#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ekz n ASP 2 N 0.00 0.00 0.18 7.83 5.75 -1.26 -4.99 116.55 124.06 1ekz n ASP 2 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 54.79 54.71 1ekz n ASP 2 Cb 0.00 0.03 -0.04 0.00 -1.03 0.00 0.00 41.12 40.09 1ekz n ASP 2 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1ekz h GLU 3 N 0.00 -0.45 0.00 0.11 4.81 -2.11 -3.49 114.58 113.44 1ekz h GLU 3 Ca 0.00 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1ekz h GLU 3 Cb 0.00 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1ekz h GLU 3 CO 0.00 -0.30 0.00 0.41 -0.73 0.00 0.00 179.01 178.39 1ekz n GLY 4 N -1.24 -3.48 3.72 1.92 0.00 -1.26 -4.89 105.19 99.97 1ekz n GLY 4 Ca -0.06 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 1ekz n GLY 4 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ekz s ASP 5 N -1.11 6.65 0.00 1.61 1.11 -1.26 -4.87 116.67 118.80 1ekz s ASP 5 Ca 0.00 2.56 0.00 0.00 0.18 0.00 0.00 52.55 55.29 1ekz s ASP 5 Cb 0.00 -2.60 0.00 0.00 1.07 0.00 0.00 42.92 41.39 1ekz s ASP 5 CO 0.00 -0.76 0.21 0.29 1.18 0.00 0.00 175.17 176.09 1ekz n LYS 6 N 3.63 1.87 -3.69 8.23 4.76 -1.26 -5.07 118.16 126.62 1ekz n LYS 6 Ca 0.12 -0.21 -0.11 0.00 -2.87 0.00 0.00 58.31 55.24 1ekz n LYS 6 Cb 0.40 -0.66 -0.06 0.00 -1.84 0.00 0.00 35.03 32.87 1ekz n LYS 6 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1ekz s LYS 7 N -0.33 0.97 -0.61 1.97 1.02 -1.26 -5.11 119.74 116.38 1ekz s LYS 7 Ca 0.00 -0.64 -0.10 0.00 0.02 0.00 0.00 55.97 55.25 1ekz s LYS 7 Cb 0.00 0.42 0.16 0.00 -0.52 0.00 0.00 37.83 37.89 1ekz s LYS 7 CO 0.00 -0.35 0.50 -1.54 -0.92 0.00 0.00 175.35 173.04 1ekz s SER 8 N -2.53 5.95 0.39 2.83 1.04 -1.26 -5.07 113.70 115.06 1ekz s SER 8 Ca 0.00 -2.32 -0.23 0.00 0.48 0.00 0.00 55.95 53.88 1ekz s SER 8 Cb 0.01 -2.06 -0.10 0.00 0.10 0.00 0.00 66.02 63.98 1ekz s SER 8 CO -0.09 -0.61 1.00 -2.16 0.98 0.00 0.00 173.24 172.36 1ekz s PRO 9 N 0.75 4.26 -0.11 4.02 0.04 -1.26 -4.83 135.00 137.86 1ekz s PRO 9 Ca 0.11 1.36 -0.28 0.00 0.04 0.00 0.00 61.00 62.23 1ekz s PRO 9 Cb -0.21 -2.48 -0.26 0.00 0.04 0.00 0.00 34.50 31.59 1ekz s PRO 9 CO -0.03 -0.03 0.86 0.82 0.04 0.00 0.00 177.00 178.65 1ekz h ILE 10 N 2.17 1.71 -0.61 0.56 1.08 -1.97 -3.14 117.51 117.32 1ekz h ILE 10 Ca -0.48 -2.20 0.12 0.00 -0.39 0.00 0.00 64.86 61.91 1ekz h ILE 10 Cb 1.20 3.20 -0.11 0.00 -3.07 0.00 0.00 36.82 38.03 1ekz h ILE 10 CO 0.62 0.58 -0.15 0.28 -0.69 0.00 0.00 178.15 178.79 1ekz h SER 11 N -0.85 -0.56 -0.61 1.72 0.02 -1.98 0.26 113.55 111.55 1ekz h SER 11 Ca -0.01 0.18 0.03 0.00 -0.84 0.00 0.00 61.79 61.14 1ekz h SER 11 Cb 0.99 0.37 -0.04 0.00 0.14 0.00 0.00 62.40 63.87 1ekz h SER 11 CO 0.02 -0.20 0.37 1.56 -1.14 0.00 0.00 176.83 177.44 1ekz h GLN 12 N 0.00 0.72 -0.60 3.45 4.20 -1.99 0.45 115.11 121.33 1ekz h GLN 12 Ca 0.29 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.98 1ekz h GLN 12 Cb 0.44 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 1ekz h GLN 12 CO -0.62 0.47 0.38 0.28 -0.67 0.00 0.00 178.83 178.68 1ekz h VAL 13 N 0.74 1.11 -0.76 -0.54 2.07 -0.80 0.22 116.25 118.29 1ekz h VAL 13 Ca 0.25 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1ekz h VAL 13 Cb 0.02 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.03 1ekz h VAL 13 CO -0.10 0.14 0.40 0.45 0.02 0.00 0.00 177.57 178.48 1ekz h HIS 14 N 0.77 1.04 0.70 1.57 3.86 0.44 0.79 115.15 124.33 1ekz h HIS 14 Ca 0.23 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.38 1ekz h HIS 14 Cb -0.03 -0.33 -0.00 0.00 1.06 0.00 0.00 27.41 28.10 1ekz h HIS 14 CO -0.04 0.74 -0.41 1.49 0.86 0.00 0.00 177.93 180.56 1ekz h GLU 15 N 1.06 -1.00 -0.73 2.45 4.22 0.17 0.33 114.58 121.09 1ekz h GLU 15 Ca 0.27 0.07 0.03 0.00 0.08 0.00 0.00 59.36 59.80 1ekz h GLU 15 Cb 0.05 0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1ekz h GLU 15 CO -0.04 -0.67 0.48 -0.84 -2.18 0.00 0.00 179.01 175.76 1ekz h ILE 16 N -1.04 1.12 -0.11 2.32 -0.00 -0.90 1.43 117.51 120.32 1ekz h ILE 16 Ca -0.10 -0.31 -0.00 0.00 -0.00 0.00 0.00 64.86 64.45 1ekz h ILE 16 Cb 0.82 0.15 -0.01 0.00 -0.00 0.00 0.00 36.82 37.78 1ekz h ILE 16 CO 0.11 0.16 0.05 1.23 -0.00 0.00 0.00 178.15 179.70 1ekz h GLY 17 N 0.89 0.18 1.44 0.16 0.00 -0.55 -0.47 103.07 104.72 1ekz h GLY 17 Ca 0.29 -0.09 -0.20 0.00 0.00 0.00 0.00 47.33 47.32 1ekz h GLY 17 CO -0.08 0.09 -0.77 -2.22 0.00 0.00 0.00 176.54 173.55 1ekz h ILE 18 N 0.04 1.34 -0.45 2.60 1.08 0.27 0.42 117.51 122.81 1ekz h ILE 18 Ca 0.04 -2.11 -0.02 0.00 -0.39 0.00 0.00 64.86 62.38 1ekz h ILE 18 Cb 0.14 2.10 -0.02 0.00 -3.07 0.00 0.00 36.82 35.96 1ekz h ILE 18 CO -0.00 0.65 0.21 0.11 -0.69 0.00 0.00 178.15 178.42 1ekz h LYS 19 N 0.37 0.62 0.00 2.37 1.79 0.21 -3.36 116.57 118.57 1ekz h LYS 19 Ca -0.05 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 1ekz h LYS 19 Cb 1.37 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 1ekz h LYS 19 CO 0.14 0.49 0.00 0.54 -1.08 0.00 0.00 179.45 179.55 1ekz n ARG 20 N -4.39 0.00 0.00 3.15 1.74 -0.20 -5.05 116.66 111.91 1ekz n ARG 20 Ca 0.03 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 1ekz n ARG 20 Cb 0.13 -0.52 0.00 0.00 -1.02 0.00 0.00 32.46 31.05 1ekz n ARG 20 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1ekz n ASN 21 N -2.01 0.00 -4.01 0.55 2.85 -0.57 -5.09 115.26 106.98 1ekz n ASN 21 Ca 0.00 0.00 -0.17 0.00 -0.11 0.00 0.00 54.58 54.30 1ekz n ASN 21 Cb 0.00 0.00 -0.14 0.00 1.24 0.00 0.00 39.78 40.88 1ekz n ASN 21 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 1ekz s MET 22 N 0.00 0.62 0.21 1.20 -1.94 0.14 -4.56 119.30 114.96 1ekz s MET 22 Ca 0.00 -0.34 -0.09 0.00 -1.71 0.00 0.00 55.69 53.55 1ekz s MET 22 Cb 0.00 -0.58 0.15 0.00 2.01 0.00 0.00 34.83 36.41 1ekz s MET 22 CO 0.00 0.16 1.83 1.79 -0.01 0.00 0.00 175.02 178.78 1ekz h THR 23 N 4.89 1.23 -4.78 2.05 1.35 -1.85 -3.38 112.91 112.43 1ekz h THR 23 Ca -0.30 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 1ekz h THR 23 Cb 1.19 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1ekz h THR 23 CO 0.49 0.25 -0.11 0.52 -0.25 0.00 0.00 175.52 176.42 1ekz n VAL 24 N -4.45 -8.25 -4.10 6.82 0.31 -1.12 -4.97 118.33 102.57 1ekz n VAL 24 Ca 0.07 0.06 -0.33 0.00 -0.01 0.00 0.00 64.34 64.14 1ekz n VAL 24 Cb 0.09 -6.23 -0.16 0.00 -0.91 0.00 0.00 33.84 26.63 1ekz n VAL 24 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1ekz s HIS 25 N -2.78 2.85 0.18 3.52 3.76 -0.18 -4.96 115.29 117.68 1ekz s HIS 25 Ca 0.05 -1.77 -0.09 0.00 -0.15 0.00 0.00 55.06 53.11 1ekz s HIS 25 Cb -0.02 -1.91 -0.07 0.00 1.11 0.00 0.00 32.58 31.70 1ekz s HIS 25 CO 0.57 -0.82 0.48 -0.06 -0.85 0.00 0.00 174.74 174.07 1ekz s PHE 26 N 1.26 3.47 -0.28 1.40 0.08 -1.26 -0.43 117.98 122.22 1ekz s PHE 26 Ca 0.02 0.79 -0.09 0.00 0.12 0.00 0.00 56.93 57.77 1ekz s PHE 26 Cb -0.14 -2.18 0.13 0.00 -0.57 0.00 0.00 43.02 40.25 1ekz s PHE 26 CO -0.11 0.36 0.60 0.21 -0.10 0.00 0.00 175.22 176.18 1ekz s LYS 27 N -2.60 0.53 0.05 0.44 2.20 0.12 -4.95 119.74 115.53 1ekz s LYS 27 Ca 0.43 1.34 -0.30 0.00 -0.36 0.00 0.00 55.97 57.08 1ekz s LYS 27 Cb -0.12 0.74 -0.05 0.00 -1.51 0.00 0.00 37.83 36.89 1ekz s LYS 27 CO 0.22 -0.25 1.10 0.08 -0.36 0.00 0.00 175.35 176.13 1ekz s VAL 28 N 2.84 4.34 -0.02 4.02 1.01 -1.26 -0.13 120.40 131.19 1ekz s VAL 28 Ca -0.03 1.71 -0.24 0.00 0.00 0.00 0.00 61.98 63.42 1ekz s VAL 28 Cb -0.12 -4.10 -0.20 0.00 0.00 0.00 0.00 36.38 31.96 1ekz s VAL 28 CO -0.18 0.15 1.18 -0.07 0.00 0.00 0.00 175.10 176.18 1ekz h LEU 29 N 6.59 0.16 0.00 3.92 3.38 -1.05 -3.46 115.31 124.85 1ekz h LEU 29 Ca -0.42 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 56.94 1ekz h LEU 29 Cb 1.22 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1ekz h LEU 29 CO 0.78 0.74 0.00 -2.11 0.09 0.00 0.00 178.44 177.94 1ekz n ARG 30 N -4.66 0.00 0.00 1.13 1.85 -1.24 -5.08 116.66 108.66 1ekz n ARG 30 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.77 1ekz n ARG 30 Cb 0.37 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.78 1ekz n ARG 30 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 1ekz n GLU 31 N 0.00 3.17 -3.07 2.89 0.28 -1.26 -4.07 120.64 118.58 1ekz n GLU 31 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.16 56.61 1ekz n GLU 31 Cb 0.00 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 32.81 1ekz n GLU 31 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 1ekz s GLU 32 N 0.00 4.45 -0.08 3.44 -1.05 -1.15 -4.93 118.70 119.39 1ekz s GLU 32 Ca 0.00 1.03 -0.05 0.00 -0.15 0.00 0.00 54.97 55.80 1ekz s GLU 32 Cb 0.00 -3.24 -0.02 0.00 -0.44 0.00 0.00 34.13 30.43 1ekz s GLU 32 CO 0.00 0.59 -0.09 0.78 0.95 0.00 0.00 175.26 177.48 1ekz h GLY 33 N 4.35 0.00 -3.83 -3.83 0.00 -1.94 -3.47 103.07 94.35 1ekz h GLY 33 Ca -0.48 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.34 1ekz h GLY 33 CO 0.65 0.00 0.23 2.56 0.00 0.00 0.00 176.54 179.98 1ekz s PRO 34 N -1.68 4.59 -1.06 4.80 0.04 -1.26 -4.93 135.00 135.49 1ekz s PRO 34 Ca -0.08 1.21 -0.25 0.00 0.04 0.00 0.00 61.00 61.92 1ekz s PRO 34 Cb 0.01 -3.15 -0.15 0.00 0.04 0.00 0.00 34.50 31.26 1ekz s PRO 34 CO 0.11 0.50 2.08 0.00 0.04 0.00 0.00 177.00 179.72 1ekz s ALA 35 N -1.27 1.08 0.00 8.56 0.00 -1.26 -3.61 121.76 125.26 1ekz s ALA 35 Ca 0.40 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1ekz s ALA 35 Cb -0.22 -4.66 0.00 0.00 0.00 0.00 0.00 23.12 18.24 1ekz s ALA 35 CO 0.26 -5.98 0.00 1.58 0.00 0.00 0.00 175.76 171.62 1ekz n HIS 36 N 17.13 0.00 -3.43 0.00 -0.00 -1.26 -5.03 115.22 122.63 1ekz n HIS 36 Ca 0.43 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.79 1ekz n HIS 36 Cb 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.41 1ekz n HIS 36 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 1ekz n MET 37 N -0.69 3.11 -1.26 1.57 0.00 -1.24 -4.99 117.12 113.62 1ekz n MET 37 Ca 0.00 -4.54 -0.21 0.00 0.00 0.00 0.00 57.70 52.95 1ekz n MET 37 Cb 0.00 -2.41 -0.11 0.00 0.00 0.00 0.00 33.22 30.70 1ekz n MET 37 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1ekz n LYS 38 N 1.77 0.06 -4.22 2.12 4.01 -1.26 -4.29 118.16 116.35 1ekz n LYS 38 Ca 0.25 -1.43 -0.18 0.00 -0.51 0.00 0.00 58.31 56.44 1ekz n LYS 38 Cb 0.37 -3.41 -0.13 0.00 -0.51 0.00 0.00 35.03 31.36 1ekz n LYS 38 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1ekz s ASN 39 N 7.72 1.43 -0.29 4.39 4.22 -1.26 -4.27 114.94 126.88 1ekz s ASN 39 Ca 0.74 -0.50 -0.02 0.00 -2.14 0.00 0.00 52.86 50.94 1ekz s ASN 39 Cb 0.01 -0.06 0.10 0.00 1.28 0.00 0.00 41.25 42.57 1ekz s ASN 39 CO 0.22 -0.05 0.10 -0.36 -2.04 0.00 0.00 177.10 174.97 1ekz s PHE 40 N -1.04 1.35 -0.61 1.54 0.40 -0.47 -2.91 117.98 116.24 1ekz s PHE 40 Ca -0.02 -1.47 -0.22 0.00 -0.60 0.00 0.00 56.93 54.62 1ekz s PHE 40 Cb -0.09 -1.47 0.07 0.00 0.51 0.00 0.00 43.02 42.04 1ekz s PHE 40 CO 0.01 -0.84 0.88 0.42 0.70 0.00 0.00 175.22 176.39 1ekz s ILE 41 N 1.74 4.48 -0.26 0.64 -1.09 -1.26 -2.74 121.20 122.73 1ekz s ILE 41 Ca 0.08 -0.36 -0.05 0.00 -2.23 0.00 0.00 60.65 58.10 1ekz s ILE 41 Cb -0.17 -4.58 0.00 0.00 -1.58 0.00 0.00 42.46 36.13 1ekz s ILE 41 CO -0.26 -1.26 0.01 -0.89 -1.23 0.00 0.00 174.94 171.32 1ekz s THR 42 N 3.64 3.61 0.41 2.92 2.01 -0.50 -0.35 115.64 127.39 1ekz s THR 42 Ca 0.21 -0.62 0.07 0.00 0.31 0.00 0.00 61.69 61.66 1ekz s THR 42 Cb -0.18 -2.77 0.01 0.00 0.01 0.00 0.00 72.50 69.58 1ekz s THR 42 CO 0.11 0.25 0.56 0.00 -0.69 0.00 0.00 174.62 174.85 1ekz s ALA 43 N 1.48 4.45 -0.02 7.40 0.00 0.81 0.10 121.76 135.99 1ekz s ALA 43 Ca 0.04 -1.62 -0.18 0.00 0.00 0.00 0.00 51.96 50.20 1ekz s ALA 43 Cb -0.16 -1.66 0.03 0.00 0.00 0.00 0.00 23.12 21.34 1ekz s ALA 43 CO -0.01 -0.25 0.38 0.00 0.00 0.00 0.00 175.76 175.88 1ekz s ILE 45 N -1.40 1.29 -0.22 0.00 -1.16 0.43 0.23 121.20 120.36 1ekz s ILE 45 Ca -0.12 -0.69 -0.04 0.00 -0.51 0.00 0.00 60.65 59.29 1ekz s ILE 45 Cb -0.04 -1.08 0.08 0.00 0.61 0.00 0.00 42.46 42.03 1ekz s ILE 45 CO 0.05 0.37 0.09 0.68 -2.81 0.00 0.00 174.94 173.31 1ekz s VAL 46 N -0.33 0.12 0.00 4.00 -7.23 0.37 -1.01 120.40 116.33 1ekz s VAL 46 Ca 0.05 -0.53 0.00 0.00 -1.81 0.00 0.00 61.98 59.69 1ekz s VAL 46 Cb -0.07 -0.88 0.00 0.00 0.56 0.00 0.00 36.38 35.99 1ekz s VAL 46 CO -0.00 -0.44 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 1ekz n GLY 47 N 5.19 1.50 0.04 2.32 0.00 -1.26 -2.47 105.19 110.50 1ekz n GLY 47 Ca -0.07 0.16 0.01 0.00 0.00 0.00 0.00 46.02 46.13 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 7.01 1.49 -4.24 1.61 3.41 -1.26 -4.85 113.62 116.80 1ekz n SER 48 Ca 0.00 -1.94 -0.28 0.00 -0.26 0.00 0.00 58.87 56.39 1ekz n SER 48 Cb 0.00 -0.07 -0.16 0.00 -0.26 0.00 0.00 64.21 63.72 1ekz n SER 48 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1ekz s ILE 49 N -0.99 1.76 0.15 -1.33 2.07 -1.03 -5.14 121.20 116.69 1ekz s ILE 49 Ca 0.05 -0.94 0.10 0.00 -1.41 0.00 0.00 60.65 58.45 1ekz s ILE 49 Cb 0.04 -1.47 -0.04 0.00 0.13 0.00 0.00 42.46 41.12 1ekz s ILE 49 CO 0.00 0.50 -0.21 -0.69 -1.91 0.00 0.00 174.94 172.63 1ekz s VAL 50 N -0.42 2.59 0.01 4.00 1.01 -1.26 -0.48 120.40 125.85 1ekz s VAL 50 Ca 0.06 -1.73 -0.01 0.00 0.00 0.00 0.00 61.98 60.30 1ekz s VAL 50 Cb -0.10 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.07 1ekz s VAL 50 CO 0.00 0.02 0.01 0.42 0.00 0.00 0.00 175.10 175.54 1ekz s THR 51 N -1.32 0.06 0.00 3.92 -4.23 0.13 -4.97 115.64 109.23 1ekz s THR 51 Ca 0.18 -0.50 -0.01 0.00 -1.18 0.00 0.00 61.69 60.18 1ekz s THR 51 Cb -0.10 -0.18 -0.04 0.00 1.34 0.00 0.00 72.50 73.53 1ekz s THR 51 CO 0.09 -0.28 0.11 -1.83 -0.54 0.00 0.00 174.62 172.18 1ekz s GLU 52 N -0.82 3.17 -0.25 3.99 1.03 -1.26 0.36 118.70 124.90 1ekz s GLU 52 Ca -0.09 -0.45 -0.03 0.00 0.03 0.00 0.00 54.97 54.43 1ekz s GLU 52 Cb -0.06 -2.92 0.02 0.00 -0.80 0.00 0.00 34.13 30.37 1ekz s GLU 52 CO -0.00 0.65 -0.03 0.20 -1.33 0.00 0.00 175.26 174.75 1ekz s GLY 53 N -1.86 1.66 -1.15 -3.83 0.00 0.29 -4.74 107.32 97.69 1ekz s GLY 53 Ca 0.25 -1.42 -0.08 0.00 0.00 0.00 0.00 44.72 43.47 1ekz s GLY 53 CO 0.16 0.54 1.45 -1.84 0.00 0.00 0.00 173.10 173.41 1ekz n GLU 54 N 4.73 3.87 -3.56 2.90 0.00 -1.26 -1.41 120.64 125.91 1ekz n GLU 54 Ca -0.16 -4.21 -0.38 0.00 0.00 0.00 0.00 57.16 52.41 1ekz n GLU 54 Cb 0.48 -2.69 -0.09 0.00 0.00 0.00 0.00 31.44 29.13 1ekz n GLU 54 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1ekz s GLY 55 N 0.38 1.97 -1.55 -1.84 0.00 -1.11 -4.90 107.32 100.27 1ekz s GLY 55 Ca 0.35 -0.87 -0.11 0.00 0.00 0.00 0.00 44.72 44.09 1ekz s GLY 55 CO 0.02 0.61 2.66 0.70 0.00 0.00 0.00 173.10 177.09 1ekz n ASN 56 N 4.66 6.97 0.00 1.64 4.13 -1.26 -1.37 115.26 130.03 1ekz n ASN 56 Ca -0.13 -2.70 0.00 0.00 1.68 0.00 0.00 54.58 53.43 1ekz n ASN 56 Cb 0.52 -1.58 0.00 0.00 -1.54 0.00 0.00 39.78 37.17 1ekz n ASN 56 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ekz n GLY 57 N 3.65 4.09 0.31 7.41 0.00 -1.26 -4.83 105.19 114.56 1ekz n GLY 57 Ca 0.68 -1.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 1ekz n GLY 57 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ekz h LYS 58 N 0.00 -0.35 -1.00 1.61 1.79 -1.96 0.42 116.57 117.08 1ekz h LYS 58 Ca 0.00 0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.52 1ekz h LYS 58 Cb 0.00 0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 30.68 1ekz h LYS 58 CO 0.00 -0.24 0.66 -0.22 -1.08 0.00 0.00 179.45 178.57 1ekz h LYS 59 N -0.37 1.27 -0.05 3.15 1.63 -1.96 -2.52 116.57 117.72 1ekz h LYS 59 Ca 0.09 -0.08 -0.16 0.00 -0.85 0.00 0.00 60.65 59.66 1ekz h LYS 59 Cb 0.51 -0.29 -0.01 0.00 -0.60 0.00 0.00 32.23 31.84 1ekz h LYS 59 CO -0.32 0.84 -0.69 0.28 -3.45 0.00 0.00 179.45 176.11 1ekz h VAL 60 N 1.31 1.42 0.00 2.00 2.07 -1.67 -3.18 116.25 118.20 1ekz h VAL 60 Ca 0.38 -2.17 0.00 0.00 0.82 0.00 0.00 66.70 65.73 1ekz h VAL 60 Cb -0.08 2.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1ekz h VAL 60 CO -0.10 0.64 0.00 -1.54 0.02 0.00 0.00 177.57 176.59 1ekz n SER 61 N -3.81 0.00 -0.24 0.57 3.41 0.14 0.87 113.62 114.56 1ekz n SER 61 Ca -0.03 0.65 0.26 0.00 -0.26 0.00 0.00 58.87 59.50 1ekz n SER 61 Cb 0.67 -0.15 0.65 0.00 -0.26 0.00 0.00 64.21 65.12 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 0.15 0.19 4.33 1.57 -1.73 0.17 116.57 121.25 1ekz h LYS 62 Ca 0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1ekz h LYS 62 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1ekz h LYS 62 CO 0.00 0.10 -0.09 0.87 -0.57 0.00 0.00 179.45 179.76 1ekz h LYS 63 N 0.15 -0.24 -1.01 3.15 6.56 -1.47 0.46 116.57 124.17 1ekz h LYS 63 Ca 0.48 0.02 0.23 0.00 -1.06 0.00 0.00 60.65 60.32 1ekz h LYS 63 Cb 1.63 0.05 -0.11 0.00 -0.57 0.00 0.00 32.23 33.24 1ekz h LYS 63 CO -0.09 -0.16 0.62 -0.09 -2.06 0.00 0.00 179.45 177.67 1ekz h ARG 64 N -0.40 0.56 -0.02 3.15 9.65 1.00 0.37 114.38 128.68 1ekz h ARG 64 Ca -0.03 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1ekz h ARG 64 Cb 0.19 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 28.64 1ekz h ARG 64 CO 0.04 0.37 0.01 0.00 2.80 0.00 0.00 179.97 183.19 1ekz h ALA 65 N 1.67 0.03 -0.28 2.80 0.00 -0.69 -2.42 119.26 120.38 1ekz h ALA 65 Ca 0.61 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.36 1ekz h ALA 65 Cb 1.21 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1ekz h ALA 65 CO -0.39 -0.35 0.01 0.00 0.00 0.00 0.00 179.25 178.51 1ekz h ALA 66 N 0.78 0.38 -0.11 0.00 0.00 0.13 -2.64 119.26 117.80 1ekz h ALA 66 Ca 0.01 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1ekz h ALA 66 Cb 0.23 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 1ekz h ALA 66 CO 0.00 0.12 -0.30 0.93 0.00 0.00 0.00 179.25 180.00 1ekz h GLU 67 N 0.29 -0.37 -0.62 0.00 5.08 -0.36 0.32 114.58 118.91 1ekz h GLU 67 Ca 0.08 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.57 1ekz h GLU 67 Cb 0.42 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.67 1ekz h GLU 67 CO 0.01 -0.25 0.18 0.87 -1.00 0.00 0.00 179.01 178.83 1ekz h LYS 68 N -0.38 0.32 0.44 2.33 1.57 -1.42 0.55 116.57 119.99 1ekz h LYS 68 Ca 0.09 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1ekz h LYS 68 Cb 0.52 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1ekz h LYS 68 CO -0.32 0.21 -0.21 0.52 -0.57 0.00 0.00 179.45 179.08 1ekz h MET 69 N 0.33 -0.57 -0.38 3.15 2.86 -0.85 -2.48 114.93 116.99 1ekz h MET 69 Ca 0.32 0.04 0.03 0.00 -2.06 0.00 0.00 59.70 58.04 1ekz h MET 69 Cb 0.45 0.13 -0.04 0.00 0.06 0.00 0.00 31.60 32.21 1ekz h MET 69 CO -0.37 -0.33 0.17 -0.07 1.06 0.00 0.00 176.91 177.37 1ekz h LEU 70 N -0.69 0.23 -0.88 1.22 3.38 0.22 0.63 115.31 119.42 1ekz h LEU 70 Ca -0.06 0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.10 1ekz h LEU 70 Cb 0.51 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.14 1ekz h LEU 70 CO 0.10 0.17 0.45 0.58 0.09 0.00 0.00 178.44 179.83 1ekz h VAL 71 N 0.35 0.68 0.01 1.22 2.07 0.17 0.48 116.25 121.24 1ekz h VAL 71 Ca 0.17 -0.21 -0.16 0.00 0.82 0.00 0.00 66.70 67.32 1ekz h VAL 71 Cb 0.10 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.87 1ekz h VAL 71 CO -0.14 0.11 -0.87 -0.33 0.02 0.00 0.00 177.57 176.37 1ekz h GLU 72 N 0.60 0.01 -0.39 1.57 4.39 -0.96 -3.13 114.58 116.68 1ekz h GLU 72 Ca 0.49 -0.02 0.11 0.00 0.34 0.00 0.00 59.36 60.28 1ekz h GLU 72 Cb 0.75 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.40 1ekz h GLU 72 CO -0.39 1.01 0.30 -0.07 -1.16 0.00 0.00 179.01 178.70 1ekz h LEU 73 N -0.96 0.00 0.00 1.33 4.07 0.46 0.46 115.31 120.67 1ekz h LEU 73 Ca -0.24 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.72 1ekz h LEU 73 Cb 1.23 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.97 1ekz h LEU 73 CO -0.13 0.00 -0.53 1.56 -1.08 0.00 0.00 178.44 178.26 1ekz h GLN 74 N 0.00 0.00 0.00 1.13 4.20 -0.16 -3.32 115.11 116.96 1ekz h GLN 74 Ca 0.18 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.74 1ekz h GLN 74 Cb 0.78 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 1ekz h GLN 74 CO -0.00 0.00 -2.01 1.17 -0.67 0.00 0.00 178.83 177.32 1ekz n LYS 75 N -2.25 0.66 0.00 1.46 4.81 0.67 -5.07 118.16 118.44 1ekz n LYS 75 Ca 0.03 -0.06 0.06 0.00 -0.87 0.00 0.00 58.31 57.48 1ekz n LYS 75 Cb 0.45 -1.58 0.05 0.00 0.02 0.00 0.00 35.03 33.98 1ekz n LYS 75 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85