#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 4.69 -0.34 1.61 0.15 -1.26 -5.05 113.70 113.50 2dk8 s SER 2 Ca 0.00 -3.19 -0.27 0.00 0.70 0.00 0.00 55.95 53.18 2dk8 s SER 2 Cb 0.00 -1.70 -0.06 0.00 -1.71 0.00 0.00 66.02 62.55 2dk8 s SER 2 CO 0.00 -0.23 2.31 -1.20 1.20 0.00 0.00 173.24 175.32 2dk8 n SER 3 N 2.91 2.82 0.00 5.45 7.64 -1.26 -4.60 113.62 126.58 2dk8 n SER 3 Ca 0.09 -0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.89 2dk8 n SER 3 Cb 0.34 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 61.98 2dk8 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dk8 n GLY 4 N 5.90 -0.03 3.10 0.23 0.00 -1.26 -5.13 105.19 108.01 2dk8 n GLY 4 Ca 0.34 0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.48 2dk8 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dk8 s SER 5 N 1.14 -0.40 -0.06 1.61 0.15 -1.26 -5.07 113.70 109.81 2dk8 s SER 5 Ca 0.00 0.01 -0.09 0.00 0.70 0.00 0.00 55.95 56.57 2dk8 s SER 5 Cb 0.00 1.14 -0.04 0.00 -1.71 0.00 0.00 66.02 65.42 2dk8 s SER 5 CO 0.00 -0.07 -0.18 -0.24 1.20 0.00 0.00 173.24 173.95 2dk8 n SER 6 N 4.90 1.44 -4.53 5.45 2.88 -1.26 -5.08 113.62 117.42 2dk8 n SER 6 Ca 0.09 0.23 -0.25 0.00 -1.33 0.00 0.00 58.87 57.61 2dk8 n SER 6 Cb 0.59 -0.52 -0.11 0.00 -0.75 0.00 0.00 64.21 63.42 2dk8 n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dk8 s GLY 7 N -4.63 2.21 -1.20 0.46 0.00 -1.26 -5.05 107.32 97.85 2dk8 s GLY 7 Ca -0.16 -2.13 -0.21 0.00 0.00 0.00 0.00 44.72 42.22 2dk8 s GLY 7 CO 0.23 -1.97 1.81 2.56 0.00 0.00 0.00 173.10 175.73 2dk8 s PRO 8 N -3.74 3.22 -0.23 2.90 0.04 -1.26 -4.83 135.00 131.11 2dk8 s PRO 8 Ca 0.34 -1.45 -0.03 0.00 0.04 0.00 0.00 61.00 59.89 2dk8 s PRO 8 Cb 0.07 -5.36 0.10 0.00 0.04 0.00 0.00 34.50 29.34 2dk8 s PRO 8 CO 0.16 -3.07 0.20 0.16 0.04 0.00 0.00 177.00 174.49 2dk8 s ASP 9 N 5.53 1.90 -0.27 6.66 -4.77 -1.26 -5.10 116.67 119.36 2dk8 s ASP 9 Ca 0.61 -0.54 -0.38 0.00 -3.30 0.00 0.00 52.55 48.94 2dk8 s ASP 9 Cb 0.01 0.20 -0.14 0.00 -1.09 0.00 0.00 42.92 41.91 2dk8 s ASP 9 CO 0.08 -0.36 1.92 0.00 0.70 0.00 0.00 175.17 177.52 2dk8 n ALA 10 N 5.30 0.43 -1.25 2.11 0.00 -1.26 -4.82 120.51 121.02 2dk8 n ALA 10 Ca -0.05 0.22 -0.39 0.00 0.00 0.00 0.00 53.44 53.22 2dk8 n ALA 10 Cb 0.48 -2.38 0.01 0.00 0.00 0.00 0.00 19.45 17.56 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 7.10 -3.58 0.09 0.00 2.03 -1.26 -4.83 116.55 116.09 2dk8 n ASP 11 Ca 0.31 0.65 -0.05 0.00 0.52 0.00 0.00 54.79 56.22 2dk8 n ASP 11 Cb 0.19 -0.87 -0.02 0.00 -0.72 0.00 0.00 41.12 39.70 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 -0.02 -0.29 -0.92 -0.67 0.13 -1.98 -2.98 132.00 125.28 2dk8 h PRO 12 Ca -0.41 0.02 0.15 0.00 -0.87 0.00 0.00 66.00 64.89 2dk8 h PRO 12 Cb 1.44 0.07 -0.16 0.00 0.13 0.00 0.00 31.00 32.48 2dk8 h PRO 12 CO 0.42 -0.19 -0.35 -0.24 -0.23 0.00 0.00 178.00 177.41 2dk8 h VAL 13 N -0.94 0.04 -0.22 1.56 3.04 -1.99 0.32 116.25 118.07 2dk8 h VAL 13 Ca -0.03 0.00 0.05 0.00 -1.01 0.00 0.00 66.70 65.71 2dk8 h VAL 13 Cb 0.23 0.04 -0.07 0.00 -2.01 0.00 0.00 31.29 29.48 2dk8 h VAL 13 CO 0.05 0.00 -0.43 -0.33 -1.01 0.00 0.00 177.57 175.85 2dk8 h GLU 14 N -0.03 -0.43 -0.59 4.17 3.07 -1.94 0.65 114.58 119.49 2dk8 h GLU 14 Ca 0.35 0.03 0.12 0.00 -0.50 0.00 0.00 59.36 59.36 2dk8 h GLU 14 Cb 0.61 0.10 -0.10 0.00 -0.84 0.00 0.00 28.75 28.51 2dk8 h GLU 14 CO -0.93 -0.29 -0.05 0.82 -1.40 0.00 0.00 179.01 177.16 2dk8 h ILE 15 N -0.44 0.48 0.66 3.13 2.04 -0.33 -0.67 117.51 122.38 2dk8 h ILE 15 Ca 0.09 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.90 2dk8 h ILE 15 Cb 0.62 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 2dk8 h ILE 15 CO -0.46 0.01 -0.41 -0.33 0.00 0.00 0.00 178.15 176.96 2dk8 h GLU 16 N 0.07 -0.98 -1.00 2.37 5.08 0.90 -1.96 114.58 119.07 2dk8 h GLU 16 Ca 0.30 0.07 0.37 0.00 -1.00 0.00 0.00 59.36 59.10 2dk8 h GLU 16 Cb 0.47 0.22 -0.17 0.00 0.50 0.00 0.00 28.75 29.77 2dk8 h GLU 16 CO -0.54 -0.65 0.51 -0.91 -1.00 0.00 0.00 179.01 176.42 2dk8 h ASN 17 N -1.01 0.32 0.31 1.42 2.35 0.12 0.69 115.58 119.78 2dk8 h ASN 17 Ca -0.08 0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2dk8 h ASN 17 Cb 0.82 0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 2dk8 h ASN 17 CO 0.08 -0.33 -0.25 0.03 -1.65 0.00 0.00 177.43 175.31 2dk8 h ARG 18 N 0.11 -0.55 -0.91 0.81 2.47 -0.40 -0.70 114.38 115.22 2dk8 h ARG 18 Ca 0.79 0.04 0.18 0.00 -1.26 0.00 0.00 59.98 59.72 2dk8 h ARG 18 Cb 1.96 0.12 -0.07 0.00 -1.65 0.00 0.00 29.97 30.33 2dk8 h ARG 18 CO -0.72 -0.37 0.59 0.82 0.56 0.00 0.00 179.97 180.85 2dk8 h ILE 19 N -0.57 0.74 -0.13 2.04 2.04 0.71 0.13 117.51 122.47 2dk8 h ILE 19 Ca -0.02 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 2dk8 h ILE 19 Cb 0.50 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2dk8 h ILE 19 CO -0.02 0.10 0.07 0.40 0.00 0.00 0.00 178.15 178.71 2dk8 h ILE 20 N 0.58 1.09 -0.51 -0.67 1.08 -0.15 0.54 117.51 119.46 2dk8 h ILE 20 Ca 0.48 -0.25 0.05 0.00 -0.39 0.00 0.00 64.86 64.75 2dk8 h ILE 20 Cb 0.95 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 35.68 2dk8 h ILE 20 CO -0.22 0.08 0.34 -0.33 -0.69 0.00 0.00 178.15 177.34 2dk8 h GLU 21 N 0.12 0.47 0.02 2.37 4.39 0.64 -0.44 114.58 122.15 2dk8 h GLU 21 Ca 0.05 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 2dk8 h GLU 21 Cb 0.07 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2dk8 h GLU 21 CO -0.01 0.31 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.07 2dk8 h LEU 22 N 0.49 -0.03 -1.83 1.33 3.38 -0.43 -1.41 115.31 116.81 2dk8 h LEU 22 Ca 0.22 -0.66 0.27 0.00 0.09 0.00 0.00 57.88 57.80 2dk8 h LEU 22 Cb 0.25 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2dk8 h LEU 22 CO -0.06 0.67 0.68 0.00 0.09 0.00 0.00 178.44 179.83 2dk8 h HIS 24 N 0.12 0.44 -0.65 0.00 3.86 -1.01 -3.24 115.15 114.67 2dk8 h HIS 24 Ca 0.48 -0.23 -0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2dk8 h HIS 24 Cb 1.70 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 30.09 2dk8 h HIS 24 CO -0.00 1.04 0.39 1.96 0.86 0.00 0.00 177.93 182.18 2dk8 h GLN 25 N -0.29 0.88 -4.72 2.45 1.08 0.92 -3.37 115.11 112.07 2dk8 h GLN 25 Ca -0.05 -0.08 -0.67 0.00 -1.45 0.00 0.00 58.65 56.40 2dk8 h GLN 25 Cb 1.15 -0.19 -0.37 0.00 -0.05 0.00 0.00 27.48 28.03 2dk8 h GLN 25 CO 0.08 0.62 -0.71 -0.06 -0.95 0.00 0.00 178.83 177.82 2dk8 s PHE 26 N -5.67 3.49 -0.00 2.96 0.40 0.20 -4.95 117.98 114.42 2dk8 s PHE 26 Ca -0.10 -2.47 0.20 0.00 -0.60 0.00 0.00 56.93 53.96 2dk8 s PHE 26 Cb 0.17 -2.54 0.57 0.00 0.51 0.00 0.00 43.02 41.73 2dk8 s PHE 26 CO 0.78 -0.90 1.67 -1.00 0.70 0.00 0.00 175.22 176.47 2dk8 h PRO 27 N 7.82 0.00 -0.13 0.24 0.13 -1.73 -3.11 132.00 135.22 2dk8 h PRO 27 Ca -0.13 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.77 2dk8 h PRO 27 Cb 1.04 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.18 2dk8 h PRO 27 CO 0.54 0.32 -0.81 0.45 -0.23 0.00 0.00 178.00 178.27 2dk8 h HIS 28 N 0.00 1.03 0.00 1.56 3.86 -1.92 -3.42 115.15 116.25 2dk8 h HIS 28 Ca -0.00 -0.47 0.00 0.00 -1.16 0.00 0.00 60.37 58.74 2dk8 h HIS 28 Cb 1.00 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.31 2dk8 h HIS 28 CO 0.00 1.30 0.00 0.41 0.86 0.00 0.00 177.93 180.50 2dk8 n GLY 29 N 0.74 2.56 2.99 2.45 0.00 -1.18 -4.71 105.19 108.04 2dk8 n GLY 29 Ca -0.08 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.74 0.48 0.19 -0.61 -4.36 0.54 -4.80 121.20 110.89 2dk8 s ILE 30 Ca 0.00 -0.48 0.03 0.00 -0.26 0.00 0.00 60.65 59.94 2dk8 s ILE 30 Cb 0.00 -0.45 -0.03 0.00 1.25 0.00 0.00 42.46 43.23 2dk8 s ILE 30 CO 0.00 -0.01 0.33 0.42 0.24 0.00 0.00 174.94 175.92 2dk8 s THR 31 N -0.48 5.28 0.31 8.37 -4.23 -1.26 -0.28 115.64 123.35 2dk8 s THR 31 Ca -0.01 -0.72 0.08 0.00 -1.18 0.00 0.00 61.69 59.85 2dk8 s THR 31 Cb -0.04 -3.78 0.31 0.00 1.34 0.00 0.00 72.50 70.33 2dk8 s THR 31 CO -0.00 -0.19 1.68 -0.78 -0.54 0.00 0.00 174.62 174.79 2dk8 h ASP 32 N 1.79 0.37 -0.45 3.99 3.58 -2.00 0.38 116.42 124.09 2dk8 h ASP 32 Ca -0.49 0.17 0.09 0.00 0.42 0.00 0.00 57.03 57.22 2dk8 h ASP 32 Cb 1.20 0.15 -0.09 0.00 1.72 0.00 0.00 39.33 42.32 2dk8 h ASP 32 CO 0.66 -0.06 -0.12 -0.61 -2.88 0.00 0.00 179.24 176.23 2dk8 h GLN 33 N 0.36 -0.00 0.00 0.28 4.15 -1.95 0.11 115.11 118.05 2dk8 h GLN 33 Ca 0.63 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.05 2dk8 h GLN 33 Cb 1.30 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.99 2dk8 h GLN 33 CO -0.58 -0.00 0.00 0.28 -1.93 0.00 0.00 178.83 176.60 2dk8 n VAL 34 N -5.33 0.00 -0.62 2.39 0.31 0.13 -0.83 118.33 114.38 2dk8 n VAL 34 Ca 0.03 1.39 0.49 0.00 -0.01 0.00 0.00 64.34 66.24 2dk8 n VAL 34 Cb 0.24 -2.19 0.81 0.00 -0.91 0.00 0.00 33.84 31.79 2dk8 n VAL 34 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2dk8 h ILE 35 N 0.00 0.10 -0.08 2.52 2.04 -1.29 1.56 117.51 122.36 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 0.00 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.17 2dk8 h ILE 35 CO 0.00 0.00 0.02 -0.61 0.00 0.00 0.00 178.15 177.56 2dk8 h GLN 36 N 0.00 0.12 0.00 2.37 4.15 0.13 1.51 115.11 123.39 2dk8 h GLN 36 Ca 0.86 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 60.22 2dk8 h GLN 36 Cb 3.41 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 31.08 2dk8 h GLN 36 CO -0.02 0.31 -0.14 -0.97 -1.93 0.00 0.00 178.83 176.07 2dk8 h ASN 37 N -0.09 0.00 0.19 -0.69 -0.73 0.39 0.28 115.58 114.93 2dk8 h ASN 37 Ca 0.02 0.00 -0.30 0.00 1.87 0.00 0.00 56.30 57.89 2dk8 h ASN 37 Cb 0.24 0.00 0.02 0.00 0.27 0.00 0.00 38.32 38.86 2dk8 h ASN 37 CO 0.00 0.14 -1.39 -0.33 -0.37 0.00 0.00 177.43 175.48 2dk8 h GLU 38 N 0.00 0.41 -1.81 6.67 4.39 -0.08 -3.41 114.58 120.75 2dk8 h GLU 38 Ca -0.00 -0.70 -0.52 0.00 0.34 0.00 0.00 59.36 58.47 2dk8 h GLU 38 Cb 0.77 0.26 -0.36 0.00 -0.10 0.00 0.00 28.75 29.33 2dk8 h GLU 38 CO 0.02 1.34 -1.02 -1.33 -1.16 0.00 0.00 179.01 176.86 2dk8 n MET 39 N -3.81 0.65 0.00 2.33 2.81 0.51 -4.93 117.12 114.68 2dk8 n MET 39 Ca -0.19 -3.03 0.12 0.00 -1.81 0.00 0.00 57.70 52.78 2dk8 n MET 39 Cb 1.01 -1.30 0.68 0.00 -0.71 0.00 0.00 33.22 32.90 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 1.64 0.65 0.05 0.03 -0.04 0.96 -2.31 135.00 135.99 2dk8 n PRO 40 Ca 0.21 0.02 -0.00 0.00 -0.04 0.00 0.00 63.50 63.68 2dk8 n PRO 40 Cb 0.54 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.43 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 -4.09 0.54 2.07 -1.92 -3.47 115.15 108.29 2dk8 h HIS 41 Ca 0.00 0.00 -0.55 0.00 -2.85 0.00 0.00 60.37 56.97 2dk8 h HIS 41 Cb 0.05 0.00 0.14 0.00 2.57 0.00 0.00 27.41 30.17 2dk8 h HIS 41 CO 0.00 0.60 0.52 0.42 -3.07 0.00 0.00 177.93 176.40 2dk8 s ILE 42 N -2.91 2.23 0.74 6.12 -1.09 -0.98 -4.99 121.20 120.32 2dk8 s ILE 42 Ca -0.02 0.15 -0.12 0.00 -2.23 0.00 0.00 60.65 58.44 2dk8 s ILE 42 Cb 0.08 -3.07 0.03 0.00 -1.58 0.00 0.00 42.46 37.93 2dk8 s ILE 42 CO 0.80 -0.02 1.11 -1.61 -1.23 0.00 0.00 174.94 173.99 2dk8 s GLU 43 N -3.24 2.57 0.18 2.79 0.41 -1.26 -4.83 118.70 115.32 2dk8 s GLU 43 Ca 0.78 0.40 -0.11 0.00 -0.41 0.00 0.00 54.97 55.64 2dk8 s GLU 43 Cb -0.36 -1.99 0.08 0.00 -1.78 0.00 0.00 34.13 30.08 2dk8 s GLU 43 CO 0.39 -1.23 1.72 0.00 -0.49 0.00 0.00 175.26 175.66 2dk8 h ALA 44 N -0.79 0.82 -0.03 5.21 0.00 -1.99 0.24 119.26 122.72 2dk8 h ALA 44 Ca -0.45 -0.19 -0.25 0.00 0.00 0.00 0.00 54.91 54.02 2dk8 h ALA 44 Cb 1.27 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 18.84 2dk8 h ALA 44 CO 0.64 0.46 -0.95 1.96 0.00 0.00 0.00 179.25 181.36 2dk8 h GLN 45 N 0.89 0.70 -0.73 0.00 4.20 -1.99 -2.54 115.11 115.64 2dk8 h GLN 45 Ca 0.21 -0.71 -0.01 0.00 0.06 0.00 0.00 58.65 58.20 2dk8 h GLN 45 Cb 0.25 0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 2dk8 h GLN 45 CO -0.01 1.30 0.43 1.96 -0.67 0.00 0.00 178.83 181.83 2dk8 h GLN 46 N 0.39 1.00 0.10 1.46 1.08 -1.89 0.71 115.11 117.95 2dk8 h GLN 46 Ca -0.11 -0.10 -0.00 0.00 -1.45 0.00 0.00 58.65 56.99 2dk8 h GLN 46 Cb 1.60 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 28.83 2dk8 h GLN 46 CO 0.19 0.72 -0.05 0.00 -0.95 0.00 0.00 178.83 178.74 2dk8 h ARG 47 N 1.00 -0.13 0.47 1.46 3.08 -0.54 -1.80 114.38 117.91 2dk8 h ARG 47 Ca 0.26 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.29 2dk8 h ARG 47 Cb -0.01 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2dk8 h ARG 47 CO -0.05 0.06 -0.23 0.00 -1.07 0.00 0.00 179.97 178.69 2dk8 h ALA 48 N 0.60 -0.63 -0.44 0.04 0.00 -1.21 -1.72 119.26 115.89 2dk8 h ALA 48 Ca -0.01 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.77 2dk8 h ALA 48 Cb 0.24 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2dk8 h ALA 48 CO 0.02 -0.81 -0.27 0.28 0.00 0.00 0.00 179.25 178.47 2dk8 h VAL 49 N -0.73 0.00 -0.72 0.00 2.07 0.44 1.43 116.25 118.74 2dk8 h VAL 49 Ca -0.06 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.61 2dk8 h VAL 49 Cb 0.53 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.17 2dk8 h VAL 49 CO 0.11 0.00 -0.12 0.00 0.02 0.00 0.00 177.57 177.57 2dk8 h ALA 50 N -0.34 0.56 0.45 1.67 0.00 -1.30 0.78 119.26 121.09 2dk8 h ALA 50 Ca 0.07 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 2dk8 h ALA 50 Cb 0.20 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2dk8 h ALA 50 CO -0.42 -0.42 -0.35 0.82 0.00 0.00 0.00 179.25 178.88 2dk8 h ILE 51 N 0.03 0.00 -0.41 0.00 2.04 0.90 0.04 117.51 120.11 2dk8 h ILE 51 Ca 0.36 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.28 2dk8 h ILE 51 Cb 0.58 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.58 2dk8 h ILE 51 CO -0.71 0.00 -0.51 -1.13 0.00 0.00 0.00 178.15 175.79 2dk8 h ASN 52 N -0.77 -1.72 -0.80 1.72 -0.73 0.29 0.45 115.58 114.03 2dk8 h ASN 52 Ca -0.06 0.24 0.10 0.00 1.87 0.00 0.00 56.30 58.45 2dk8 h ASN 52 Cb 0.64 0.72 -0.12 0.00 0.27 0.00 0.00 38.32 39.82 2dk8 h ASN 52 CO 0.02 -0.39 -0.48 0.03 -0.37 0.00 0.00 177.43 176.23 2dk8 h ARG 53 N -0.38 -0.11 -0.10 6.67 -0.00 0.68 0.38 114.38 121.52 2dk8 h ARG 53 Ca 0.10 0.01 0.04 0.00 -0.50 0.00 0.00 59.98 59.62 2dk8 h ARG 53 Cb 0.60 0.02 -0.04 0.00 0.00 0.00 0.00 29.97 30.55 2dk8 h ARG 53 CO -0.59 -0.07 -0.14 -0.07 0.00 0.00 0.00 179.97 179.09 2dk8 h LEU 54 N -0.11 -0.44 -0.77 3.04 3.38 0.50 1.51 115.31 122.42 2dk8 h LEU 54 Ca 0.21 0.08 0.18 0.00 0.09 0.00 0.00 57.88 58.43 2dk8 h LEU 54 Cb 0.53 0.21 -0.13 0.00 0.09 0.00 0.00 40.66 41.35 2dk8 h LEU 54 CO -0.84 -0.19 0.03 -0.07 0.09 0.00 0.00 178.44 177.46 2dk8 h LEU 55 N -0.19 -0.31 0.36 1.67 3.38 0.30 0.16 115.31 120.68 2dk8 h LEU 55 Ca 0.08 0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.23 2dk8 h LEU 55 Cb 0.31 0.33 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2dk8 h LEU 55 CO -0.21 -0.17 -0.17 -1.28 0.09 0.00 0.00 178.44 176.69 2dk8 h SER 56 N 0.12 -0.41 -1.42 -0.43 0.87 0.78 -3.21 113.55 109.85 2dk8 h SER 56 Ca 0.42 0.01 0.45 0.00 -1.23 0.00 0.00 61.79 61.45 2dk8 h SER 56 Cb 0.76 0.10 -0.10 0.00 -0.44 0.00 0.00 62.40 62.72 2dk8 h SER 56 CO -0.66 0.03 0.97 0.23 -0.53 0.00 0.00 176.83 176.86 2dk8 n MET 57 N -5.04 -0.02 -0.46 2.24 2.81 0.51 -4.69 117.12 112.46 2dk8 n MET 57 Ca -0.06 1.03 0.00 0.00 -1.81 0.00 0.00 57.70 56.87 2dk8 n MET 57 Cb 0.19 -2.17 0.00 0.00 -0.71 0.00 0.00 33.22 30.53 2dk8 n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dk8 n GLY 58 N -1.60 1.00 0.08 3.03 0.00 0.52 -4.97 105.19 103.26 2dk8 n GLY 58 Ca 0.37 -0.36 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.90 0.91 -4.24 1.61 1.13 -0.88 -4.78 117.38 109.22 2dk8 n GLN 59 Ca 0.00 -0.03 -0.30 0.00 -1.94 0.00 0.00 57.00 54.73 2dk8 n GLN 59 Cb 0.06 -1.48 -0.10 0.00 0.11 0.00 0.00 30.24 28.83 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 -5.29 3.09 -0.17 1.08 2.96 -1.16 -2.62 118.68 116.57 2dk8 s LEU 60 Ca -0.09 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 2dk8 s LEU 60 Cb 0.06 -1.87 0.02 0.00 0.50 0.00 0.00 46.19 44.90 2dk8 s LEU 60 CO 0.77 0.19 -0.20 -0.62 -1.32 0.00 0.00 176.35 175.17 2dk8 s ASP 61 N -2.15 3.09 -0.25 3.68 -1.08 0.42 -4.23 116.67 116.15 2dk8 s ASP 61 Ca 0.21 -0.63 -0.23 0.00 -0.52 0.00 0.00 52.55 51.39 2dk8 s ASP 61 Cb -0.11 -1.45 -0.01 0.00 -1.46 0.00 0.00 42.92 39.89 2dk8 s ASP 61 CO 0.14 0.00 0.74 -0.22 0.52 0.00 0.00 175.17 176.35 2dk8 s LEU 62 N 1.26 4.07 -0.29 -1.34 0.20 -1.26 -1.30 118.68 120.02 2dk8 s LEU 62 Ca 0.04 0.90 0.02 0.00 0.69 0.00 0.00 54.13 55.77 2dk8 s LEU 62 Cb -0.13 -3.04 0.07 0.00 -0.43 0.00 0.00 46.19 42.65 2dk8 s LEU 62 CO -0.12 -0.45 -0.04 -0.76 -0.29 0.00 0.00 176.35 174.69 2dk8 s LEU 63 N 2.68 3.87 -0.52 -0.68 1.43 0.34 -4.94 118.68 120.86 2dk8 s LEU 63 Ca 0.31 -1.53 -0.28 0.00 -1.03 0.00 0.00 54.13 51.60 2dk8 s LEU 63 Cb -0.15 -1.61 0.01 0.00 0.03 0.00 0.00 46.19 44.46 2dk8 s LEU 63 CO 0.08 -0.26 1.42 -0.13 0.23 0.00 0.00 176.35 177.69 2dk8 s ARG 64 N 1.10 3.37 0.51 1.70 3.00 -1.26 0.14 118.95 127.51 2dk8 s ARG 64 Ca -0.04 0.60 0.03 0.00 0.00 0.00 0.00 55.73 56.32 2dk8 s ARG 64 Cb -0.20 -4.10 -0.00 0.00 0.00 0.00 0.00 34.95 30.65 2dk8 s ARG 64 CO -0.05 -1.85 0.14 -1.54 0.00 0.00 0.00 175.30 172.01 2dk8 s SER 65 N 4.36 4.31 -0.14 0.23 1.04 -1.23 -4.94 113.70 117.32 2dk8 s SER 65 Ca 0.55 -1.48 -0.36 0.00 0.48 0.00 0.00 55.95 55.14 2dk8 s SER 65 Cb -0.12 0.39 -0.13 0.00 0.10 0.00 0.00 66.02 66.26 2dk8 s SER 65 CO 0.27 -0.90 1.80 0.59 0.98 0.00 0.00 173.24 175.98 2dk8 n ASN 66 N -1.42 2.99 -1.88 7.02 4.13 -1.26 -4.16 115.26 120.68 2dk8 n ASN 66 Ca -0.12 1.02 0.00 0.00 1.68 0.00 0.00 54.58 57.16 2dk8 n ASN 66 Cb 0.66 -1.28 0.00 0.00 -1.54 0.00 0.00 39.78 37.62 2dk8 n ASN 66 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 2dk8 n THR 67 N 4.77-12.08 -3.61 3.41 -1.04 -1.26 -4.92 114.28 99.56 2dk8 n THR 67 Ca 0.24 2.97 0.07 0.00 -2.04 0.00 0.00 64.05 65.28 2dk8 n THR 67 Cb 0.23 -5.14 -0.02 0.00 -1.82 0.00 0.00 70.33 63.59 2dk8 n THR 67 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2dk8 n GLY 68 N 1.64 -1.25 3.67 3.41 0.00 -1.26 -4.90 105.19 106.51 2dk8 n GLY 68 Ca 0.00 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 44.76 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 3.08 0.13 0.99 1.43 -1.26 -3.52 118.68 119.53 2dk8 s LEU 69 Ca 0.00 -0.94 0.11 0.00 -1.03 0.00 0.00 54.13 52.27 2dk8 s LEU 69 Cb 0.00 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 2dk8 s LEU 69 CO 0.00 -0.28 -0.27 -0.22 0.23 0.00 0.00 176.35 175.81 2dk8 s LEU 70 N -3.77 2.33 -0.13 1.79 0.20 0.38 -4.43 118.68 115.05 2dk8 s LEU 70 Ca 0.36 -0.74 -0.00 0.00 0.69 0.00 0.00 54.13 54.44 2dk8 s LEU 70 Cb -0.00 -1.23 0.03 0.00 -0.43 0.00 0.00 46.19 44.55 2dk8 s LEU 70 CO 0.21 0.18 -0.07 -0.31 -0.29 0.00 0.00 176.35 176.06 2dk8 s TYR 71 N -1.06 1.59 0.41 5.38 2.02 0.61 0.13 117.35 126.44 2dk8 s TYR 71 Ca 0.14 -0.87 0.04 0.00 -0.37 0.00 0.00 57.07 56.01 2dk8 s TYR 71 Cb -0.10 -1.28 -0.02 0.00 -0.40 0.00 0.00 41.96 40.15 2dk8 s TYR 71 CO 0.06 -0.55 0.13 -0.98 -1.57 0.00 0.00 175.55 172.64 2dk8 s ARG 72 N 1.67 1.95 0.06 -0.62 1.70 -0.42 0.20 118.95 123.49 2dk8 s ARG 72 Ca 0.04 -2.19 -0.31 0.00 -0.47 0.00 0.00 55.73 52.80 2dk8 s ARG 72 Cb -0.13 -0.60 -0.06 0.00 -0.57 0.00 0.00 34.95 33.59 2dk8 s ARG 72 CO -0.08 -0.49 1.35 0.42 -1.08 0.00 0.00 175.30 175.41 2dk8 s ILE 73 N -3.20 3.63 0.32 4.99 -1.09 -1.25 -0.43 121.20 124.16 2dk8 s ILE 73 Ca 0.23 1.12 -0.29 0.00 -2.23 0.00 0.00 60.65 59.48 2dk8 s ILE 73 Cb 0.02 -3.72 -0.11 0.00 -1.58 0.00 0.00 42.46 37.08 2dk8 s ILE 73 CO 0.15 0.05 1.48 -0.75 -1.23 0.00 0.00 174.94 174.64 2dk8 s LYS 74 N 1.57 4.19 0.07 2.79 2.20 -1.08 -4.68 119.74 124.80 2dk8 s LYS 74 Ca 0.63 2.46 -0.28 0.00 -0.36 0.00 0.00 55.97 58.42 2dk8 s LYS 74 Cb -0.33 -3.03 0.09 0.00 -1.51 0.00 0.00 37.83 33.05 2dk8 s LYS 74 CO 0.28 -0.48 1.12 0.34 -0.36 0.00 0.00 175.35 176.26 2dk8 s ASP 75 N 0.07 -0.12 -0.22 1.43 -1.08 -1.26 -4.99 116.67 110.50 2dk8 s ASP 75 Ca 0.56 -0.27 -0.03 0.00 -0.52 0.00 0.00 52.55 52.30 2dk8 s ASP 75 Cb -0.45 0.33 0.01 0.00 -1.46 0.00 0.00 42.92 41.35 2dk8 s ASP 75 CO 0.53 -0.60 0.06 -0.24 0.52 0.00 0.00 175.17 175.44 2dk8 n SER 76 N -0.47 -5.10 -3.56 -0.34 2.88 -1.26 -5.09 113.62 100.69 2dk8 n SER 76 Ca -0.07 1.13 -0.09 0.00 -1.33 0.00 0.00 58.87 58.51 2dk8 n SER 76 Cb 0.62 -4.46 -0.04 0.00 -0.75 0.00 0.00 64.21 59.58 2dk8 n SER 76 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dk8 s GLY 77 N -1.09 -0.33 -0.06 0.46 0.00 -1.26 -5.08 107.32 99.96 2dk8 s GLY 77 Ca -0.07 1.66 -0.13 0.00 0.00 0.00 0.00 44.72 46.18 2dk8 s GLY 77 CO 0.63 0.74 0.51 -0.56 0.00 0.00 0.00 173.10 174.43 2dk8 h PRO 78 N 2.30 -0.27 -6.62 2.90 0.13 -2.00 -3.45 132.00 124.99 2dk8 h PRO 78 Ca -0.18 0.02 -0.57 0.00 -0.87 0.00 0.00 66.00 64.40 2dk8 h PRO 78 Cb 1.19 0.06 0.08 0.00 0.13 0.00 0.00 31.00 32.46 2dk8 h PRO 78 CO 0.30 -0.04 0.71 0.43 -0.23 0.00 0.00 178.00 179.16 2dk8 n SER 79 N -4.96 3.08 -4.73 1.44 7.64 -1.26 -4.93 113.62 109.90 2dk8 n SER 79 Ca -0.05 1.13 -0.40 0.00 1.01 0.00 0.00 58.87 60.56 2dk8 n SER 79 Cb 0.18 -1.47 -0.05 0.00 -1.01 0.00 0.00 64.21 61.87 2dk8 n SER 79 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dk8 s SER 80 N 0.45 7.19 0.00 6.43 0.01 -1.26 -5.11 113.70 121.41 2dk8 s SER 80 Ca 0.69 1.43 0.00 0.00 1.31 0.00 0.00 55.95 59.38 2dk8 s SER 80 Cb -0.62 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.14 2dk8 s SER 80 CO 0.47 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.65