#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 1.19 0.11 1.61 1.04 -1.26 -5.00 113.70 111.39 2dk8 s SER 2 Ca 0.00 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.98 2dk8 s SER 2 Cb 0.00 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.08 2dk8 s SER 2 CO 0.00 -0.07 0.00 -0.24 0.98 0.00 0.00 173.24 173.91 2dk8 n SER 3 N 1.83 -0.97 0.00 7.02 2.88 -1.26 -5.10 113.62 118.01 2dk8 n SER 3 Ca -0.19 0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 2dk8 n SER 3 Cb 0.55 1.16 0.00 0.00 -0.75 0.00 0.00 64.21 65.17 2dk8 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dk8 n GLY 4 N -1.32 0.54 3.82 0.46 0.00 -1.26 -5.18 105.19 102.24 2dk8 n GLY 4 Ca 0.00 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 2dk8 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dk8 s SER 5 N 0.00 4.40 0.78 1.61 1.04 -1.26 -5.12 113.70 115.15 2dk8 s SER 5 Ca 0.00 -1.39 -0.12 0.00 0.48 0.00 0.00 55.95 54.92 2dk8 s SER 5 Cb 0.00 0.34 0.07 0.00 0.10 0.00 0.00 66.02 66.52 2dk8 s SER 5 CO 0.00 -0.93 1.14 -0.94 0.98 0.00 0.00 173.24 173.50 2dk8 s SER 6 N -4.07 4.08 0.00 7.02 1.04 -1.26 -4.48 113.70 116.03 2dk8 s SER 6 Ca 0.24 2.11 0.00 0.00 0.48 0.00 0.00 55.95 58.78 2dk8 s SER 6 Cb 0.00 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.56 2dk8 s SER 6 CO 0.14 -2.33 0.00 0.61 0.98 0.00 0.00 173.24 172.64 2dk8 n GLY 7 N -0.22 1.78 2.91 7.32 0.00 -1.26 -4.99 105.19 110.74 2dk8 n GLY 7 Ca 0.11 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2dk8 n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dk8 n PRO 8 N 0.00 2.15 -3.87 1.61 -0.04 -1.26 -4.80 135.00 128.79 2dk8 n PRO 8 Ca 0.00 -2.18 -0.33 0.00 -0.04 0.00 0.00 63.50 60.95 2dk8 n PRO 8 Cb 0.00 -3.07 -0.13 0.00 -0.04 0.00 0.00 33.50 30.26 2dk8 n PRO 8 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2dk8 s ASP 9 N 4.11 4.79 -0.13 3.54 -1.08 -1.26 -4.90 116.67 121.74 2dk8 s ASP 9 Ca 0.53 -2.66 -0.09 0.00 -0.52 0.00 0.00 52.55 49.80 2dk8 s ASP 9 Cb 0.14 -1.72 0.03 0.00 -1.46 0.00 0.00 42.92 39.91 2dk8 s ASP 9 CO 0.02 -0.34 0.18 0.00 0.52 0.00 0.00 175.17 175.54 2dk8 n ALA 10 N 3.65 -2.91 -1.07 3.66 0.00 -1.26 -4.85 120.51 117.72 2dk8 n ALA 10 Ca 0.05 1.74 -0.36 0.00 0.00 0.00 0.00 53.44 54.86 2dk8 n ALA 10 Cb 0.37 -3.55 0.06 0.00 0.00 0.00 0.00 19.45 16.32 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 1.96 -3.72 0.08 0.00 9.92 -1.26 -4.82 116.55 118.71 2dk8 n ASP 11 Ca -0.30 0.40 -0.04 0.00 -0.53 0.00 0.00 54.79 54.31 2dk8 n ASP 11 Cb 0.46 -0.97 -0.02 0.00 -0.64 0.00 0.00 41.12 39.96 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 -0.76 -0.26 -0.99 -0.24 0.13 -1.99 -2.85 132.00 125.04 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 1.34 0.06 -0.16 0.00 0.13 0.00 0.00 31.00 32.36 2dk8 h PRO 12 CO 0.33 -0.17 -0.36 -0.24 -0.23 0.00 0.00 178.00 177.33 2dk8 h VAL 13 N -0.87 0.01 0.05 1.56 3.04 -1.99 0.30 116.25 118.34 2dk8 h VAL 13 Ca -0.03 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.68 2dk8 h VAL 13 Cb 0.21 0.01 -0.05 0.00 -2.01 0.00 0.00 31.29 29.44 2dk8 h VAL 13 CO 0.05 0.00 -0.49 -0.33 -1.01 0.00 0.00 177.57 175.79 2dk8 h GLU 14 N -0.00 -0.65 -0.45 4.17 5.08 -1.94 0.10 114.58 120.89 2dk8 h GLU 14 Ca 0.37 0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.82 2dk8 h GLU 14 Cb 0.62 0.15 -0.08 0.00 0.50 0.00 0.00 28.75 29.94 2dk8 h GLU 14 CO -0.99 -0.43 -0.53 0.82 -1.00 0.00 0.00 179.01 176.88 2dk8 h ILE 15 N -0.67 0.00 -0.53 3.13 2.04 -0.27 0.31 117.51 121.52 2dk8 h ILE 15 Ca 0.02 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.96 2dk8 h ILE 15 Cb 0.71 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.69 2dk8 h ILE 15 CO -0.31 0.00 -0.41 -0.33 0.00 0.00 0.00 178.15 177.09 2dk8 h GLU 16 N -0.33 -0.24 -0.58 2.37 5.08 -0.48 -0.38 114.58 120.03 2dk8 h GLU 16 Ca 0.08 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 2dk8 h GLU 16 Cb 0.54 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 29.74 2dk8 h GLU 16 CO -0.60 -0.16 -0.48 -0.91 -1.00 0.00 0.00 179.01 175.87 2dk8 h ASN 17 N -0.25 -1.64 -0.92 1.42 2.35 0.78 0.39 115.58 117.71 2dk8 h ASN 17 Ca 0.18 0.25 0.24 0.00 -0.55 0.00 0.00 56.30 56.42 2dk8 h ASN 17 Cb 0.57 0.72 -0.17 0.00 0.05 0.00 0.00 38.32 39.49 2dk8 h ASN 17 CO -0.65 -0.34 0.02 0.03 -1.65 0.00 0.00 177.43 174.84 2dk8 h ARG 18 N -0.25 0.05 -0.78 0.81 2.47 0.69 1.42 114.38 118.79 2dk8 h ARG 18 Ca 0.16 -0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.88 2dk8 h ARG 18 Cb 0.56 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.83 2dk8 h ARG 18 CO -0.69 0.03 0.51 0.82 0.56 0.00 0.00 179.97 181.20 2dk8 h ILE 19 N 0.05 1.20 -0.53 2.04 2.04 0.36 -1.00 117.51 121.67 2dk8 h ILE 19 Ca 0.54 -0.36 0.05 0.00 1.00 0.00 0.00 64.86 66.09 2dk8 h ILE 19 Cb 1.06 0.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 2dk8 h ILE 19 CO -0.84 0.19 0.26 0.40 0.00 0.00 0.00 178.15 178.16 2dk8 h ILE 20 N 1.05 0.94 -0.55 -0.67 1.08 0.34 1.05 117.51 120.75 2dk8 h ILE 20 Ca 0.28 -0.17 -0.01 0.00 -0.39 0.00 0.00 64.86 64.57 2dk8 h ILE 20 Cb -0.12 0.39 -0.03 0.00 -3.07 0.00 0.00 36.82 33.99 2dk8 h ILE 20 CO -0.06 0.09 0.30 -0.33 -0.69 0.00 0.00 178.15 177.46 2dk8 h GLU 21 N 0.51 0.76 0.09 2.37 5.08 -0.15 -0.23 114.58 123.00 2dk8 h GLU 21 Ca 0.24 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2dk8 h GLU 21 Cb 0.16 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2dk8 h GLU 21 CO -0.17 0.57 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.29 2dk8 h LEU 22 N 0.77 -0.10 -1.99 1.33 3.38 0.18 0.72 115.31 119.59 2dk8 h LEU 22 Ca 0.20 -0.50 0.27 0.00 0.09 0.00 0.00 57.88 57.94 2dk8 h LEU 22 Cb 0.03 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 2dk8 h LEU 22 CO -0.03 0.53 0.67 0.00 0.09 0.00 0.00 178.44 179.70 2dk8 h HIS 24 N 0.00 0.88 -0.15 0.00 3.86 -0.94 -3.26 115.15 115.54 2dk8 h HIS 24 Ca 0.44 -0.64 -0.05 0.00 -1.16 0.00 0.00 60.37 58.96 2dk8 h HIS 24 Cb 1.78 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 30.20 2dk8 h HIS 24 CO 0.00 1.58 -0.13 1.96 0.86 0.00 0.00 177.93 182.20 2dk8 h GLN 25 N 0.13 0.24 -4.77 2.45 1.08 0.28 -3.38 115.11 111.14 2dk8 h GLN 25 Ca -0.28 -0.06 -0.67 0.00 -1.45 0.00 0.00 58.65 56.20 2dk8 h GLN 25 Cb 2.14 -0.03 -0.37 0.00 -0.05 0.00 0.00 27.48 29.16 2dk8 h GLN 25 CO 0.24 0.38 -0.75 -0.06 -0.95 0.00 0.00 178.83 177.70 2dk8 s PHE 26 N -4.72 3.46 -0.09 2.96 0.40 0.19 -4.95 117.98 115.24 2dk8 s PHE 26 Ca -0.05 -2.52 0.25 0.00 -0.60 0.00 0.00 56.93 54.00 2dk8 s PHE 26 Cb 0.15 -2.38 0.74 0.00 0.51 0.00 0.00 43.02 42.05 2dk8 s PHE 26 CO 0.73 -0.90 1.75 -1.00 0.70 0.00 0.00 175.22 176.50 2dk8 h PRO 27 N 7.76 0.00 0.18 0.24 0.13 -1.75 -3.09 132.00 135.48 2dk8 h PRO 27 Ca -0.14 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.69 2dk8 h PRO 27 Cb 1.04 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.18 2dk8 h PRO 27 CO 0.50 0.13 -1.38 0.45 -0.23 0.00 0.00 178.00 177.48 2dk8 h HIS 28 N 0.00 0.71 0.00 1.56 3.86 -1.92 -3.44 115.15 115.91 2dk8 h HIS 28 Ca -0.00 -0.52 0.00 0.00 -1.16 0.00 0.00 60.37 58.69 2dk8 h HIS 28 Cb 0.85 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.29 2dk8 h HIS 28 CO 0.00 1.42 0.00 0.41 0.86 0.00 0.00 177.93 180.62 2dk8 n GLY 29 N 1.63 2.49 3.03 2.45 0.00 -1.17 -4.78 105.19 108.84 2dk8 n GLY 29 Ca -0.13 -1.89 -0.17 0.00 0.00 0.00 0.00 46.02 43.83 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 -1.72 0.65 0.12 -0.61 -4.36 0.52 -4.84 121.20 110.95 2dk8 s ILE 30 Ca 0.00 -0.54 -0.03 0.00 -0.26 0.00 0.00 60.65 59.82 2dk8 s ILE 30 Cb 0.00 -0.58 -0.05 0.00 1.25 0.00 0.00 42.46 43.08 2dk8 s ILE 30 CO 0.00 0.05 0.32 0.42 0.24 0.00 0.00 174.94 175.97 2dk8 s THR 31 N -0.47 5.24 0.61 8.37 -4.23 -1.26 -0.73 115.64 123.16 2dk8 s THR 31 Ca 0.00 -0.13 0.27 0.00 -1.18 0.00 0.00 61.69 60.66 2dk8 s THR 31 Cb -0.05 -3.63 0.36 0.00 1.34 0.00 0.00 72.50 70.52 2dk8 s THR 31 CO 0.00 0.06 1.66 -0.78 -0.54 0.00 0.00 174.62 175.02 2dk8 h ASP 32 N 2.85 0.00 -0.25 3.99 1.82 -1.98 0.78 116.42 123.63 2dk8 h ASP 32 Ca -0.46 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.14 2dk8 h ASP 32 Cb 1.16 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.17 2dk8 h ASP 32 CO 0.73 0.00 -0.00 1.56 -1.61 0.00 0.00 179.24 179.92 2dk8 h GLN 33 N 0.00 0.45 0.05 0.28 4.20 -1.95 -2.22 115.11 115.92 2dk8 h GLN 33 Ca 0.28 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 2dk8 h GLN 33 Cb 1.75 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 29.49 2dk8 h GLN 33 CO -0.00 0.62 -0.04 0.28 -0.67 0.00 0.00 178.83 179.01 2dk8 h VAL 34 N 0.22 0.00 -1.63 -0.54 2.07 0.21 -1.34 116.25 115.25 2dk8 h VAL 34 Ca 0.07 0.00 0.50 0.00 0.82 0.00 0.00 66.70 68.10 2dk8 h VAL 34 Cb 0.42 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.08 2dk8 h VAL 34 CO 0.01 0.00 1.12 0.40 0.02 0.00 0.00 177.57 179.13 2dk8 h ILE 35 N -0.09 0.06 0.11 4.57 2.04 -1.60 1.39 117.51 123.99 2dk8 h ILE 35 Ca -0.01 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2dk8 h ILE 35 Cb 0.08 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.19 2dk8 h ILE 35 CO 0.00 0.00 -0.05 -0.61 0.00 0.00 0.00 178.15 177.49 2dk8 h GLN 36 N 0.02 -0.15 0.00 2.37 4.15 -0.63 1.44 115.11 122.31 2dk8 h GLN 36 Ca 0.88 0.01 0.00 0.00 0.77 0.00 0.00 58.65 60.31 2dk8 h GLN 36 Cb 3.18 0.03 0.00 0.00 0.21 0.00 0.00 27.48 30.90 2dk8 h GLN 36 CO -0.22 -0.01 0.00 -0.97 -1.93 0.00 0.00 178.83 175.70 2dk8 h ASN 37 N -0.26 0.00 0.08 -0.69 -0.73 0.27 0.25 115.58 114.50 2dk8 h ASN 37 Ca -0.02 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 57.94 2dk8 h ASN 37 Cb 0.21 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.79 2dk8 h ASN 37 CO 0.03 0.00 -1.11 -0.33 -0.37 0.00 0.00 177.43 175.65 2dk8 h GLU 38 N 0.00 0.16 -1.94 6.67 4.39 0.20 -3.42 114.58 120.65 2dk8 h GLU 38 Ca 0.00 -0.28 -0.55 0.00 0.34 0.00 0.00 59.36 58.87 2dk8 h GLU 38 Cb 0.47 0.10 -0.38 0.00 -0.10 0.00 0.00 28.75 28.85 2dk8 h GLU 38 CO 0.00 1.13 -1.07 -1.33 -1.16 0.00 0.00 179.01 176.58 2dk8 n MET 39 N -4.14 0.67 0.00 2.33 2.81 0.48 -4.92 117.12 114.35 2dk8 n MET 39 Ca -0.23 -3.15 0.12 0.00 -1.81 0.00 0.00 57.70 52.63 2dk8 n MET 39 Cb 0.79 -1.26 0.67 0.00 -0.71 0.00 0.00 33.22 32.71 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 1.54 0.63 0.00 0.03 -0.04 0.86 -2.07 135.00 135.96 2dk8 n PRO 40 Ca 0.21 0.02 0.12 0.00 -0.04 0.00 0.00 63.50 63.81 2dk8 n PRO 40 Cb 0.53 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.75 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 -1.08 0.00 -2.18 0.54 1.44 -1.26 -4.89 115.22 107.78 2dk8 n HIS 41 Ca 0.16 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.55 2dk8 n HIS 41 Cb 0.11 -0.22 -0.01 0.00 0.12 0.00 0.00 29.99 29.99 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 -2.90 4.19 0.35 0.61 -1.09 -0.88 -5.03 121.20 116.44 2dk8 s ILE 42 Ca 0.13 1.02 -0.21 0.00 -2.23 0.00 0.00 60.65 59.36 2dk8 s ILE 42 Cb 0.18 -3.56 -0.10 0.00 -1.58 0.00 0.00 42.46 37.40 2dk8 s ILE 42 CO 0.67 -0.63 0.87 -1.61 -1.23 0.00 0.00 174.94 173.01 2dk8 s GLU 43 N -4.16 4.28 0.38 2.79 2.02 -1.26 -4.85 118.70 117.90 2dk8 s GLU 43 Ca 0.61 1.05 0.11 0.00 0.02 0.00 0.00 54.97 56.76 2dk8 s GLU 43 Cb -0.13 -2.50 0.90 0.00 0.10 0.00 0.00 34.13 32.50 2dk8 s GLU 43 CO 0.36 0.15 1.89 0.00 0.02 0.00 0.00 175.26 177.68 2dk8 h ALA 44 N 2.54 1.93 0.03 5.21 0.00 -1.98 0.41 119.26 127.41 2dk8 h ALA 44 Ca -0.48 0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.22 2dk8 h ALA 44 Cb 1.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2dk8 h ALA 44 CO 0.64 -0.16 -1.00 1.96 0.00 0.00 0.00 179.25 180.68 2dk8 h GLN 45 N 0.59 0.13 0.51 0.00 4.20 -1.99 -3.03 115.11 115.52 2dk8 h GLN 45 Ca 0.42 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 2dk8 h GLN 45 Cb 0.76 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.61 2dk8 h GLN 45 CO -0.17 1.02 -0.24 1.96 -0.67 0.00 0.00 178.83 180.73 2dk8 h GLN 46 N 0.05 -0.66 -0.76 1.46 4.20 -0.99 0.23 115.11 118.64 2dk8 h GLN 46 Ca -0.05 0.04 0.17 0.00 0.06 0.00 0.00 58.65 58.87 2dk8 h GLN 46 Cb 1.71 0.15 -0.11 0.00 0.30 0.00 0.00 27.48 29.52 2dk8 h GLN 46 CO 0.15 -0.36 0.21 0.00 -0.67 0.00 0.00 178.83 178.16 2dk8 h ARG 47 N -1.06 0.29 0.55 1.46 3.08 -0.48 0.44 114.38 118.66 2dk8 h ARG 47 Ca -0.07 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2dk8 h ARG 47 Cb 0.60 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.59 2dk8 h ARG 47 CO 0.11 0.19 -0.27 0.00 -1.07 0.00 0.00 179.97 178.94 2dk8 h ALA 48 N 1.63 -0.74 -0.88 0.04 0.00 -1.51 -2.05 119.26 115.75 2dk8 h ALA 48 Ca 0.44 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.23 2dk8 h ALA 48 Cb 0.76 0.29 -0.11 0.00 0.00 0.00 0.00 17.79 18.73 2dk8 h ALA 48 CO -0.51 -0.79 -0.52 0.28 0.00 0.00 0.00 179.25 177.71 2dk8 h VAL 49 N -1.01 0.00 -0.57 0.00 2.07 0.49 0.84 116.25 118.08 2dk8 h VAL 49 Ca -0.08 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.56 2dk8 h VAL 49 Cb 0.64 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.30 2dk8 h VAL 49 CO 0.13 0.00 -0.21 0.00 0.02 0.00 0.00 177.57 177.50 2dk8 h ALA 50 N 0.32 0.23 0.27 1.67 0.00 -0.96 0.64 119.26 121.41 2dk8 h ALA 50 Ca 0.14 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2dk8 h ALA 50 Cb 0.36 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 2dk8 h ALA 50 CO -0.83 -0.52 -0.36 0.82 0.00 0.00 0.00 179.25 178.37 2dk8 h ILE 51 N -0.07 0.00 -0.70 0.00 2.04 0.88 0.42 117.51 120.07 2dk8 h ILE 51 Ca 0.26 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.26 2dk8 h ILE 51 Cb 0.48 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.43 2dk8 h ILE 51 CO -0.62 0.00 -0.20 -1.13 0.00 0.00 0.00 178.15 176.20 2dk8 h ASN 52 N -0.65 -0.74 0.28 1.72 -0.73 0.13 1.23 115.58 116.83 2dk8 h ASN 52 Ca -0.03 0.22 -0.00 0.00 1.87 0.00 0.00 56.30 58.35 2dk8 h ASN 52 Cb 0.59 0.47 -0.03 0.00 0.27 0.00 0.00 38.32 39.61 2dk8 h ASN 52 CO -0.09 -0.25 -0.42 0.03 -0.37 0.00 0.00 177.43 176.33 2dk8 h ARG 53 N -0.02 -0.71 -0.92 6.67 -0.00 0.87 0.35 114.38 120.62 2dk8 h ARG 53 Ca 0.33 0.05 0.15 0.00 -0.50 0.00 0.00 59.98 60.00 2dk8 h ARG 53 Cb 0.53 0.16 -0.08 0.00 0.00 0.00 0.00 29.97 30.58 2dk8 h ARG 53 CO -0.73 -0.47 0.59 -0.07 0.00 0.00 0.00 179.97 179.28 2dk8 h LEU 54 N -0.74 0.70 -0.62 3.04 3.38 0.11 1.41 115.31 122.60 2dk8 h LEU 54 Ca -0.03 0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2dk8 h LEU 54 Cb 0.67 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2dk8 h LEU 54 CO -0.13 0.35 0.41 -0.07 0.09 0.00 0.00 178.44 179.09 2dk8 h LEU 55 N 0.74 0.69 0.11 1.67 3.38 0.26 -0.10 115.31 122.05 2dk8 h LEU 55 Ca 0.47 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.42 2dk8 h LEU 55 Cb 0.72 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2dk8 h LEU 55 CO -0.23 0.50 -0.05 -1.28 0.09 0.00 0.00 178.44 177.47 2dk8 h SER 56 N 0.82 -0.12 -1.77 -0.43 0.87 0.26 -3.28 113.55 109.90 2dk8 h SER 56 Ca 0.23 0.00 0.52 0.00 -1.23 0.00 0.00 61.79 61.32 2dk8 h SER 56 Cb -0.07 0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 61.84 2dk8 h SER 56 CO -0.06 0.31 1.25 0.23 -0.53 0.00 0.00 176.83 178.03 2dk8 n MET 57 N -4.60 -0.01 -0.44 2.24 2.81 0.46 -4.69 117.12 112.89 2dk8 n MET 57 Ca -0.02 1.04 0.00 0.00 -1.81 0.00 0.00 57.70 56.91 2dk8 n MET 57 Cb 0.06 -2.34 0.00 0.00 -0.71 0.00 0.00 33.22 30.23 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 -1.80 0.83 0.09 3.03 0.00 -0.50 -4.96 105.19 101.87 2dk8 n GLY 58 Ca 0.41 -0.43 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.23 0.66 -4.23 1.61 1.13 -0.19 -4.74 117.38 109.39 2dk8 n GLN 59 Ca 0.00 0.14 -0.28 0.00 -1.94 0.00 0.00 57.00 54.91 2dk8 n GLN 59 Cb 0.02 -1.67 -0.09 0.00 0.11 0.00 0.00 30.24 28.61 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 -5.73 3.11 -0.14 1.08 2.96 -0.40 -3.28 118.68 116.28 2dk8 s LEU 60 Ca -0.07 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.44 2dk8 s LEU 60 Cb 0.07 -1.85 0.02 0.00 0.50 0.00 0.00 46.19 44.93 2dk8 s LEU 60 CO 0.83 0.14 -0.18 -0.62 -1.32 0.00 0.00 176.35 175.20 2dk8 s ASP 61 N -2.51 2.83 0.17 3.68 2.15 0.27 -4.36 116.67 118.91 2dk8 s ASP 61 Ca 0.24 -0.54 -0.19 0.00 0.43 0.00 0.00 52.55 52.48 2dk8 s ASP 61 Cb -0.10 -1.29 -0.08 0.00 -0.30 0.00 0.00 42.92 41.15 2dk8 s ASP 61 CO 0.15 0.01 0.67 -0.22 -0.17 0.00 0.00 175.17 175.62 2dk8 s LEU 62 N 1.14 4.41 -0.23 -1.34 0.20 -1.26 -0.39 118.68 121.21 2dk8 s LEU 62 Ca -0.01 1.37 -0.04 0.00 0.69 0.00 0.00 54.13 56.14 2dk8 s LEU 62 Cb -0.14 -3.37 0.09 0.00 -0.43 0.00 0.00 46.19 42.34 2dk8 s LEU 62 CO -0.07 0.11 0.17 -0.76 -0.29 0.00 0.00 176.35 175.52 2dk8 s LEU 63 N -1.70 0.17 -0.47 -0.68 1.43 -0.26 -4.96 118.68 112.21 2dk8 s LEU 63 Ca 0.39 -0.71 -0.29 0.00 -1.03 0.00 0.00 54.13 52.49 2dk8 s LEU 63 Cb -0.18 0.04 0.02 0.00 0.03 0.00 0.00 46.19 46.09 2dk8 s LEU 63 CO 0.21 -0.38 1.35 -0.13 0.23 0.00 0.00 176.35 177.64 2dk8 s ARG 64 N 2.22 3.52 0.00 1.70 0.52 -1.26 -0.04 118.95 125.62 2dk8 s ARG 64 Ca 0.07 0.71 0.00 0.00 -0.52 0.00 0.00 55.73 55.98 2dk8 s ARG 64 Cb -0.16 -4.03 0.00 0.00 0.52 0.00 0.00 34.95 31.28 2dk8 s ARG 64 CO -0.22 -1.64 0.00 0.45 0.02 0.00 0.00 175.30 173.91 2dk8 n SER 65 N 8.83 0.00 -3.52 0.23 2.88 -1.25 -4.98 113.62 115.81 2dk8 n SER 65 Ca 0.14 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.59 2dk8 n SER 65 Cb 0.49 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.93 2dk8 n SER 65 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2dk8 s ASN 66 N -0.32 -0.41 -1.61 -3.46 3.84 -1.26 -4.96 114.94 106.77 2dk8 s ASN 66 Ca 0.00 -0.08 -0.08 0.00 0.21 0.00 0.00 52.86 52.91 2dk8 s ASN 66 Cb 0.00 0.49 0.08 0.00 -0.55 0.00 0.00 41.25 41.27 2dk8 s ASN 66 CO 0.00 -0.81 0.39 0.41 -2.79 0.00 0.00 177.10 174.30 2dk8 n THR 67 N -0.33 -1.39 0.00 -5.21 -1.04 -1.26 -4.50 114.28 100.55 2dk8 n THR 67 Ca -0.11 -0.30 0.00 0.00 -2.04 0.00 0.00 64.05 61.60 2dk8 n THR 67 Cb 0.63 -1.51 0.00 0.00 -1.82 0.00 0.00 70.33 67.62 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 -1.89 0.47 3.50 3.41 0.00 -1.26 -5.07 105.19 104.34 2dk8 n GLY 68 Ca -0.16 -2.25 -0.24 0.00 0.00 0.00 0.00 46.02 43.37 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 2.62 0.28 0.99 1.43 -1.26 -3.93 118.68 118.82 2dk8 s LEU 69 Ca 0.00 -1.21 0.10 0.00 -1.03 0.00 0.00 54.13 52.00 2dk8 s LEU 69 Cb 0.00 -0.84 -0.05 0.00 0.03 0.00 0.00 46.19 45.34 2dk8 s LEU 69 CO 0.00 -0.28 -0.07 -0.22 0.23 0.00 0.00 176.35 176.01 2dk8 s LEU 70 N -3.54 2.94 -0.06 1.79 0.20 0.95 -4.43 118.68 116.52 2dk8 s LEU 70 Ca 0.32 -0.85 -0.01 0.00 0.69 0.00 0.00 54.13 54.28 2dk8 s LEU 70 Cb 0.03 -1.43 0.03 0.00 -0.43 0.00 0.00 46.19 44.39 2dk8 s LEU 70 CO 0.15 -0.03 0.01 -0.31 -0.29 0.00 0.00 176.35 175.88 2dk8 s TYR 71 N -2.43 0.49 0.33 5.38 2.02 0.09 -1.10 117.35 122.13 2dk8 s TYR 71 Ca 0.32 -0.05 0.04 0.00 -0.37 0.00 0.00 57.07 57.01 2dk8 s TYR 71 Cb -0.05 -0.68 -0.03 0.00 -0.40 0.00 0.00 41.96 40.79 2dk8 s TYR 71 CO 0.18 -0.27 0.18 -0.98 -1.57 0.00 0.00 175.55 173.09 2dk8 s ARG 72 N 1.90 1.69 0.11 -0.62 1.70 0.48 0.19 118.95 124.39 2dk8 s ARG 72 Ca 0.03 -1.98 -0.31 0.00 -0.47 0.00 0.00 55.73 53.00 2dk8 s ARG 72 Cb -0.12 -0.09 -0.07 0.00 -0.57 0.00 0.00 34.95 34.09 2dk8 s ARG 72 CO -0.04 -0.50 1.32 0.42 -1.08 0.00 0.00 175.30 175.41 2dk8 s ILE 73 N -3.51 3.54 0.43 4.99 -1.09 -1.23 0.95 121.20 125.28 2dk8 s ILE 73 Ca 0.35 1.12 -0.24 0.00 -2.23 0.00 0.00 60.65 59.64 2dk8 s ILE 73 Cb 0.04 -3.72 -0.08 0.00 -1.58 0.00 0.00 42.46 37.12 2dk8 s ILE 73 CO 0.19 0.10 1.22 -0.75 -1.23 0.00 0.00 174.94 174.46 2dk8 s LYS 74 N 0.96 3.87 -0.44 2.79 2.20 -1.20 -4.64 119.74 123.28 2dk8 s LYS 74 Ca 0.62 1.93 -0.34 0.00 -0.36 0.00 0.00 55.97 57.82 2dk8 s LYS 74 Cb -0.34 -2.58 -0.12 0.00 -1.51 0.00 0.00 37.83 33.27 2dk8 s LYS 74 CO 0.31 -0.50 2.27 -0.25 -0.36 0.00 0.00 175.35 176.82 2dk8 n ASP 75 N -0.17 1.95 -4.14 1.43 9.92 -1.26 -4.89 116.55 119.40 2dk8 n ASP 75 Ca 0.05 0.27 -0.09 0.00 -0.53 0.00 0.00 54.79 54.49 2dk8 n ASP 75 Cb 0.46 -1.26 -0.10 0.00 -0.64 0.00 0.00 41.12 39.58 2dk8 n ASP 75 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 2dk8 s SER 76 N 8.11 0.34 0.00 -2.24 0.15 -1.26 -5.15 113.70 113.65 2dk8 s SER 76 Ca 1.11 -1.17 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2dk8 s SER 76 Cb -0.82 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 63.77 2dk8 s SER 76 CO 0.46 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.81 2dk8 n GLY 77 N -0.06 1.98 3.79 9.45 0.00 -1.26 -5.16 105.19 113.94 2dk8 n GLY 77 Ca -0.07 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 2dk8 n GLY 77 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dk8 s PRO 78 N -2.00 3.90 0.01 1.61 0.04 -1.26 -5.06 135.00 132.24 2dk8 s PRO 78 Ca 0.00 1.41 0.06 0.00 0.04 0.00 0.00 61.00 62.51 2dk8 s PRO 78 Cb 0.00 -2.22 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 2dk8 s PRO 78 CO 0.00 -0.35 -0.17 0.45 0.04 0.00 0.00 177.00 176.97 2dk8 s SER 79 N -1.86 3.81 -0.96 6.66 0.15 -1.26 -5.05 113.70 115.20 2dk8 s SER 79 Ca 0.65 -0.35 -0.24 0.00 0.70 0.00 0.00 55.95 56.70 2dk8 s SER 79 Cb -0.18 -0.67 0.01 0.00 -1.71 0.00 0.00 66.02 63.47 2dk8 s SER 79 CO 0.22 0.29 1.66 -0.94 1.20 0.00 0.00 173.24 175.67 2dk8 s SER 80 N -1.15 5.89 0.00 5.45 1.04 -1.26 -5.37 113.70 118.30 2dk8 s SER 80 Ca 0.13 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.50 2dk8 s SER 80 Cb -0.10 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.45 2dk8 s SER 80 CO 0.03 -2.06 0.00 0.61 0.98 0.00 0.00 173.24 172.81