#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dk8 n SER 2 N 0.00 1.18 -3.66 1.61 2.88 -1.26 -5.02 113.62 109.34 2dk8 n SER 2 Ca 0.00 0.17 -0.25 0.00 -1.33 0.00 0.00 58.87 57.46 2dk8 n SER 2 Cb 0.00 -0.40 -0.17 0.00 -0.75 0.00 0.00 64.21 62.89 2dk8 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dk8 s SER 3 N -5.92 2.16 -0.01 -3.46 0.01 -1.26 -5.13 113.70 100.10 2dk8 s SER 3 Ca -0.08 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.71 2dk8 s SER 3 Cb 0.01 -0.31 0.02 0.00 0.21 0.00 0.00 66.02 65.95 2dk8 s SER 3 CO 0.11 -0.31 0.01 -0.83 0.41 0.00 0.00 173.24 172.63 2dk8 s GLY 4 N 2.07 0.09 1.10 3.44 0.00 -1.26 -5.15 107.32 107.61 2dk8 s GLY 4 Ca 0.02 0.14 -0.13 0.00 0.00 0.00 0.00 44.72 44.75 2dk8 s GLY 4 CO -0.07 0.37 1.06 -0.56 0.00 0.00 0.00 173.10 173.90 2dk8 s SER 5 N 0.59 1.72 -0.25 1.64 0.01 -1.26 -5.01 113.70 111.14 2dk8 s SER 5 Ca -0.05 1.24 -0.08 0.00 1.31 0.00 0.00 55.95 58.37 2dk8 s SER 5 Cb -0.08 -1.93 -0.03 0.00 0.21 0.00 0.00 66.02 64.19 2dk8 s SER 5 CO -0.02 -3.70 0.08 -0.55 0.41 0.00 0.00 173.24 169.46 2dk8 s SER 6 N -3.12 5.23 0.00 2.44 0.15 -1.26 -5.01 113.70 112.13 2dk8 s SER 6 Ca 0.67 -0.18 0.00 0.00 0.70 0.00 0.00 55.95 57.14 2dk8 s SER 6 Cb -0.21 -1.95 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 2dk8 s SER 6 CO 0.60 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.62 2dk8 n GLY 7 N 4.93 4.39 0.17 9.45 0.00 -1.26 -5.02 105.19 117.85 2dk8 n GLY 7 Ca -0.16 -1.46 -0.05 0.00 0.00 0.00 0.00 46.02 44.35 2dk8 n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dk8 h PRO 8 N 0.00 -0.33 -5.16 1.61 0.13 -2.04 -3.50 132.00 122.73 2dk8 h PRO 8 Ca 0.00 0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2dk8 h PRO 8 Cb 0.00 0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.20 2dk8 h PRO 8 CO 0.00 -0.21 -0.99 -0.25 -0.23 0.00 0.00 178.00 176.32 2dk8 n ASP 9 N -5.00 -8.05 -2.20 1.44 9.92 -1.26 -4.74 116.55 106.65 2dk8 n ASP 9 Ca -0.04 1.42 -0.02 0.00 -0.53 0.00 0.00 54.79 55.62 2dk8 n ASP 9 Cb 0.14 -5.33 -0.02 0.00 -0.64 0.00 0.00 41.12 35.27 2dk8 n ASP 9 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dk8 n ALA 10 N 0.70 -3.40 -0.98 2.24 0.00 -1.26 -4.92 120.51 112.88 2dk8 n ALA 10 Ca 0.00 1.09 -0.36 0.00 0.00 0.00 0.00 53.44 54.17 2dk8 n ALA 10 Cb 0.01 -2.13 0.05 0.00 0.00 0.00 0.00 19.45 17.38 2dk8 n ALA 10 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dk8 n ASP 11 N 0.83 -5.71 0.08 0.00 9.92 -1.26 -4.77 116.55 115.64 2dk8 n ASP 11 Ca -0.17 0.19 -0.04 0.00 -0.53 0.00 0.00 54.79 54.24 2dk8 n ASP 11 Cb 0.26 -0.79 -0.02 0.00 -0.64 0.00 0.00 41.12 39.93 2dk8 n ASP 11 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 2dk8 h PRO 12 N -1.05 -0.27 -0.94 -0.24 0.13 -1.93 -2.96 132.00 124.74 2dk8 h PRO 12 Ca -0.44 0.02 0.16 0.00 -0.87 0.00 0.00 66.00 64.87 2dk8 h PRO 12 Cb 1.30 0.06 -0.16 0.00 0.13 0.00 0.00 31.00 32.33 2dk8 h PRO 12 CO 0.24 -0.18 -0.34 -0.24 -0.23 0.00 0.00 178.00 177.25 2dk8 h VAL 13 N -0.89 0.03 -0.09 1.56 3.04 -1.99 0.16 116.25 118.07 2dk8 h VAL 13 Ca -0.03 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.69 2dk8 h VAL 13 Cb 0.21 0.03 -0.06 0.00 -2.01 0.00 0.00 31.29 29.47 2dk8 h VAL 13 CO 0.05 0.00 -0.49 -0.33 -1.01 0.00 0.00 177.57 175.78 2dk8 h GLU 14 N -0.02 -0.53 -0.58 4.17 4.39 -1.93 0.34 114.58 120.42 2dk8 h GLU 14 Ca 0.36 0.04 0.06 0.00 0.34 0.00 0.00 59.36 60.16 2dk8 h GLU 14 Cb 0.62 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 29.31 2dk8 h GLU 14 CO -0.95 -0.36 -0.48 0.82 -1.16 0.00 0.00 179.01 176.88 2dk8 h ILE 15 N -0.55 0.00 -0.23 3.13 2.04 -0.57 0.15 117.51 121.48 2dk8 h ILE 15 Ca 0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.93 2dk8 h ILE 15 Cb 0.63 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.64 2dk8 h ILE 15 CO -0.38 0.00 -0.51 -0.33 0.00 0.00 0.00 178.15 176.94 2dk8 h GLU 16 N -0.17 -0.48 -0.90 2.37 5.08 -0.58 -1.12 114.58 118.78 2dk8 h GLU 16 Ca 0.10 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.61 2dk8 h GLU 16 Cb 0.42 0.11 -0.14 0.00 0.50 0.00 0.00 28.75 29.65 2dk8 h GLU 16 CO -0.64 -0.32 -0.45 -0.91 -1.00 0.00 0.00 179.01 175.69 2dk8 h ASN 17 N -0.49 -1.63 -0.77 1.42 2.35 0.12 0.34 115.58 116.91 2dk8 h ASN 17 Ca 0.07 0.30 0.12 0.00 -0.55 0.00 0.00 56.30 56.23 2dk8 h ASN 17 Cb 0.64 0.79 -0.13 0.00 0.05 0.00 0.00 38.32 39.67 2dk8 h ASN 17 CO -0.48 -0.28 -0.40 -0.09 -1.65 0.00 0.00 177.43 174.52 2dk8 h ARG 18 N -0.05 -0.10 -0.47 0.81 1.12 0.48 0.42 114.38 116.58 2dk8 h ARG 18 Ca 0.26 0.01 0.09 0.00 -1.11 0.00 0.00 59.98 59.23 2dk8 h ARG 18 Cb 0.54 0.02 -0.09 0.00 -0.01 0.00 0.00 29.97 30.44 2dk8 h ARG 18 CO -0.90 -0.07 -0.09 0.82 -3.11 0.00 0.00 179.97 176.61 2dk8 h ILE 19 N -0.11 0.55 -0.29 1.20 2.04 0.17 -1.05 117.51 120.02 2dk8 h ILE 19 Ca 0.25 -0.01 0.06 0.00 1.00 0.00 0.00 64.86 66.16 2dk8 h ILE 19 Cb 0.56 0.53 -0.08 0.00 -0.74 0.00 0.00 36.82 37.09 2dk8 h ILE 19 CO -0.82 0.00 -0.43 0.40 0.00 0.00 0.00 178.15 177.30 2dk8 h ILE 20 N 0.02 0.12 -1.04 -0.67 1.08 0.11 1.15 117.51 118.29 2dk8 h ILE 20 Ca 0.23 0.00 0.27 0.00 -0.39 0.00 0.00 64.86 64.96 2dk8 h ILE 20 Cb 0.35 0.12 -0.08 0.00 -3.07 0.00 0.00 36.82 34.13 2dk8 h ILE 20 CO -0.47 0.00 0.68 -0.33 -0.69 0.00 0.00 178.15 177.34 2dk8 h GLU 21 N -0.40 0.33 0.16 2.37 5.08 0.11 0.36 114.58 122.58 2dk8 h GLU 21 Ca 0.11 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2dk8 h GLU 21 Cb 0.60 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2dk8 h GLU 21 CO -0.50 0.22 -0.08 -0.07 -1.00 0.00 0.00 179.01 177.58 2dk8 h LEU 22 N 0.34 -0.18 -1.83 1.33 3.38 0.91 -1.49 115.31 117.78 2dk8 h LEU 22 Ca 0.57 -0.28 0.25 0.00 0.09 0.00 0.00 57.88 58.51 2dk8 h LEU 22 Cb 1.56 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 42.32 2dk8 h LEU 22 CO -0.24 0.39 0.75 0.00 0.09 0.00 0.00 178.44 179.43 2dk8 h HIS 24 N 0.00 0.58 -0.32 0.00 3.86 -0.28 -3.25 115.15 115.74 2dk8 h HIS 24 Ca 0.40 -0.37 -0.04 0.00 -1.16 0.00 0.00 60.37 59.20 2dk8 h HIS 24 Cb 1.91 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 30.31 2dk8 h HIS 24 CO 0.00 1.23 0.01 1.96 0.86 0.00 0.00 177.93 181.99 2dk8 h GLN 25 N -0.24 0.48 -4.74 2.45 1.08 0.19 -3.37 115.11 110.96 2dk8 h GLN 25 Ca -0.11 -0.10 -0.66 0.00 -1.45 0.00 0.00 58.65 56.33 2dk8 h GLN 25 Cb 1.49 -0.07 -0.39 0.00 -0.05 0.00 0.00 27.48 28.46 2dk8 h GLN 25 CO 0.14 0.51 -0.75 -0.06 -0.95 0.00 0.00 178.83 177.71 2dk8 s PHE 26 N -4.98 3.50 0.14 2.96 0.40 0.15 -4.95 117.98 115.20 2dk8 s PHE 26 Ca -0.07 -2.68 0.13 0.00 -0.60 0.00 0.00 56.93 53.70 2dk8 s PHE 26 Cb 0.16 -2.47 0.30 0.00 0.51 0.00 0.00 43.02 41.52 2dk8 s PHE 26 CO 0.76 -0.92 1.56 -1.00 0.70 0.00 0.00 175.22 176.32 2dk8 h PRO 27 N 7.69 0.00 -0.31 0.24 0.13 -1.74 -3.17 132.00 134.83 2dk8 h PRO 27 Ca -0.11 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.91 2dk8 h PRO 27 Cb 1.03 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 2dk8 h PRO 27 CO 0.49 0.60 -0.25 0.45 -0.23 0.00 0.00 178.00 179.06 2dk8 h HIS 28 N 0.00 0.85 0.00 1.56 3.86 -1.92 -3.40 115.15 116.10 2dk8 h HIS 28 Ca -0.01 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 2dk8 h HIS 28 Cb 1.21 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 29.49 2dk8 h HIS 28 CO 0.00 0.98 0.00 0.41 0.86 0.00 0.00 177.93 180.18 2dk8 n GLY 29 N 0.08 3.53 3.35 2.45 0.00 -1.20 -4.70 105.19 108.71 2dk8 n GLY 29 Ca -0.03 -1.69 -0.19 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.02 1.78 0.09 -0.61 -4.36 0.28 -4.86 121.20 111.51 2dk8 s ILE 30 Ca 0.00 -2.21 0.06 0.00 -0.26 0.00 0.00 60.65 58.24 2dk8 s ILE 30 Cb 0.00 -2.05 -0.04 0.00 1.25 0.00 0.00 42.46 41.62 2dk8 s ILE 30 CO 0.00 -0.58 -0.09 0.42 0.24 0.00 0.00 174.94 174.94 2dk8 s THR 31 N -2.91 3.45 0.37 8.37 -4.23 -1.26 -0.90 115.64 118.53 2dk8 s THR 31 Ca 0.23 -1.19 0.21 0.00 -1.18 0.00 0.00 61.69 59.75 2dk8 s THR 31 Cb -0.01 -2.60 0.35 0.00 1.34 0.00 0.00 72.50 71.58 2dk8 s THR 31 CO 0.07 0.14 1.59 -2.24 -0.54 0.00 0.00 174.62 173.64 2dk8 h ASP 32 N 3.70 0.33 0.36 3.99 2.03 -1.97 0.70 116.42 125.55 2dk8 h ASP 32 Ca -0.49 0.25 -0.00 0.00 -0.73 0.00 0.00 57.03 56.06 2dk8 h ASP 32 Cb 1.17 0.25 -0.02 0.00 -0.83 0.00 0.00 39.33 39.90 2dk8 h ASP 32 CO 0.53 -0.41 -0.37 -0.61 -1.03 0.00 0.00 179.24 177.35 2dk8 h GLN 33 N 0.03 -0.73 -0.11 4.15 4.15 -1.96 0.08 115.11 120.72 2dk8 h GLN 33 Ca 0.84 0.05 0.01 0.00 0.77 0.00 0.00 58.65 60.32 2dk8 h GLN 33 Cb 2.22 0.17 -0.02 0.00 0.21 0.00 0.00 27.48 30.05 2dk8 h GLN 33 CO -0.75 -0.49 -0.12 0.28 -1.93 0.00 0.00 178.83 175.83 2dk8 h VAL 34 N -0.76 0.00 -0.70 2.39 2.07 0.01 1.30 116.25 120.56 2dk8 h VAL 34 Ca -0.02 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.70 2dk8 h VAL 34 Cb 0.69 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2dk8 h VAL 34 CO -0.07 0.00 0.76 0.40 0.02 0.00 0.00 177.57 178.68 2dk8 h ILE 35 N -0.07 0.22 0.15 4.57 2.04 -1.39 0.59 117.51 123.62 2dk8 h ILE 35 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 2dk8 h ILE 35 Cb 0.12 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2dk8 h ILE 35 CO -0.14 0.00 -0.07 -0.61 0.00 0.00 0.00 178.15 177.33 2dk8 h GLN 36 N 0.00 -0.20 0.00 2.37 4.15 0.35 1.47 115.11 123.25 2dk8 h GLN 36 Ca 0.33 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.76 2dk8 h GLN 36 Cb 1.85 0.04 0.00 0.00 0.21 0.00 0.00 27.48 29.59 2dk8 h GLN 36 CO -0.00 0.25 0.00 -0.91 -1.93 0.00 0.00 178.83 176.23 2dk8 h ASN 37 N -0.80 0.00 0.00 -0.69 2.35 0.38 0.33 115.58 117.15 2dk8 h ASN 37 Ca -0.02 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.51 2dk8 h ASN 37 Cb 0.53 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 2dk8 h ASN 37 CO 0.03 0.00 -1.22 -0.62 -1.65 0.00 0.00 177.43 173.97 2dk8 n GLU 38 N -2.81 0.55 -3.26 0.81 -0.58 0.16 -4.70 120.64 110.83 2dk8 n GLU 38 Ca 0.00 0.57 -0.25 0.00 -0.42 0.00 0.00 57.16 57.07 2dk8 n GLU 38 Cb 0.24 -1.74 -0.07 0.00 -0.57 0.00 0.00 31.44 29.30 2dk8 n GLU 38 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 2dk8 n MET 39 N -4.45 1.45 0.00 3.49 2.81 0.50 -4.89 117.12 116.04 2dk8 n MET 39 Ca -0.30 -3.79 0.11 0.00 -1.81 0.00 0.00 57.70 51.90 2dk8 n MET 39 Cb 0.65 -1.64 0.51 0.00 -0.71 0.00 0.00 33.22 32.02 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 1.06 0.14 -0.03 0.03 -0.04 0.11 -2.38 135.00 133.90 2dk8 n PRO 40 Ca 0.25 0.10 0.08 0.00 -0.04 0.00 0.00 63.50 63.89 2dk8 n PRO 40 Cb 0.49 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.87 2dk8 n PRO 40 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2dk8 n HIS 41 N -1.41 0.07 -3.31 0.54 1.44 -1.26 -4.81 115.22 106.48 2dk8 n HIS 41 Ca 0.08 -0.04 -0.35 0.00 -2.01 0.00 0.00 57.72 55.40 2dk8 n HIS 41 Cb 0.22 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.28 2dk8 n HIS 41 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2dk8 s ILE 42 N -1.93 4.81 0.51 0.61 -1.09 -1.00 -4.98 121.20 118.13 2dk8 s ILE 42 Ca 0.25 0.90 -0.18 0.00 -2.23 0.00 0.00 60.65 59.39 2dk8 s ILE 42 Cb 0.12 -3.75 -0.08 0.00 -1.58 0.00 0.00 42.46 37.18 2dk8 s ILE 42 CO 0.20 0.22 1.00 -1.61 -1.23 0.00 0.00 174.94 173.51 2dk8 s GLU 43 N -2.01 3.88 0.30 2.79 2.02 -1.26 -4.80 118.70 119.62 2dk8 s GLU 43 Ca 0.39 1.07 0.04 0.00 0.02 0.00 0.00 54.97 56.49 2dk8 s GLU 43 Cb -0.15 -2.12 0.64 0.00 0.10 0.00 0.00 34.13 32.60 2dk8 s GLU 43 CO 0.19 -0.33 1.84 0.00 0.02 0.00 0.00 175.26 176.98 2dk8 h ALA 44 N 1.09 1.62 0.07 5.21 0.00 -1.97 1.10 119.26 126.38 2dk8 h ALA 44 Ca -0.47 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 2dk8 h ALA 44 Cb 1.19 -0.18 0.02 0.00 0.00 0.00 0.00 17.79 18.82 2dk8 h ALA 44 CO 0.60 0.12 -0.66 1.96 0.00 0.00 0.00 179.25 181.28 2dk8 h GLN 45 N 0.90 0.33 -0.99 0.00 4.20 -1.99 -3.03 115.11 114.53 2dk8 h GLN 45 Ca 0.49 -0.44 0.02 0.00 0.06 0.00 0.00 58.65 58.77 2dk8 h GLN 45 Cb 0.58 0.15 -0.05 0.00 0.30 0.00 0.00 27.48 28.46 2dk8 h GLN 45 CO -0.26 1.16 0.65 1.96 -0.67 0.00 0.00 178.83 181.67 2dk8 h GLN 46 N -0.29 1.28 -0.75 1.46 1.08 -1.68 0.79 115.11 117.01 2dk8 h GLN 46 Ca -0.10 -0.08 -0.02 0.00 -1.45 0.00 0.00 58.65 57.00 2dk8 h GLN 46 Cb 1.44 -0.29 -0.04 0.00 -0.05 0.00 0.00 27.48 28.55 2dk8 h GLN 46 CO 0.13 0.85 0.38 0.00 -0.95 0.00 0.00 178.83 179.24 2dk8 h ARG 47 N 1.32 1.06 0.03 1.46 3.08 0.11 -1.64 114.38 119.80 2dk8 h ARG 47 Ca 0.37 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.29 2dk8 h ARG 47 Cb -0.11 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.74 2dk8 h ARG 47 CO -0.09 0.80 -0.02 0.00 -1.07 0.00 0.00 179.97 179.59 2dk8 h ALA 48 N 1.36 -0.04 -0.15 0.04 0.00 -1.15 -2.85 119.26 116.46 2dk8 h ALA 48 Ca 0.26 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2dk8 h ALA 48 Cb 0.07 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2dk8 h ALA 48 CO -0.04 -0.11 -0.12 0.28 0.00 0.00 0.00 179.25 179.27 2dk8 h VAL 49 N -0.87 0.00 -0.76 0.00 2.07 0.69 1.58 116.25 118.96 2dk8 h VAL 49 Ca -0.00 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.69 2dk8 h VAL 49 Cb 0.71 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.35 2dk8 h VAL 49 CO 0.01 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.60 2dk8 h ALA 50 N -0.84 0.79 0.44 1.67 0.00 -1.45 0.54 119.26 120.42 2dk8 h ALA 50 Ca 0.03 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2dk8 h ALA 50 Cb 0.10 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2dk8 h ALA 50 CO -0.16 -0.43 -0.39 0.82 0.00 0.00 0.00 179.25 179.09 2dk8 h ILE 51 N 0.10 0.00 -0.46 0.00 2.04 -0.29 0.13 117.51 119.03 2dk8 h ILE 51 Ca 0.42 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.36 2dk8 h ILE 51 Cb 0.74 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.72 2dk8 h ILE 51 CO -0.68 0.00 -0.36 -1.13 0.00 0.00 0.00 178.15 175.98 2dk8 h ASN 52 N -0.82 -1.21 -0.38 1.72 -0.73 0.36 0.54 115.58 115.06 2dk8 h ASN 52 Ca -0.06 0.21 0.06 0.00 1.87 0.00 0.00 56.30 58.38 2dk8 h ASN 52 Cb 0.70 0.56 -0.08 0.00 0.27 0.00 0.00 38.32 39.77 2dk8 h ASN 52 CO -0.02 -0.33 -0.51 0.03 -0.37 0.00 0.00 177.43 176.23 2dk8 h ARG 53 N -0.25 -0.38 -0.54 6.67 -0.00 0.30 0.48 114.38 120.67 2dk8 h ARG 53 Ca 0.18 0.03 0.08 0.00 -0.50 0.00 0.00 59.98 59.77 2dk8 h ARG 53 Cb 0.55 0.09 -0.07 0.00 0.00 0.00 0.00 29.97 30.54 2dk8 h ARG 53 CO -0.59 -0.25 0.17 -0.07 0.00 0.00 0.00 179.97 179.22 2dk8 h LEU 54 N -0.39 0.13 -0.26 3.04 3.38 0.55 1.47 115.31 123.23 2dk8 h LEU 54 Ca 0.09 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.21 2dk8 h LEU 54 Cb 0.60 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 2dk8 h LEU 54 CO -0.57 0.09 -0.20 -0.07 0.09 0.00 0.00 178.44 177.78 2dk8 h LEU 55 N 0.33 -0.64 0.57 1.67 3.38 0.23 0.10 115.31 120.95 2dk8 h LEU 55 Ca 0.27 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 2dk8 h LEU 55 Cb 0.34 0.32 0.01 0.00 0.09 0.00 0.00 40.66 41.41 2dk8 h LEU 55 CO -0.30 -0.24 -0.27 -1.28 0.09 0.00 0.00 178.44 176.44 2dk8 h SER 56 N -0.19 -0.64 -1.17 -0.43 0.87 0.10 -3.09 113.55 109.00 2dk8 h SER 56 Ca 0.14 0.02 0.42 0.00 -1.23 0.00 0.00 61.79 61.14 2dk8 h SER 56 Cb 0.40 0.17 -0.13 0.00 -0.44 0.00 0.00 62.40 62.40 2dk8 h SER 56 CO -0.37 -0.29 0.74 0.23 -0.53 0.00 0.00 176.83 176.61 2dk8 n MET 57 N -5.00 -0.04 -0.21 2.24 2.81 0.49 -4.71 117.12 112.69 2dk8 n MET 57 Ca -0.09 1.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.93 2dk8 n MET 57 Cb 0.30 -2.20 0.00 0.00 -0.71 0.00 0.00 33.22 30.61 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 -1.42 0.97 0.04 3.03 0.00 0.26 -4.97 105.19 103.09 2dk8 n GLY 58 Ca 0.36 -0.21 0.07 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.07 0.66 -4.68 1.61 1.13 -0.55 -4.75 117.38 108.73 2dk8 n GLN 59 Ca 0.00 -0.11 -0.30 0.00 -1.94 0.00 0.00 57.00 54.65 2dk8 n GLN 59 Cb 0.01 -1.57 -0.14 0.00 0.11 0.00 0.00 30.24 28.66 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 -4.84 2.26 -0.13 1.08 2.96 -0.98 -3.08 118.68 115.94 2dk8 s LEU 60 Ca -0.07 -0.65 0.01 0.00 -0.22 0.00 0.00 54.13 53.20 2dk8 s LEU 60 Cb 0.12 -1.28 -0.00 0.00 0.50 0.00 0.00 46.19 45.53 2dk8 s LEU 60 CO 0.88 0.23 -0.18 -0.62 -1.32 0.00 0.00 176.35 175.34 2dk8 s ASP 61 N -1.59 3.52 -0.00 3.68 2.15 0.57 -4.26 116.67 120.74 2dk8 s ASP 61 Ca 0.13 -0.48 -0.21 0.00 0.43 0.00 0.00 52.55 52.41 2dk8 s ASP 61 Cb -0.10 -1.52 -0.05 0.00 -0.30 0.00 0.00 42.92 40.95 2dk8 s ASP 61 CO 0.04 0.12 0.62 -0.22 -0.17 0.00 0.00 175.17 175.56 2dk8 s LEU 62 N 0.61 4.42 -0.23 -1.34 0.20 -1.26 -1.03 118.68 120.04 2dk8 s LEU 62 Ca -0.10 1.20 -0.03 0.00 0.69 0.00 0.00 54.13 55.89 2dk8 s LEU 62 Cb -0.16 -2.97 0.08 0.00 -0.43 0.00 0.00 46.19 42.70 2dk8 s LEU 62 CO 0.03 0.08 0.08 -0.22 -0.29 0.00 0.00 176.35 176.03 2dk8 s LEU 63 N -0.13 1.01 -0.55 -0.68 0.20 0.15 -4.97 118.68 113.71 2dk8 s LEU 63 Ca 0.32 -1.04 -0.28 0.00 0.69 0.00 0.00 54.13 53.82 2dk8 s LEU 63 Cb -0.18 -0.50 0.03 0.00 -0.43 0.00 0.00 46.19 45.10 2dk8 s LEU 63 CO 0.18 -0.37 1.23 -0.13 -0.29 0.00 0.00 176.35 176.97 2dk8 s ARG 64 N 1.94 3.51 0.22 1.98 3.00 -1.26 0.13 118.95 128.47 2dk8 s ARG 64 Ca 0.04 0.36 0.03 0.00 0.00 0.00 0.00 55.73 56.16 2dk8 s ARG 64 Cb -0.17 -4.02 0.04 0.00 0.00 0.00 0.00 34.95 30.80 2dk8 s ARG 64 CO -0.19 -1.68 0.30 -1.13 0.00 0.00 0.00 175.30 172.60 2dk8 n SER 65 N 8.57 0.67 -0.04 0.23 3.41 -1.25 -4.95 113.62 120.26 2dk8 n SER 65 Ca 0.10 -1.50 -0.01 0.00 -0.26 0.00 0.00 58.87 57.19 2dk8 n SER 65 Cb 0.49 -0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.26 2dk8 n SER 65 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2dk8 h ASN 66 N -0.03 -0.26 0.00 4.04 4.21 -2.00 -3.42 115.58 118.12 2dk8 h ASN 66 Ca -0.10 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.45 2dk8 h ASN 66 Cb 0.43 0.11 0.00 0.00 -1.12 0.00 0.00 38.32 37.75 2dk8 h ASN 66 CO 0.13 -0.03 0.00 1.07 -1.29 0.00 0.00 177.43 177.31 2dk8 n THR 67 N -3.23 0.00 -0.95 2.81 5.66 -1.26 -5.01 114.28 112.31 2dk8 n THR 67 Ca 0.00 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.63 2dk8 n THR 67 Cb 0.03 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 68.87 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 5.00 -3.44 3.77 1.09 0.00 -1.26 -4.91 105.19 105.43 2dk8 n GLY 68 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 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 6.25 2.47 0.20 0.99 1.43 -1.26 -3.76 118.68 125.00 2dk8 s LEU 69 Ca 0.41 1.40 0.09 0.00 -1.03 0.00 0.00 54.13 55.00 2dk8 s LEU 69 Cb -0.04 -3.94 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 2dk8 s LEU 69 CO 0.72 -2.26 -0.16 -0.22 0.23 0.00 0.00 176.35 174.66 2dk8 s LEU 70 N -5.97 2.53 -0.05 1.79 0.20 0.34 -4.44 118.68 113.08 2dk8 s LEU 70 Ca 0.62 -0.97 -0.01 0.00 0.69 0.00 0.00 54.13 54.46 2dk8 s LEU 70 Cb -0.16 -0.78 0.03 0.00 -0.43 0.00 0.00 46.19 44.85 2dk8 s LEU 70 CO 0.55 -0.10 0.01 -0.31 -0.29 0.00 0.00 176.35 176.22 2dk8 s TYR 71 N -2.63 0.47 0.43 5.38 2.02 -0.08 0.33 117.35 123.28 2dk8 s TYR 71 Ca 0.21 -0.04 0.04 0.00 -0.37 0.00 0.00 57.07 56.91 2dk8 s TYR 71 Cb -0.03 -0.65 -0.02 0.00 -0.40 0.00 0.00 41.96 40.87 2dk8 s TYR 71 CO 0.08 -0.25 0.13 -0.98 -1.57 0.00 0.00 175.55 172.96 2dk8 s ARG 72 N 1.77 2.01 0.01 -0.62 1.70 -0.20 0.10 118.95 123.73 2dk8 s ARG 72 Ca 0.01 -2.25 -0.30 0.00 -0.47 0.00 0.00 55.73 52.72 2dk8 s ARG 72 Cb -0.13 -0.67 -0.05 0.00 -0.57 0.00 0.00 34.95 33.53 2dk8 s ARG 72 CO -0.04 -0.51 1.34 0.42 -1.08 0.00 0.00 175.30 175.42 2dk8 s ILE 73 N -3.15 3.82 0.55 4.99 -1.09 -1.23 -0.31 121.20 124.78 2dk8 s ILE 73 Ca 0.20 1.22 -0.21 0.00 -2.23 0.00 0.00 60.65 59.63 2dk8 s ILE 73 Cb 0.01 -3.78 -0.05 0.00 -1.58 0.00 0.00 42.46 37.07 2dk8 s ILE 73 CO 0.13 0.02 1.28 -0.75 -1.23 0.00 0.00 174.94 174.40 2dk8 s LYS 74 N 2.07 3.15 -0.26 2.79 2.20 -1.18 -4.70 119.74 123.82 2dk8 s LYS 74 Ca 0.62 2.04 -0.27 0.00 -0.36 0.00 0.00 55.97 58.00 2dk8 s LYS 74 Cb -0.30 -2.17 0.15 0.00 -1.51 0.00 0.00 37.83 34.00 2dk8 s LYS 74 CO 0.26 -1.12 1.20 0.34 -0.36 0.00 0.00 175.35 175.67 2dk8 s ASP 75 N -1.22 -0.25 0.05 1.43 -1.08 -1.26 -4.98 116.67 109.36 2dk8 s ASP 75 Ca 0.73 0.40 0.00 0.00 -0.52 0.00 0.00 52.55 53.15 2dk8 s ASP 75 Cb -0.36 0.38 0.00 0.00 -1.46 0.00 0.00 42.92 41.48 2dk8 s ASP 75 CO 0.41 -0.14 0.00 -1.54 0.52 0.00 0.00 175.17 174.42 2dk8 n SER 76 N 1.39 -0.43 -3.51 -0.34 3.41 -1.26 -5.15 113.62 107.74 2dk8 n SER 76 Ca -0.09 0.15 -0.12 0.00 -0.26 0.00 0.00 58.87 58.54 2dk8 n SER 76 Cb 0.57 0.63 -0.04 0.00 -0.26 0.00 0.00 64.21 65.12 2dk8 n SER 76 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dk8 s GLY 77 N -2.00 -0.49 0.11 5.00 0.00 -1.26 -5.15 107.32 103.53 2dk8 s GLY 77 Ca 0.00 1.21 -0.30 0.00 0.00 0.00 0.00 44.72 45.63 2dk8 s GLY 77 CO 0.00 0.62 1.15 2.56 0.00 0.00 0.00 173.10 177.43 2dk8 s PRO 78 N -2.28 4.50 -0.58 2.90 0.04 -1.26 -5.00 135.00 133.32 2dk8 s PRO 78 Ca -0.02 1.74 -0.03 0.00 0.04 0.00 0.00 61.00 62.73 2dk8 s PRO 78 Cb -0.01 -3.32 0.15 0.00 0.04 0.00 0.00 34.50 31.36 2dk8 s PRO 78 CO -0.02 -0.11 0.40 0.45 0.04 0.00 0.00 177.00 177.75 2dk8 s SER 79 N 0.57 5.28 -0.29 6.66 0.15 -1.26 -5.00 113.70 119.82 2dk8 s SER 79 Ca 0.54 -2.66 -0.03 0.00 0.70 0.00 0.00 55.95 54.50 2dk8 s SER 79 Cb -0.29 -1.86 0.11 0.00 -1.71 0.00 0.00 66.02 62.27 2dk8 s SER 79 CO 0.32 -0.42 0.18 -0.94 1.20 0.00 0.00 173.24 173.58 2dk8 s SER 80 N 1.00 3.02 0.00 5.45 1.04 -1.26 -5.31 113.70 117.63 2dk8 s SER 80 Ca 0.15 -1.15 0.16 0.00 0.48 0.00 0.00 55.95 55.59 2dk8 s SER 80 Cb -0.21 -0.11 0.96 0.00 0.10 0.00 0.00 66.02 66.76 2dk8 s SER 80 CO -0.04 -0.42 1.37 0.61 0.98 0.00 0.00 173.24 175.74