88 1ekz h PRO 9 Cb 0.94 0.11 -0.09 0.00 0.13 0.00 0.00 31.00 32.09 1ekz h PRO 9 CO 0.74 1.07 -0.22 0.82 -0.23 0.00 0.00 178.00 180.19 1ekz h ILE 10 N -0.29 0.39 0.58 -3.56 2.04 -1.98 0.74 117.51 115.43 1ekz h ILE 10 Ca -0.07 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 1ekz h ILE 10 Cb 1.27 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 1ekz h ILE 10 CO 0.10 0.00 -0.39 0.28 0.00 0.00 0.00 178.15 178.14 1ekz h SER 11 N -0.15 -0.99 -0.98 1.72 0.02 -1.99 -0.33 113.55 110.86 1ekz h SER 11 Ca 0.19 0.06 0.18 0.00 -0.84 0.00 0.00 61.79 61.39 1ekz h SER 11 Cb 0.45 0.30 -0.09 0.00 0.14 0.00 0.00 62.40 63.19 1ekz h SER 11 CO -0.48 -0.58 0.61 1.56 -1.14 0.00 0.00 176.83 176.80 1ekz h GLN 12 N -0.92 0.68 -0.10 3.45 4.20 -1.39 0.44 115.11 121.47 1ekz h GLN 12 Ca -0.08 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1ekz h GLN 12 Cb 0.74 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1ekz h GLN 12 CO 0.06 0.45 0.06 0.28 -0.67 0.00 0.00 178.83 179.01 1ekz h VAL 13 N 0.70 1.05 -0.62 -0.54 2.07 0.96 0.40 116.25 120.27 1ekz h VAL 13 Ca 0.54 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 67.89 1ekz h VAL 13 Cb 0.92 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 1ekz h VAL 13 CO -0.31 0.04 0.15 0.45 0.02 0.00 0.00 177.57 177.92 1ekz h HIS 14 N 0.12 1.00 0.53 1.57 3.86 0.76 -0.68 115.15 122.30 1ekz h HIS 14 Ca 0.04 -0.10 -0.03 0.00 -1.16 0.00 0.00 60.37 59.12 1ekz h HIS 14 Cb 0.01 -0.29 0.01 0.00 1.06 0.00 0.00 27.41 28.20 1ekz h HIS 14 CO -0.06 0.82 -0.25 0.93 0.86 0.00 0.00 177.93 180.23 1ekz h GLU 15 N 0.92 -0.68 -0.40 2.45 5.08 0.54 -1.49 114.58 121.00 1ekz h GLU 15 Ca 0.20 0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1ekz h GLU 15 Cb 0.33 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1ekz h GLU 15 CO -0.00 -0.43 0.15 -0.84 -1.00 0.00 0.00 179.01 176.90 1ekz h ILE 16 N -0.77 1.16 -0.05 3.13 3.07 -0.10 0.99 117.51 124.94 1ekz h ILE 16 Ca -0.07 -0.49 -0.00 0.00 1.55 0.00 0.00 64.86 65.84 1ekz h ILE 16 Cb 0.57 0.69 -0.00 0.00 -0.27 0.00 0.00 36.82 37.81 1ekz h ILE 16 CO 0.12 0.19 0.02 1.23 -1.05 0.00 0.00 178.15 178.66 1ekz h GLY 17 N 0.72 0.09 1.62 0.16 0.00 -0.89 -2.68 103.07 102.08 1ekz h GLY 17 Ca 0.14 -0.05 -0.27 0.00 0.00 0.00 0.00 47.33 47.15 1ekz h GLY 17 CO -0.01 0.04 -1.26 -2.22 0.00 0.00 0.00 176.54 173.09 1ekz h ILE 18 N -0.07 1.46 0.00 2.60 5.03 -0.98 0.97 117.51 126.52 1ekz h ILE 18 Ca 0.02 -3.08 0.00 0.00 -0.12 0.00 0.00 64.86 61.68 1ekz h ILE 18 Cb 0.16 2.88 0.00 0.00 -3.03 0.00 0.00 36.82 36.83 1ekz h ILE 18 CO -0.00 0.89 0.00 0.11 -0.68 0.00 0.00 178.15 178.46 1ekz h LYS 19 N 0.06 0.00 0.00 2.37 1.79 0.10 -3.37 116.57 117.52 1ekz h LYS 19 Ca -0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 1ekz h LYS 19 Cb 1.94 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.59 1ekz h LYS 19 CO 0.18 0.00 0.00 0.54 -1.08 0.00 0.00 179.45 179.09 1ekz n ARG 20 N -2.99 0.00 0.00 3.15 3.00 -1.01 -5.04 116.66 113.76 1ekz n ARG 20 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.81 1ekz n ARG 20 Cb 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 32.46 32.52 1ekz n ARG 20 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1ekz n ASN 21 N -1.43 0.00 -3.77 0.55 6.94 -0.74 -5.10 115.26 111.70 1ekz n ASN 21 Ca 0.00 0.00 -0.22 0.00 -0.02 0.00 0.00 54.58 54.34 1ekz n ASN 21 Cb 0.00 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.25 1ekz n ASN 21 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1ekz s MET 22 N 0.00 0.55 -0.60 -3.83 -1.94 0.33 -4.74 119.30 109.06 1ekz s MET 22 Ca 0.00 0.12 -0.28 0.00 -1.71 0.00 0.00 55.69 53.82 1ekz s MET 22 Cb 0.00 -0.89 0.02 0.00 2.01 0.00 0.00 34.83 35.97 1ekz s MET 22 CO 0.00 -0.28 1.32 0.95 -0.01 0.00 0.00 175.02 177.00 1ekz s THR 23 N 1.86 3.85 -0.28 2.05 -4.23 -1.26 -3.83 115.64 113.79 1ekz s THR 23 Ca 0.03 0.70 -0.14 0.00 -1.18 0.00 0.00 61.69 61.11 1ekz s THR 23 Cb -0.12 -4.62 -0.04 0.00 1.34 0.00 0.00 72.50 69.06 1ekz s THR 23 CO -0.04 -1.35 0.32 0.54 -0.54 0.00 0.00 174.62 173.54 1ekz s VAL 24 N 5.65 5.21 -0.09 2.29 0.11 -1.25 -2.65 120.40 129.68 1ekz s VAL 24 Ca 0.46 0.38 -0.00 0.00 -2.93 0.00 0.00 61.98 59.88 1ekz s VAL 24 Cb -0.09 -3.66 0.02 0.00 -1.53 0.00 0.00 36.38 31.12 1ekz s VAL 24 CO 0.23 0.15 -0.05 -1.00 -3.33 0.00 0.00 175.10 171.10 1ekz s HIS 25 N 1.97 1.16 -0.84 1.54 3.76 0.39 -4.96 115.29 118.31 1ekz s HIS 25 Ca 0.12 -0.50 -0.08 0.00 -0.15 0.00 0.00 55.06 54.46 1ekz s HIS 25 Cb -0.16 -1.03 0.22 0.00 1.11 0.00 0.00 32.58 32.71 1ekz s HIS 25 CO 0.10 -0.41 0.75 -0.06 -0.85 0.00 0.00 174.74 174.28 1ekz s PHE 26 N 1.63 3.79 0.24 1.40 0.08 -1.26 -0.65 117.98 123.22 1ekz s PHE 26 Ca 0.02 -2.50 0.01 0.00 0.12 0.00 0.00 56.93 54.58 1ekz s PHE 26 Cb -0.13 -3.56 -0.04 0.00 -0.57 0.00 0.00 43.02 38.72 1ekz s PHE 26 CO -0.06 -0.90 0.41 0.21 -0.10 0.00 0.00 175.22 174.79 1ekz s LYS 27 N -0.45 3.49 0.27 0.44 2.20 0.35 -4.89 119.74 121.15 1ekz s LYS 27 Ca 0.22 -0.45 0.07 0.00 -0.36 0.00 0.00 55.97 55.45 1ekz s LYS 27 Cb -0.12 -2.82 -0.03 0.00 -1.51 0.00 0.00 37.83 33.35 1ekz s LYS 27 CO -0.08 0.36 0.20 0.08 -0.36 0.00 0.00 175.35 175.55 1ekz s VAL 28 N -1.99 4.22 -0.01 4.02 1.01 -1.26 0.44 120.40 126.83 1ekz s VAL 28 Ca 0.38 -1.43 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 1ekz s VAL 28 Cb -0.10 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 1ekz s VAL 28 CO 0.31 -0.32 -0.04 0.18 0.00 0.00 0.00 175.10 175.23 1ekz n LEU 29 N -1.20 0.27 0.00 3.92 4.77 -1.26 -4.88 117.00 118.62 1ekz n LEU 29 Ca -0.07 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1ekz n LEU 29 Cb 0.58 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1ekz n LEU 29 CO 0.43 -0.49 0.00 -1.14 -1.33 0.00 0.00 177.39 174.85 1ekz n ARG 30 N -2.77 0.00 -4.15 3.23 0.63 -1.26 -5.17 116.66 107.17 1ekz n ARG 30 Ca -0.01 0.00 -0.25 0.00 -0.92 0.00 0.00 57.85 56.67 1ekz n ARG 30 Cb 0.05 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 32.90 1ekz n ARG 30 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1ekz s GLU 31 N 0.00 2.70 2.69 -0.14 8.01 -1.26 -5.02 118.70 125.68 1ekz s GLU 31 Ca 0.00 -1.05 0.00 0.00 0.01 0.00 0.00 54.97 53.93 1ekz s GLU 31 Cb 0.00 -2.49 0.00 0.00 -4.31 0.00 0.00 34.13 27.33 1ekz s GLU 31 CO 0.00 0.44 0.00 -1.91 0.01 0.00 0.00 175.26 173.80 1ekz n GLU 32 N -0.60 0.00 0.00 1.61 0.00 -1.25 -4.98 120.64 115.42 1ekz n GLU 32 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.08 1ekz n GLU 32 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.00 1ekz n GLU 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1ekz n GLY 33 N 0.00 2.59 0.32 8.31 0.00 -1.26 -4.86 105.19 110.29 1ekz n GLY 33 Ca 0.00 -0.68 0.01 0.00 0.00 0.00 0.00 46.02 45.35 1ekz n GLY 33 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ekz n PRO 34 N 0.00 1.23 -1.69 1.61 -0.04 -1.26 -4.87 135.00 129.98 1ekz n PRO 34 Ca 0.00 -0.25 -0.14 0.00 -0.04 0.00 0.00 63.50 63.07 1ekz n PRO 34 Cb 0.00 -1.26 -0.04 0.00 -0.04 0.00 0.00 33.50 32.15 1ekz n PRO 34 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ekz n ALA 35 N -0.16 -0.36 -0.91 0.55 0.00 -1.26 -4.75 120.51 113.61 1ekz n ALA 35 Ca 0.02 0.19 0.03 0.00 0.00 0.00 0.00 53.44 53.68 1ekz n ALA 35 Cb 0.17 -1.49 0.04 0.00 0.00 0.00 0.00 19.45 18.17 1ekz n ALA 35 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ekz n HIS 36 N -2.35 0.00 -0.02 0.00 8.25 -1.26 -4.79 115.22 115.04 1ekz n HIS 36 Ca -0.14 -0.46 -0.03 0.00 -0.26 0.00 0.00 57.72 56.82 1ekz n HIS 36 Cb 0.50 -0.07 -0.02 0.00 1.12 0.00 0.00 29.99 31.52 1ekz n HIS 36 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1ekz n MET 37 N -0.59 0.20 -4.28 -0.41 0.00 -1.26 -5.02 117.12 105.75 1ekz n MET 37 Ca 0.05 0.03 -0.33 0.00 0.00 0.00 0.00 57.70 57.45 1ekz n MET 37 Cb 0.51 -1.10 -0.07 0.00 0.00 0.00 0.00 33.22 32.56 1ekz n MET 37 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1ekz n LYS 38 N -2.63 -1.70 -3.75 2.12 4.81 -1.26 -4.94 118.16 110.82 1ekz n LYS 38 Ca -0.09 0.21 -0.12 0.00 -0.87 0.00 0.00 58.31 57.43 1ekz n LYS 38 Cb 0.59 -4.23 -0.11 0.00 0.02 0.00 0.00 35.03 31.30 1ekz n LYS 38 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1ekz s ASN 39 N -3.99 -0.34 0.15 3.14 0.01 -1.14 -4.49 114.94 108.28 1ekz s ASN 39 Ca 0.28 0.65 0.09 0.00 -0.71 0.00 0.00 52.86 53.18 1ekz s ASN 39 Cb -0.16 0.62 -0.04 0.00 0.41 0.00 0.00 41.25 42.08 1ekz s ASN 39 CO 0.97 -0.13 -0.21 -0.36 -1.51 0.00 0.00 177.10 175.86 1ekz s PHE 40 N 0.49 2.00 -0.42 2.20 0.08 0.13 -3.81 117.98 118.64 1ekz s PHE 40 Ca -0.03 -0.42 0.04 0.00 0.12 0.00 0.00 56.93 56.65 1ekz s PHE 40 Cb -0.04 -1.03 0.17 0.00 -0.57 0.00 0.00 43.02 41.55 1ekz s PHE 40 CO -0.03 0.35 0.42 0.42 -0.10 0.00 0.00 175.22 176.29 1ekz s ILE 41 N -1.62 -0.19 -0.22 0.64 1.01 -1.26 0.77 121.20 120.33 1ekz s ILE 41 Ca 0.15 -1.66 -0.29 0.00 0.00 0.00 0.00 60.65 58.84 1ekz s ILE 41 Cb -0.08 -0.78 -0.00 0.00 0.01 0.00 0.00 42.46 41.62 1ekz s ILE 41 CO 0.07 -0.74 1.18 -0.89 0.00 0.00 0.00 174.94 174.56 1ekz s THR 42 N 0.77 4.40 0.18 2.92 2.01 0.62 -4.35 115.64 122.19 1ekz s THR 42 Ca 0.26 1.67 -0.30 0.00 0.31 0.00 0.00 61.69 63.63 1ekz s THR 42 Cb -0.06 -4.16 -0.08 0.00 0.01 0.00 0.00 72.50 68.22 1ekz s THR 42 CO -0.09 -0.24 1.08 0.00 -0.69 0.00 0.00 174.62 174.68 1ekz s ALA 43 N 3.56 3.36 -0.08 7.40 0.00 0.17 0.11 121.76 136.29 1ekz s ALA 43 Ca 0.51 0.79 0.03 0.00 0.00 0.00 0.00 51.96 53.29 1ekz s ALA 43 Cb -0.18 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1ekz s ALA 43 CO 0.13 -0.17 -0.18 0.00 0.00 0.00 0.00 175.76 175.54 1ekz s ILE 45 N 0.41 2.80 0.12 0.00 2.07 0.18 -1.17 121.20 125.61 1ekz s ILE 45 Ca -0.14 -0.96 0.04 0.00 -1.41 0.00 0.00 60.65 58.18 1ekz s ILE 45 Cb -0.16 -2.11 -0.04 0.00 0.13 0.00 0.00 42.46 40.28 1ekz s ILE 45 CO 0.06 0.49 -0.10 0.54 -1.91 0.00 0.00 174.94 174.01 1ekz s VAL 46 N -0.79 1.07 -0.35 4.00 0.11 0.21 -0.46 120.40 124.19 1ekz s VAL 46 Ca 0.13 -1.86 -0.21 0.00 -2.93 0.00 0.00 61.98 57.10 1ekz s VAL 46 Cb -0.10 -1.63 -0.22 0.00 -1.53 0.00 0.00 36.38 32.90 1ekz s VAL 46 CO 0.02 -0.65 1.67 0.61 -3.33 0.00 0.00 175.10 173.42 1ekz n GLY 47 N 0.16 1.65 0.00 6.54 0.00 -1.08 -2.02 105.19 110.44 1ekz n GLY 47 Ca -0.13 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1ekz n GLY 47 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ekz n SER 48 N 7.41 0.00 -2.51 1.61 3.41 -1.26 -4.76 113.62 117.52 1ekz n SER 48 Ca 0.41 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.95 1ekz n SER 48 Cb 0.32 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.30 1ekz n SER 48 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1ekz n ILE 49 N 0.00 0.00 -3.92 -1.33 5.41 -0.86 -5.18 119.36 113.48 1ekz n ILE 49 Ca 0.00 -0.81 -0.12 0.00 1.00 0.00 0.00 62.75 62.82 1ekz n ILE 49 Cb 0.00 0.82 -0.13 0.00 -0.71 0.00 0.00 39.64 39.62 1ekz n ILE 49 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1ekz s VAL 50 N -2.24 0.07 0.05 1.39 1.01 -1.26 -0.62 120.40 118.81 1ekz s VAL 50 Ca 0.14 -0.28 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 1ekz s VAL 50 Cb -0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 36.21 1ekz s VAL 50 CO 0.10 -0.13 0.11 -0.89 0.00 0.00 0.00 175.10 174.29 1ekz s THR 51 N -0.43 0.15 -0.11 3.92 2.01 -0.32 -5.02 115.64 115.85 1ekz s THR 51 Ca -0.04 -1.21 -0.16 0.00 0.31 0.00 0.00 61.69 60.59 1ekz s THR 51 Cb -0.03 -1.11 -0.05 0.00 0.01 0.00 0.00 72.50 71.32 1ekz s THR 51 CO -0.00 -0.67 0.41 -1.83 -0.69 0.00 0.00 174.62 171.84 1ekz s GLU 52 N -3.15 4.22 -1.11 4.92 1.03 -1.26 -0.69 118.70 122.66 1ekz s GLU 52 Ca -0.00 0.33 -0.11 0.00 0.03 0.00 0.00 54.97 55.22 1ekz s GLU 52 Cb 0.02 -3.39 0.24 0.00 -0.80 0.00 0.00 34.13 30.20 1ekz s GLU 52 CO -0.07 0.30 1.18 0.20 -1.33 0.00 0.00 175.26 175.54 1ekz s GLY 53 N 0.22 2.90 0.20 -3.83 0.00 0.31 -4.90 107.32 102.22 1ekz s GLY 53 Ca 0.23 -3.63 -0.30 0.00 0.00 0.00 0.00 44.72 41.02 1ekz s GLY 53 CO 0.09 1.56 1.09 -1.83 0.00 0.00 0.00 173.10 174.01 1ekz s GLU 54 N -0.18 4.62 -0.10 2.90 4.04 -1.26 -0.27 118.70 128.44 1ekz s GLU 54 Ca 0.33 1.72 -0.07 0.00 0.04 0.00 0.00 54.97 57.00 1ekz s GLU 54 Cb -0.08 -3.26 0.03 0.00 0.02 0.00 0.00 34.13 30.85 1ekz s GLU 54 CO -0.06 0.13 0.25 0.20 -1.84 0.00 0.00 175.26 173.94 1ekz s GLY 55 N -0.34 -0.17 0.06 -3.83 0.00 0.23 -4.38 107.32 98.89 1ekz s GLY 55 Ca 0.48 0.86 -0.18 0.00 0.00 0.00 0.00 44.72 45.88 1ekz s GLY 55 CO 0.36 0.92 1.28 -0.57 0.00 0.00 0.00 173.10 175.10 1ekz h ASN 56 N 6.42 -0.84 0.00 1.64 -0.73 -1.80 0.36 115.58 120.63 1ekz h ASN 56 Ca -0.33 0.09 0.00 0.00 1.87 0.00 0.00 56.30 57.94 1ekz h ASN 56 Cb 1.18 0.32 0.00 0.00 0.27 0.00 0.00 38.32 40.08 1ekz h ASN 56 CO 0.36 -0.27 0.00 0.61 -0.37 0.00 0.00 177.43 177.76 1ekz n GLY 57 N -1.24 1.49 3.40 1.57 0.00 -0.82 -2.70 105.19 106.89 1ekz n GLY 57 Ca -0.04 -0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1ekz n GLY 57 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ekz n LYS 58 N 0.00 0.98 -0.99 1.61 4.81 -1.26 -3.34 118.16 119.97 1ekz n LYS 58 Ca 0.00 -1.81 0.00 0.00 -0.87 0.00 0.00 58.31 55.63 1ekz n LYS 58 Cb 0.00 -3.22 0.00 0.00 0.02 0.00 0.00 35.03 31.83 1ekz n LYS 58 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1ekz n LYS 59 N 7.76 -0.00 -4.29 1.64 4.81 -1.26 -5.00 118.16 121.81 1ekz n LYS 59 Ca 0.46 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.72 1ekz n LYS 59 Cb 0.44 -2.57 -0.11 0.00 0.02 0.00 0.00 35.03 32.81 1ekz n LYS 59 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1ekz s VAL 60 N -3.83 1.53 0.00 3.15 0.11 -1.21 -4.98 120.40 115.17 1ekz s VAL 60 Ca 0.00 -1.97 0.00 0.00 -2.93 0.00 0.00 61.98 57.08 1ekz s VAL 60 Cb 0.00 -1.80 0.00 0.00 -1.53 0.00 0.00 36.38 33.05 1ekz s VAL 60 CO 0.00 -0.51 0.00 -1.54 -3.33 0.00 0.00 175.10 169.72 1ekz n SER 61 N 0.08 0.00 -0.24 3.54 3.41 -1.26 -1.95 113.62 117.20 1ekz n SER 61 Ca -0.12 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.58 1ekz n SER 61 Cb 0.59 0.00 0.36 0.00 -0.26 0.00 0.00 64.21 64.89 1ekz n SER 61 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ekz h LYS 62 N 0.00 0.72 0.84 4.33 1.79 -1.95 0.12 116.57 122.42 1ekz h LYS 62 Ca 0.00 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.39 1ekz h LYS 62 Cb 0.00 -0.16 0.01 0.00 -1.58 0.00 0.00 32.23 30.50 1ekz h LYS 62 CO 0.00 0.48 -0.40 0.87 -1.08 0.00 0.00 179.45 179.31 1ekz h LYS 63 N 0.74 -1.09 -0.48 3.15 1.57 -1.93 0.14 116.57 118.67 1ekz h LYS 63 Ca 0.39 0.07 0.13 0.00 -1.87 0.00 0.00 60.65 59.37 1ekz h LYS 63 Cb 0.51 0.25 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 1ekz h LYS 63 CO -0.16 -0.73 0.34 0.00 -0.57 0.00 0.00 179.45 178.33 1ekz h ARG 64 N -1.13 0.06 0.26 3.15 2.47 -1.76 0.34 114.38 117.76 1ekz h ARG 64 Ca -0.12 -0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.59 1ekz h ARG 64 Cb 0.87 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.18 1ekz h ARG 64 CO 0.19 0.04 -0.13 0.00 0.56 0.00 0.00 179.97 180.63 1ekz h ALA 65 N 1.76 -0.35 -0.63 0.04 0.00 -0.23 -2.30 119.26 117.55 1ekz h ALA 65 Ca 0.23 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1ekz h ALA 65 Cb 0.83 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1ekz h ALA 65 CO -0.01 -0.51 0.08 0.00 0.00 0.00 0.00 179.25 178.81 1ekz h ALA 66 N -0.15 0.83 -0.55 0.00 0.00 0.01 -2.68 119.26 116.73 1ekz h ALA 66 Ca -0.04 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.71 1ekz h ALA 66 Cb 0.49 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 17.96 1ekz h ALA 66 CO 0.06 0.61 0.06 0.93 0.00 0.00 0.00 179.25 180.91 1ekz h GLU 67 N 0.96 0.18 0.58 0.00 5.08 -0.37 0.55 114.58 121.55 1ekz h GLU 67 Ca 0.19 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1ekz h GLU 67 Cb 0.45 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1ekz h GLU 67 CO 0.02 0.12 -0.34 0.87 -1.00 0.00 0.00 179.01 178.68 1ekz h LYS 68 N 0.18 -0.83 -0.35 2.33 1.57 -1.18 0.23 116.57 118.53 1ekz h LYS 68 Ca 0.28 0.06 0.07 0.00 -1.87 0.00 0.00 60.65 59.19 1ekz h LYS 68 Cb 0.42 0.19 -0.09 0.00 0.08 0.00 0.00 32.23 32.84 1ekz h LYS 68 CO -0.41 -0.55 -0.30 1.98 -0.57 0.00 0.00 179.45 179.60 1ekz h MET 69 N -0.86 -0.25 -0.20 3.15 4.05 -1.02 0.41 114.93 120.21 1ekz h MET 69 Ca -0.07 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1ekz h MET 69 Cb 0.69 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.54 1ekz h MET 69 CO 0.08 -0.16 0.11 -0.07 0.23 0.00 0.00 176.91 177.10 1ekz h LEU 70 N -0.26 0.25 -0.89 3.39 -0.00 -0.78 0.20 115.31 117.22 1ekz h LEU 70 Ca 0.16 -0.08 0.09 0.00 -0.00 0.00 0.00 57.88 58.05 1ekz h LEU 70 Cb 0.52 -0.06 -0.07 0.00 -0.00 0.00 0.00 40.66 41.04 1ekz h LEU 70 CO -0.49 0.26 0.54 0.58 -0.00 0.00 0.00 178.44 179.33 1ekz h VAL 71 N 0.22 0.96 0.38 1.22 2.07 0.36 0.66 116.25 122.13 1ekz h VAL 71 Ca 0.07 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1ekz h VAL 71 Cb 0.07 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.80 1ekz h VAL 71 CO -0.01 0.17 -0.18 -0.33 0.02 0.00 0.00 177.57 177.23 1ekz h GLU 72 N 0.92 -0.49 0.00 1.57 5.08 0.28 -2.90 114.58 119.04 1ekz h GLU 72 Ca 0.42 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.79 1ekz h GLU 72 Cb 0.32 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1ekz h GLU 72 CO -0.22 -0.18 -0.11 1.37 -1.00 0.00 0.00 179.01 178.87 1ekz h LEU 73 N -0.89 0.00 -0.71 1.33 8.10 -0.27 -1.31 115.31 121.56 1ekz h LEU 73 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.94 1ekz h LEU 73 Cb 0.54 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.76 1ekz h LEU 73 CO 0.09 0.11 0.00 0.00 -4.11 0.00 0.00 178.44 174.53 1ekz n GLN 74 N -4.09 1.46 0.00 0.17 6.02 0.23 -3.75 117.38 117.41 1ekz n GLN 74 Ca -0.02 -0.70 0.00 0.00 -0.01 0.00 0.00 57.00 56.27 1ekz n GLN 74 Cb 0.19 -1.29 0.00 0.00 1.02 0.00 0.00 30.24 30.16 1ekz n GLN 74 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1ekz n LYS 75 N -0.04 0.11 0.00 -1.09 4.81 -0.54 -5.03 118.16 116.38 1ekz n LYS 75 Ca 0.12 -0.41 0.11 0.00 -0.87 0.00 0.00 58.31 57.26 1ekz n LYS 75 Cb 0.21 -0.69 0.10 0.00 0.02 0.00 0.00 35.03 34.66 1ekz n LYS 75 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85