#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dk8 s SER 2 N 0.00 -0.26 -0.30 1.61 0.01 -1.26 -5.17 113.70 108.34 2dk8 s SER 2 Ca 0.00 -0.15 -0.12 0.00 1.31 0.00 0.00 55.95 56.99 2dk8 s SER 2 Cb 0.00 0.39 0.13 0.00 0.21 0.00 0.00 66.02 66.75 2dk8 s SER 2 CO 0.00 -0.67 0.72 -0.94 0.41 0.00 0.00 173.24 172.76 2dk8 s SER 3 N -2.65 -1.01 1.30 2.44 1.04 -1.26 -5.10 113.70 108.45 2dk8 s SER 3 Ca 0.08 1.43 0.00 0.00 0.48 0.00 0.00 55.95 57.94 2dk8 s SER 3 Cb -0.01 2.05 0.00 0.00 0.10 0.00 0.00 66.02 68.16 2dk8 s SER 3 CO -0.04 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2dk8 n GLY 4 N 5.17 2.37 3.68 7.32 0.00 -1.26 -4.82 105.19 117.65 2dk8 n GLY 4 Ca -0.13 -0.36 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 2dk8 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dk8 n SER 5 N 8.18 1.13 0.13 1.61 2.88 -1.26 -4.92 113.62 121.35 2dk8 n SER 5 Ca 0.00 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 2dk8 n SER 5 Cb 0.00 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 61.97 2dk8 n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dk8 n SER 6 N -2.57 -1.15 -3.66 -3.46 3.41 -1.26 -5.05 113.62 99.86 2dk8 n SER 6 Ca 0.14 0.46 -0.30 0.00 -0.26 0.00 0.00 58.87 58.91 2dk8 n SER 6 Cb 0.50 1.23 -0.14 0.00 -0.26 0.00 0.00 64.21 65.53 2dk8 n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dk8 s GLY 7 N -3.96 1.06 -1.09 5.00 0.00 -1.26 -5.04 107.32 102.02 2dk8 s GLY 7 Ca 0.00 -1.76 -0.18 0.00 0.00 0.00 0.00 44.72 42.78 2dk8 s GLY 7 CO 0.00 1.73 2.07 -1.55 0.00 0.00 0.00 173.10 175.36 2dk8 n PRO 8 N 4.59 2.13 -3.43 2.90 -0.04 -1.26 -4.72 135.00 135.17 2dk8 n PRO 8 Ca 0.01 -2.19 -0.20 0.00 -0.04 0.00 0.00 63.50 61.07 2dk8 n PRO 8 Cb 0.40 -3.09 -0.11 0.00 -0.04 0.00 0.00 33.50 30.66 2dk8 n PRO 8 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dk8 s ASP 9 N 4.15 2.13 0.01 3.54 1.11 -1.26 -5.04 116.67 121.32 2dk8 s ASP 9 Ca 0.53 -0.92 0.00 0.00 0.18 0.00 0.00 52.55 52.33 2dk8 s ASP 9 Cb 0.14 0.29 0.00 0.00 1.07 0.00 0.00 42.92 44.42 2dk8 s ASP 9 CO 0.02 -0.40 0.00 0.00 1.18 0.00 0.00 175.17 175.97 2dk8 n ALA 10 N 5.26 -2.70 -1.04 5.23 0.00 -1.26 -4.82 120.51 121.18 2dk8 n ALA 10 Ca -0.03 0.15 -0.36 0.00 0.00 0.00 0.00 53.44 53.20 2dk8 n ALA 10 Cb 0.45 -0.46 0.04 0.00 0.00 0.00 0.00 19.45 19.48 2dk8 n ALA 10 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2dk8 n ASP 11 N 0.56 -5.58 0.09 0.00 2.03 -1.26 -4.81 116.55 107.59 2dk8 n ASP 11 Ca 0.00 0.26 -0.05 0.00 0.52 0.00 0.00 54.79 55.52 2dk8 n ASP 11 Cb 0.00 -0.79 -0.02 0.00 -0.72 0.00 0.00 41.12 39.59 2dk8 n ASP 11 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dk8 h PRO 12 N -0.85 -0.31 -0.66 -0.67 0.13 -1.96 -3.09 132.00 124.59 2dk8 h PRO 12 Ca -0.44 0.02 0.08 0.00 -0.87 0.00 0.00 66.00 64.79 2dk8 h PRO 12 Cb 1.32 0.07 -0.10 0.00 0.13 0.00 0.00 31.00 32.42 2dk8 h PRO 12 CO 0.26 -0.21 -0.53 -0.24 -0.23 0.00 0.00 178.00 177.06 2dk8 h VAL 13 N -1.04 0.02 -0.87 1.56 3.04 -1.99 0.21 116.25 117.19 2dk8 h VAL 13 Ca -0.03 0.00 0.09 0.00 -1.01 0.00 0.00 66.70 65.75 2dk8 h VAL 13 Cb 0.25 0.02 -0.12 0.00 -2.01 0.00 0.00 31.29 29.44 2dk8 h VAL 13 CO 0.05 0.00 -0.55 -0.33 -1.01 0.00 0.00 177.57 175.74 2dk8 h GLU 14 N -0.22 -0.08 -0.49 4.17 5.08 -1.94 0.35 114.58 121.45 2dk8 h GLU 14 Ca 0.14 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.58 2dk8 h GLU 14 Cb 0.54 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.71 2dk8 h GLU 14 CO -0.74 -0.05 -0.46 0.82 -1.00 0.00 0.00 179.01 177.57 2dk8 h ILE 15 N -0.09 0.08 0.04 3.13 2.04 -0.92 0.20 117.51 121.99 2dk8 h ILE 15 Ca 0.17 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.04 2dk8 h ILE 15 Cb 0.48 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 2dk8 h ILE 15 CO -0.87 0.00 -0.23 -0.33 0.00 0.00 0.00 178.15 176.72 2dk8 h GLU 16 N -0.29 -0.30 -0.99 2.37 5.08 0.53 -0.50 114.58 120.47 2dk8 h GLU 16 Ca 0.14 0.02 0.35 0.00 -1.00 0.00 0.00 59.36 58.88 2dk8 h GLU 16 Cb 0.58 0.07 -0.18 0.00 0.50 0.00 0.00 28.75 29.71 2dk8 h GLU 16 CO -0.63 -0.20 0.30 0.09 -1.00 0.00 0.00 179.01 177.57 2dk8 n ASN 17 N -3.74 0.14 -0.06 1.42 3.02 0.93 0.19 115.26 117.15 2dk8 n ASN 17 Ca -0.03 1.67 -0.08 0.00 -0.03 0.00 0.00 54.58 56.11 2dk8 n ASN 17 Cb 0.17 -0.72 -0.01 0.00 -0.61 0.00 0.00 39.78 38.61 2dk8 n ASN 17 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2dk8 h ARG 18 N 0.00 0.13 -0.94 3.52 2.47 0.92 -0.87 114.38 119.61 2dk8 h ARG 18 Ca 0.74 -0.01 0.08 0.00 -1.26 0.00 0.00 59.98 59.53 2dk8 h ARG 18 Cb 1.79 -0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 30.01 2dk8 h ARG 18 CO -0.84 0.08 0.61 0.82 0.56 0.00 0.00 179.97 181.20 2dk8 h ILE 19 N 0.13 1.02 0.28 2.04 2.04 0.32 -1.56 117.51 121.78 2dk8 h ILE 19 Ca 0.12 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 2dk8 h ILE 19 Cb 0.13 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.11 2dk8 h ILE 19 CO -0.17 0.19 -0.24 0.40 0.00 0.00 0.00 178.15 178.32 2dk8 h ILE 20 N 1.02 0.48 -0.92 -0.67 1.08 0.13 1.22 117.51 119.85 2dk8 h ILE 20 Ca 0.42 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 65.08 2dk8 h ILE 20 Cb 0.30 0.48 -0.07 0.00 -3.07 0.00 0.00 36.82 34.46 2dk8 h ILE 20 CO -0.18 0.00 0.60 -0.33 -0.69 0.00 0.00 178.15 177.55 2dk8 h GLU 21 N -0.54 0.51 0.23 2.37 4.39 -0.42 0.41 114.58 121.53 2dk8 h GLU 21 Ca -0.01 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 2dk8 h GLU 21 Cb 0.49 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2dk8 h GLU 21 CO -0.03 0.34 -0.11 -0.07 -1.16 0.00 0.00 179.01 177.98 2dk8 h LEU 22 N 0.52 -0.26 -1.77 1.33 3.38 -0.34 -0.28 115.31 117.89 2dk8 h LEU 22 Ca 0.48 -0.06 0.38 0.00 0.09 0.00 0.00 57.88 58.77 2dk8 h LEU 22 Cb 1.04 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.78 2dk8 h LEU 22 CO -0.22 0.22 0.90 0.00 0.09 0.00 0.00 178.44 179.43 2dk8 h HIS 24 N 0.10 0.94 -0.85 0.00 3.86 -0.18 -3.21 115.15 115.81 2dk8 h HIS 24 Ca 0.67 -0.56 -0.02 0.00 -1.16 0.00 0.00 60.37 59.30 2dk8 h HIS 24 Cb 2.38 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 30.72 2dk8 h HIS 24 CO -0.00 1.40 0.44 1.96 0.86 0.00 0.00 177.93 182.59 2dk8 h GLN 25 N 0.21 1.20 -4.41 2.45 1.08 0.39 -3.36 115.11 112.66 2dk8 h GLN 25 Ca -0.15 -0.15 -0.71 0.00 -1.45 0.00 0.00 58.65 56.18 2dk8 h GLN 25 Cb 1.74 -0.23 -0.31 0.00 -0.05 0.00 0.00 27.48 28.63 2dk8 h GLN 25 CO 0.21 0.89 -0.48 -0.06 -0.95 0.00 0.00 178.83 178.44 2dk8 s PHE 26 N -5.75 3.47 -1.69 2.96 0.40 0.15 -4.91 117.98 112.60 2dk8 s PHE 26 Ca -0.12 -2.02 0.23 0.00 -0.60 0.00 0.00 56.93 54.42 2dk8 s PHE 26 Cb 0.17 -3.24 1.28 0.00 0.51 0.00 0.00 43.02 41.74 2dk8 s PHE 26 CO 0.83 -0.95 1.77 -0.35 0.70 0.00 0.00 175.22 177.21 2dk8 n PRO 27 N 4.78 0.52 -0.02 0.24 -0.04 -1.26 -2.23 135.00 136.99 2dk8 n PRO 27 Ca -0.06 0.04 0.07 0.00 -0.04 0.00 0.00 63.50 63.51 2dk8 n PRO 27 Cb 0.41 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.24 2dk8 n PRO 27 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2dk8 n HIS 28 N -1.16 0.00 0.00 0.54 1.44 -1.26 -4.85 115.22 109.93 2dk8 n HIS 28 Ca 0.14 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.85 2dk8 n HIS 28 Cb 0.14 -0.45 0.00 0.00 0.12 0.00 0.00 29.99 29.80 2dk8 n HIS 28 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2dk8 n GLY 29 N 1.54 2.12 3.16 -1.39 0.00 -0.95 -4.74 105.19 104.93 2dk8 n GLY 29 Ca -0.06 -2.19 -0.18 0.00 0.00 0.00 0.00 46.02 43.59 2dk8 n GLY 29 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2dk8 s ILE 30 N -1.76 1.10 -0.04 -0.61 -4.36 0.49 -4.80 121.20 111.21 2dk8 s ILE 30 Ca 0.00 -1.25 -0.04 0.00 -0.26 0.00 0.00 60.65 59.10 2dk8 s ILE 30 Cb 0.00 -1.05 -0.04 0.00 1.25 0.00 0.00 42.46 42.62 2dk8 s ILE 30 CO 0.00 -0.19 0.15 0.42 0.24 0.00 0.00 174.94 175.56 2dk8 s THR 31 N -1.21 5.31 0.56 8.37 -4.23 -1.26 -0.57 115.64 122.61 2dk8 s THR 31 Ca -0.02 -0.09 0.50 0.00 -1.18 0.00 0.00 61.69 60.90 2dk8 s THR 31 Cb -0.10 -3.42 0.74 0.00 1.34 0.00 0.00 72.50 71.06 2dk8 s THR 31 CO 0.02 0.43 1.59 -0.78 -0.54 0.00 0.00 174.62 175.33 2dk8 h ASP 32 N 4.25 0.00 0.13 3.99 3.58 -1.95 1.42 116.42 127.84 2dk8 h ASP 32 Ca -0.51 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 56.94 2dk8 h ASP 32 Cb 1.20 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.25 2dk8 h ASP 32 CO 0.64 -0.00 -0.06 1.56 -2.88 0.00 0.00 179.24 178.50 2dk8 h GLN 33 N 0.00 -0.17 0.01 0.28 4.20 -1.94 -2.18 115.11 115.31 2dk8 h GLN 33 Ca 0.92 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.65 2dk8 h GLN 33 Cb 3.71 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 31.51 2dk8 h GLN 33 CO -0.01 0.07 -0.14 0.28 -0.67 0.00 0.00 178.83 178.36 2dk8 h VAL 34 N -0.40 0.00 -1.16 -0.54 2.07 0.16 0.36 116.25 116.73 2dk8 h VAL 34 Ca -0.02 0.00 0.34 0.00 0.82 0.00 0.00 66.70 67.84 2dk8 h VAL 34 Cb 0.32 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.05 2dk8 h VAL 34 CO 0.03 0.00 1.04 0.40 0.02 0.00 0.00 177.57 179.06 2dk8 h ILE 35 N -0.18 0.16 0.16 4.57 2.04 -1.56 0.91 117.51 123.60 2dk8 h ILE 35 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 2dk8 h ILE 35 Cb 0.19 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 2dk8 h ILE 35 CO -0.09 0.00 -0.08 -0.61 0.00 0.00 0.00 178.15 177.37 2dk8 h GLN 36 N 0.00 -0.21 0.00 2.37 4.15 0.31 1.45 115.11 123.18 2dk8 h GLN 36 Ca 0.55 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.96 2dk8 h GLN 36 Cb 2.63 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 30.37 2dk8 h GLN 36 CO -0.01 0.15 -0.11 -0.97 -1.93 0.00 0.00 178.83 175.96 2dk8 h ASN 37 N -0.60 0.00 0.18 -0.69 -0.73 0.21 0.61 115.58 114.57 2dk8 h ASN 37 Ca -0.02 0.00 -0.31 0.00 1.87 0.00 0.00 56.30 57.83 2dk8 h ASN 37 Cb 0.45 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.06 2dk8 h ASN 37 CO 0.04 0.11 -1.51 -0.33 -0.37 0.00 0.00 177.43 175.36 2dk8 h GLU 38 N 0.00 0.39 -1.59 6.67 4.39 -0.06 -3.42 114.58 120.97 2dk8 h GLU 38 Ca -0.00 -0.67 -0.49 0.00 0.34 0.00 0.00 59.36 58.55 2dk8 h GLU 38 Cb 0.61 0.25 -0.34 0.00 -0.10 0.00 0.00 28.75 29.17 2dk8 h GLU 38 CO 0.01 1.32 -0.97 -1.33 -1.16 0.00 0.00 179.01 176.88 2dk8 n MET 39 N -3.76 0.71 0.00 2.33 2.81 0.49 -4.93 117.12 114.78 2dk8 n MET 39 Ca -0.22 -2.90 0.12 0.00 -1.81 0.00 0.00 57.70 52.89 2dk8 n MET 39 Cb 1.02 -1.28 0.69 0.00 -0.71 0.00 0.00 33.22 32.94 2dk8 n MET 39 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2dk8 n PRO 40 N 1.51 0.68 0.07 0.03 -0.04 0.21 -2.24 135.00 135.22 2dk8 n PRO 40 Ca 0.19 0.01 0.05 0.00 -0.04 0.00 0.00 63.50 63.71 2dk8 n PRO 40 Cb 0.55 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.47 2dk8 n PRO 40 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 2dk8 h HIS 41 N 0.00 0.00 -4.11 0.54 2.07 -1.92 -3.47 115.15 108.26 2dk8 h HIS 41 Ca 0.00 0.00 -0.54 0.00 -2.85 0.00 0.00 60.37 56.98 2dk8 h HIS 41 Cb 0.04 0.00 0.14 0.00 2.57 0.00 0.00 27.41 30.16 2dk8 h HIS 41 CO 0.00 0.34 0.49 0.42 -3.07 0.00 0.00 177.93 176.11 2dk8 s ILE 42 N -3.10 2.27 0.58 6.12 -1.09 -0.95 -5.00 121.20 120.04 2dk8 s ILE 42 Ca -0.01 0.16 -0.08 0.00 -2.23 0.00 0.00 60.65 58.49 2dk8 s ILE 42 Cb 0.09 -3.02 -0.03 0.00 -1.58 0.00 0.00 42.46 37.92 2dk8 s ILE 42 CO 0.80 -0.04 0.94 -1.61 -1.23 0.00 0.00 174.94 173.79 2dk8 s GLU 43 N -3.43 3.40 0.31 2.79 0.41 -1.26 -4.87 118.70 116.04 2dk8 s GLU 43 Ca 0.80 0.43 0.01 0.00 -0.41 0.00 0.00 54.97 55.80 2dk8 s GLU 43 Cb -0.34 -2.20 0.50 0.00 -1.78 0.00 0.00 34.13 30.31 2dk8 s GLU 43 CO 0.38 -0.52 1.87 0.00 -0.49 0.00 0.00 175.26 176.50 2dk8 h ALA 44 N -0.16 1.32 0.22 5.21 0.00 -1.99 0.23 119.26 124.09 2dk8 h ALA 44 Ca -0.45 -0.17 -0.30 0.00 0.00 0.00 0.00 54.91 53.99 2dk8 h ALA 44 Cb 1.21 -0.21 0.03 0.00 0.00 0.00 0.00 17.79 18.82 2dk8 h ALA 44 CO 0.62 0.49 -1.33 1.96 0.00 0.00 0.00 179.25 180.99 2dk8 h GLN 45 N 0.74 0.46 -0.89 0.00 4.20 -1.98 -2.72 115.11 114.91 2dk8 h GLN 45 Ca 0.17 -0.79 -0.00 0.00 0.06 0.00 0.00 58.65 58.09 2dk8 h GLN 45 Cb 0.23 0.29 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 2dk8 h GLN 45 CO -0.01 1.38 0.56 1.96 -0.67 0.00 0.00 178.83 182.04 2dk8 h GLN 46 N -0.01 1.20 0.08 1.46 1.08 -1.87 0.81 115.11 117.86 2dk8 h GLN 46 Ca -0.24 -0.10 -0.00 0.00 -1.45 0.00 0.00 58.65 56.86 2dk8 h GLN 46 Cb 2.02 -0.26 0.00 0.00 -0.05 0.00 0.00 27.48 29.19 2dk8 h GLN 46 CO 0.23 0.83 -0.04 0.00 -0.95 0.00 0.00 178.83 178.90 2dk8 h ARG 47 N 1.22 -0.10 -0.14 1.46 3.08 -0.64 -2.18 114.38 117.09 2dk8 h ARG 47 Ca 0.32 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.38 2dk8 h ARG 47 Cb -0.08 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 2dk8 h ARG 47 CO -0.06 0.22 0.08 0.00 -1.07 0.00 0.00 179.97 179.14 2dk8 h ALA 48 N 0.47 0.18 -0.16 0.04 0.00 -1.23 -1.51 119.26 117.05 2dk8 h ALA 48 Ca -0.01 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2dk8 h ALA 48 Cb 0.37 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2dk8 h ALA 48 CO 0.02 -0.30 -0.22 0.28 0.00 0.00 0.00 179.25 179.03 2dk8 h VAL 49 N 0.15 0.00 -0.69 0.00 2.07 0.67 1.22 116.25 119.67 2dk8 h VAL 49 Ca 0.05 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.71 2dk8 h VAL 49 Cb 0.05 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.68 2dk8 h VAL 49 CO -0.01 0.00 -0.18 0.00 0.02 0.00 0.00 177.57 177.40 2dk8 h ALA 50 N -0.80 0.44 0.27 1.67 0.00 -1.32 0.78 119.26 120.29 2dk8 h ALA 50 Ca 0.03 0.27 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2dk8 h ALA 50 Cb 0.23 0.54 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2dk8 h ALA 50 CO -0.23 -0.43 -0.37 0.82 0.00 0.00 0.00 179.25 179.03 2dk8 h ILE 51 N -0.01 0.00 -0.56 0.00 2.04 0.07 0.43 117.51 119.48 2dk8 h ILE 51 Ca 0.33 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.30 2dk8 h ILE 51 Cb 0.51 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.48 2dk8 h ILE 51 CO -0.72 0.00 -0.20 -1.13 0.00 0.00 0.00 178.15 176.10 2dk8 h ASN 52 N -0.67 -0.73 -0.02 1.72 -0.73 0.28 1.42 115.58 116.86 2dk8 h ASN 52 Ca -0.03 0.19 0.03 0.00 1.87 0.00 0.00 56.30 58.36 2dk8 h ASN 52 Cb 0.61 0.42 -0.06 0.00 0.27 0.00 0.00 38.32 39.56 2dk8 h ASN 52 CO -0.10 -0.24 -0.42 0.03 -0.37 0.00 0.00 177.43 176.33 2dk8 h ARG 53 N -0.07 -0.54 -0.33 6.67 -0.00 0.10 0.11 114.38 120.32 2dk8 h ARG 53 Ca 0.26 0.04 0.02 0.00 -0.50 0.00 0.00 59.98 59.79 2dk8 h ARG 53 Cb 0.47 0.12 -0.02 0.00 0.00 0.00 0.00 29.97 30.54 2dk8 h ARG 53 CO -0.61 -0.36 0.19 -0.07 0.00 0.00 0.00 179.97 179.11 2dk8 h LEU 54 N -0.56 0.30 -0.95 3.04 3.38 0.13 1.15 115.31 121.79 2dk8 h LEU 54 Ca 0.05 0.01 0.25 0.00 0.09 0.00 0.00 57.88 58.27 2dk8 h LEU 54 Cb 0.65 -0.06 -0.13 0.00 0.09 0.00 0.00 40.66 41.21 2dk8 h LEU 54 CO -0.33 0.22 0.49 -0.07 0.09 0.00 0.00 178.44 178.84 2dk8 h LEU 55 N 0.39 0.47 0.00 1.67 3.38 0.28 0.40 115.31 121.89 2dk8 h LEU 55 Ca 0.13 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 2dk8 h LEU 55 Cb 0.01 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2dk8 h LEU 55 CO -0.07 0.01 -0.09 -1.28 0.09 0.00 0.00 178.44 177.09 2dk8 h SER 56 N 0.44 0.00 -1.41 -0.43 0.87 0.31 -3.31 113.55 110.02 2dk8 h SER 56 Ca 0.62 -0.02 0.41 0.00 -1.23 0.00 0.00 61.79 61.57 2dk8 h SER 56 Cb 1.23 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.13 2dk8 h SER 56 CO -0.53 0.56 1.25 0.24 -0.53 0.00 0.00 176.83 177.81 2dk8 h MET 57 N -1.00 0.00 0.00 2.24 2.86 0.18 -3.43 114.93 115.78 2dk8 h MET 57 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2dk8 h MET 57 Cb 0.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.77 2dk8 h MET 57 CO -0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 2dk8 n GLY 58 N -1.80 0.77 0.06 8.32 0.00 0.13 -4.95 105.19 107.72 2dk8 n GLY 58 Ca 0.32 -0.57 0.02 0.00 0.00 0.00 0.00 46.02 45.79 2dk8 n GLY 58 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dk8 n GLN 59 N -2.17 0.66 -4.38 1.61 1.13 -0.59 -4.66 117.38 108.99 2dk8 n GLN 59 Ca 0.00 -0.03 -0.29 0.00 -1.94 0.00 0.00 57.00 54.74 2dk8 n GLN 59 Cb 0.07 -1.60 -0.13 0.00 0.11 0.00 0.00 30.24 28.69 2dk8 n GLN 59 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2dk8 s LEU 60 N -5.14 2.37 -0.11 1.08 2.96 -1.11 -2.83 118.68 115.90 2dk8 s LEU 60 Ca -0.07 -0.74 0.01 0.00 -0.22 0.00 0.00 54.13 53.11 2dk8 s LEU 60 Cb 0.10 -1.26 0.02 0.00 0.50 0.00 0.00 46.19 45.55 2dk8 s LEU 60 CO 0.86 0.18 -0.13 -1.81 -1.32 0.00 0.00 176.35 174.12 2dk8 s ASP 61 N -2.12 2.36 0.18 3.68 1.01 0.46 -4.21 116.67 118.03 2dk8 s ASP 61 Ca 0.15 -0.40 -0.19 0.00 0.71 0.00 0.00 52.55 52.82 2dk8 s ASP 61 Cb -0.10 -1.02 -0.08 0.00 1.01 0.00 0.00 42.92 42.73 2dk8 s ASP 61 CO 0.07 -0.03 0.67 -0.22 0.21 0.00 0.00 175.17 175.87 2dk8 s LEU 62 N 1.25 4.38 -0.23 1.23 0.20 -1.26 -0.62 118.68 123.63 2dk8 s LEU 62 Ca -0.02 1.35 -0.04 0.00 0.69 0.00 0.00 54.13 56.11 2dk8 s LEU 62 Cb -0.14 -3.42 0.09 0.00 -0.43 0.00 0.00 46.19 42.30 2dk8 s LEU 62 CO -0.05 0.09 0.18 -0.76 -0.29 0.00 0.00 176.35 175.52 2dk8 s LEU 63 N -1.80 0.15 -0.38 -0.68 1.43 0.37 -4.95 118.68 112.82 2dk8 s LEU 63 Ca 0.40 -0.68 -0.29 0.00 -1.03 0.00 0.00 54.13 52.53 2dk8 s LEU 63 Cb -0.17 0.06 0.01 0.00 0.03 0.00 0.00 46.19 46.12 2dk8 s LEU 63 CO 0.21 -0.37 1.22 -0.60 0.23 0.00 0.00 176.35 177.04 2dk8 s ARG 64 N 2.23 3.83 0.00 1.70 3.52 -1.26 0.50 118.95 129.47 2dk8 s ARG 64 Ca 0.07 0.96 0.00 0.00 -0.13 0.00 0.00 55.73 56.62 2dk8 s ARG 64 Cb -0.16 -3.88 0.00 0.00 -1.56 0.00 0.00 34.95 29.35 2dk8 s ARG 64 CO -0.21 -1.23 0.00 0.45 -0.81 0.00 0.00 175.30 173.51 2dk8 n SER 65 N 7.73 0.00 0.00 -2.12 2.88 -1.26 -4.97 113.62 115.88 2dk8 n SER 65 Ca 0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 2dk8 n SER 65 Cb 0.48 -0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.83 2dk8 n SER 65 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2dk8 n ASN 66 N -2.44 0.00 -4.41 -3.46 2.85 -1.26 -4.99 115.26 101.56 2dk8 n ASN 66 Ca 0.00 0.00 -0.39 0.00 -0.11 0.00 0.00 54.58 54.08 2dk8 n ASN 66 Cb 0.00 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 40.94 2dk8 n ASN 66 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2dk8 n THR 67 N -0.06 -0.21 0.00 -0.44 5.66 -1.26 -4.51 114.28 113.46 2dk8 n THR 67 Ca 0.00 -0.11 0.00 0.00 -3.05 0.00 0.00 64.05 60.89 2dk8 n THR 67 Cb 0.00 -0.59 0.00 0.00 -1.55 0.00 0.00 70.33 68.19 2dk8 n THR 67 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dk8 n GLY 68 N -1.37 3.02 3.80 1.09 0.00 -1.26 -5.01 105.19 105.46 2dk8 n GLY 68 Ca 0.02 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 44.03 2dk8 n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dk8 s LEU 69 N 0.00 2.53 0.08 0.99 1.43 -1.26 -4.25 118.68 118.20 2dk8 s LEU 69 Ca 0.00 1.28 0.09 0.00 -1.03 0.00 0.00 54.13 54.47 2dk8 s LEU 69 Cb 0.00 -3.86 -0.03 0.00 0.03 0.00 0.00 46.19 42.33 2dk8 s LEU 69 CO 0.00 -2.05 -0.23 -0.22 0.23 0.00 0.00 176.35 174.08 2dk8 s LEU 70 N -5.82 2.40 -0.12 1.79 0.20 0.18 -4.22 118.68 113.09 2dk8 s LEU 70 Ca 0.61 -0.59 -0.01 0.00 0.69 0.00 0.00 54.13 54.84 2dk8 s LEU 70 Cb -0.15 -1.37 0.03 0.00 -0.43 0.00 0.00 46.19 44.28 2dk8 s LEU 70 CO 0.54 0.23 -0.06 -0.31 -0.29 0.00 0.00 176.35 176.46 2dk8 s TYR 71 N -0.95 1.41 0.47 5.38 2.02 0.26 0.14 117.35 126.08 2dk8 s TYR 71 Ca 0.14 -0.74 0.02 0.00 -0.37 0.00 0.00 57.07 56.12 2dk8 s TYR 71 Cb -0.10 -1.19 -0.01 0.00 -0.40 0.00 0.00 41.96 40.26 2dk8 s TYR 71 CO 0.05 -0.52 0.07 -0.98 -1.57 0.00 0.00 175.55 172.61 2dk8 s ARG 72 N 1.73 2.09 -0.02 -0.62 1.70 0.21 0.19 118.95 124.23 2dk8 s ARG 72 Ca 0.04 -2.32 -0.30 0.00 -0.47 0.00 0.00 55.73 52.68 2dk8 s ARG 72 Cb -0.13 -1.03 -0.05 0.00 -0.57 0.00 0.00 34.95 33.18 2dk8 s ARG 72 CO -0.08 -0.46 1.34 0.42 -1.08 0.00 0.00 175.30 175.44 2dk8 s ILE 73 N -3.04 3.89 0.53 4.99 -1.09 -1.21 -0.40 121.20 124.87 2dk8 s ILE 73 Ca 0.13 1.25 -0.21 0.00 -2.23 0.00 0.00 60.65 59.59 2dk8 s ILE 73 Cb 0.01 -3.80 -0.05 0.00 -1.58 0.00 0.00 42.46 37.04 2dk8 s ILE 73 CO 0.08 -0.00 1.28 -0.75 -1.23 0.00 0.00 174.94 174.32 2dk8 s LYS 74 N 2.36 3.25 -0.09 2.79 2.20 -1.13 -4.39 119.74 124.73 2dk8 s LYS 74 Ca 0.61 2.03 -0.07 0.00 -0.36 0.00 0.00 55.97 58.19 2dk8 s LYS 74 Cb -0.29 -2.23 0.03 0.00 -1.51 0.00 0.00 37.83 33.83 2dk8 s LYS 74 CO 0.25 -1.04 0.14 -3.47 -0.36 0.00 0.00 175.35 170.87 2dk8 n ASP 75 N -1.01 -3.83 -3.15 1.43 2.03 -1.26 -4.96 116.55 105.80 2dk8 n ASP 75 Ca 0.10 1.45 0.05 0.00 0.52 0.00 0.00 54.79 56.92 2dk8 n ASP 75 Cb 0.47 -4.65 -0.00 0.00 -0.72 0.00 0.00 41.12 36.21 2dk8 n ASP 75 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2dk8 s SER 76 N -0.54 -0.88 0.43 1.67 0.01 -1.26 -5.17 113.70 107.96 2dk8 s SER 76 Ca -0.16 0.17 -0.11 0.00 1.31 0.00 0.00 55.95 57.16 2dk8 s SER 76 Cb 0.01 1.59 -0.06 0.00 0.21 0.00 0.00 66.02 67.76 2dk8 s SER 76 CO 0.43 -0.16 0.80 -0.83 0.41 0.00 0.00 173.24 173.88 2dk8 s GLY 77 N 2.91 1.92 0.91 3.44 0.00 -1.26 -5.07 107.32 110.16 2dk8 s GLY 77 Ca 0.18 -0.18 -0.12 0.00 0.00 0.00 0.00 44.72 44.60 2dk8 s GLY 77 CO -0.23 0.02 1.14 2.56 0.00 0.00 0.00 173.10 176.59 2dk8 s PRO 78 N -3.95 1.18 -0.19 2.90 0.04 -1.26 -5.07 135.00 128.65 2dk8 s PRO 78 Ca 0.52 0.30 -0.05 0.00 0.04 0.00 0.00 61.00 61.81 2dk8 s PRO 78 Cb -0.10 -1.84 0.07 0.00 0.04 0.00 0.00 34.50 32.66 2dk8 s PRO 78 CO 0.33 -2.17 0.09 -1.12 0.04 0.00 0.00 177.00 174.17 2dk8 s SER 79 N -4.03 2.51 -0.19 6.66 0.01 -1.26 -5.12 113.70 112.28 2dk8 s SER 79 Ca 0.64 -0.71 -0.35 0.00 1.31 0.00 0.00 55.95 56.84 2dk8 s SER 79 Cb -0.15 -0.26 0.14 0.00 0.21 0.00 0.00 66.02 65.96 2dk8 s SER 79 CO 0.53 -0.36 1.23 -0.94 0.41 0.00 0.00 173.24 174.11 2dk8 s SER 80 N 2.13 -0.12 0.00 2.44 1.04 -1.26 -5.37 113.70 112.56 2dk8 s SER 80 Ca 0.03 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.45 2dk8 s SER 80 Cb -0.16 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.09 2dk8 s SER 80 CO -0.13 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.49