#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 0.61 -0.09 1.61 0.15 -1.26 -5.04 113.70 109.69 2dk8 s SER 2 Ca 0.00 -0.36 -0.11 0.00 0.70 0.00 0.00 55.95 56.18 2dk8 s SER 2 Cb 0.00 0.99 -0.09 0.00 -1.71 0.00 0.00 66.02 65.22 2dk8 s SER 2 CO 0.00 -0.35 0.39 -1.28 1.20 0.00 0.00 173.24 173.20 2dk8 h SER 3 N 8.18 -0.11 0.00 5.45 0.87 -2.10 -3.50 113.55 122.34 2dk8 h SER 3 Ca -0.11 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 2dk8 h SER 3 Cb 1.12 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2dk8 h SER 3 CO 0.28 0.47 0.00 0.61 -0.53 0.00 0.00 176.83 177.66 2dk8 n GLY 4 N 1.31 2.48 0.28 5.77 0.00 -1.26 -4.95 105.19 108.80 2dk8 n GLY 4 Ca -0.04 -1.03 0.02 0.00 0.00 0.00 0.00 46.02 44.97 2dk8 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dk8 h SER 5 N 0.00 0.48 0.00 1.61 0.02 -2.05 -3.43 113.55 110.18 2dk8 h SER 5 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2dk8 h SER 5 Cb 0.00 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2dk8 h SER 5 CO 0.00 0.27 0.00 -1.20 -1.14 0.00 0.00 176.83 174.76 2dk8 n SER 6 N -4.86 0.00 0.00 3.07 7.64 -1.26 -4.83 113.62 113.39 2dk8 n SER 6 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.00 2dk8 n SER 6 Cb 0.29 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 2dk8 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dk8 n GLY 7 N 0.00 1.14 3.49 0.23 0.00 -1.26 -4.93 105.19 103.86 2dk8 n GLY 7 Ca 0.00 -2.16 -0.37 0.00 0.00 0.00 0.00 46.02 43.49 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 -1.40 2.39 0.00 1.61 -0.04 -1.26 -4.77 135.00 131.53 2dk8 n PRO 8 Ca 0.00 -2.80 0.00 0.00 -0.04 0.00 0.00 63.50 60.66 2dk8 n PRO 8 Cb 0.00 -3.54 0.00 0.00 -0.04 0.00 0.00 33.50 29.92 2dk8 n PRO 8 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dk8 n ASP 9 N 10.70 0.00 -4.59 3.54 8.00 -1.26 -5.07 116.55 127.87 2dk8 n ASP 9 Ca 0.48 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.55 2dk8 n ASP 9 Cb 0.45 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 2dk8 n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dk8 s ALA 10 N -2.00 2.77 1.00 2.24 0.00 -1.26 -4.94 121.76 119.57 2dk8 s ALA 10 Ca 0.00 0.21 -0.18 0.00 0.00 0.00 0.00 51.96 51.99 2dk8 s ALA 10 Cb 0.00 -4.05 -0.11 0.00 0.00 0.00 0.00 23.12 18.96 2dk8 s ALA 10 CO 0.00 -2.80 -0.65 -0.25 0.00 0.00 0.00 175.76 172.06 2dk8 n ASP 11 N 10.73 -4.63 0.08 0.00 9.92 -1.26 -4.79 116.55 126.60 2dk8 n ASP 11 Ca 0.23 0.16 -0.04 0.00 -0.53 0.00 0.00 54.79 54.62 2dk8 n ASP 11 Cb 0.47 -0.81 -0.02 0.00 -0.64 0.00 0.00 41.12 40.12 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 -1.16 -0.27 -0.74 -0.24 0.13 -1.98 -3.00 132.00 124.74 2dk8 h PRO 12 Ca -0.44 0.02 0.14 0.00 -0.87 0.00 0.00 66.00 64.85 2dk8 h PRO 12 Cb 1.32 0.06 -0.14 0.00 0.13 0.00 0.00 31.00 32.37 2dk8 h PRO 12 CO 0.26 -0.18 -0.27 -0.24 -0.23 0.00 0.00 178.00 177.34 2dk8 h VAL 13 N -0.88 0.17 -0.41 1.56 3.04 -1.99 0.14 116.25 117.88 2dk8 h VAL 13 Ca -0.03 0.00 0.07 0.00 -1.01 0.00 0.00 66.70 65.73 2dk8 h VAL 13 Cb 0.21 0.17 -0.09 0.00 -2.01 0.00 0.00 31.29 29.57 2dk8 h VAL 13 CO 0.05 0.00 -0.42 -0.08 -1.01 0.00 0.00 177.57 176.10 2dk8 h GLU 14 N -0.06 -0.31 -0.15 4.17 4.22 -1.93 0.67 114.58 121.19 2dk8 h GLU 14 Ca 0.32 0.02 0.04 0.00 0.08 0.00 0.00 59.36 59.82 2dk8 h GLU 14 Cb 0.57 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 2dk8 h GLU 14 CO -0.79 -0.21 -0.47 0.82 -2.18 0.00 0.00 179.01 176.19 2dk8 h ILE 15 N -0.32 0.08 0.10 2.32 2.04 -0.63 0.35 117.51 121.46 2dk8 h ILE 15 Ca 0.14 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.02 2dk8 h ILE 15 Cb 0.58 0.08 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 2dk8 h ILE 15 CO -0.57 0.00 -0.52 -0.33 0.00 0.00 0.00 178.15 176.72 2dk8 h GLU 16 N -0.52 -0.71 -0.97 2.37 5.08 -0.02 -1.35 114.58 118.46 2dk8 h GLU 16 Ca 0.06 0.05 0.19 0.00 -1.00 0.00 0.00 59.36 58.66 2dk8 h GLU 16 Cb 0.65 0.16 -0.18 0.00 0.50 0.00 0.00 28.75 29.88 2dk8 h GLU 16 CO -0.42 -0.47 -0.27 -0.91 -1.00 0.00 0.00 179.01 175.93 2dk8 h ASN 17 N -0.74 -1.01 -0.66 1.42 2.35 0.86 0.89 115.58 118.69 2dk8 h ASN 17 Ca 0.00 0.29 0.13 0.00 -0.55 0.00 0.00 56.30 56.18 2dk8 h ASN 17 Cb 0.75 0.63 -0.13 0.00 0.05 0.00 0.00 38.32 39.63 2dk8 h ASN 17 CO -0.30 -0.31 -0.18 0.03 -1.65 0.00 0.00 177.43 175.02 2dk8 h ARG 18 N -0.00 -0.01 -0.82 0.81 2.47 0.20 0.55 114.38 117.57 2dk8 h ARG 18 Ca 0.44 0.00 0.05 0.00 -1.26 0.00 0.00 59.98 59.21 2dk8 h ARG 18 Cb 0.69 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.95 2dk8 h ARG 18 CO -0.99 -0.01 0.51 0.82 0.56 0.00 0.00 179.97 180.86 2dk8 h ILE 19 N -0.01 1.06 -0.16 2.04 2.04 0.11 -1.39 117.51 121.20 2dk8 h ILE 19 Ca 0.32 -0.33 0.03 0.00 1.00 0.00 0.00 64.86 65.88 2dk8 h ILE 19 Cb 0.50 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 2dk8 h ILE 19 CO -0.69 0.17 -0.04 0.40 0.00 0.00 0.00 178.15 178.00 2dk8 h ILE 20 N 0.95 0.85 -0.74 -0.67 1.08 0.12 0.85 117.51 119.94 2dk8 h ILE 20 Ca 0.35 -0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.94 2dk8 h ILE 20 Cb 0.12 0.84 -0.05 0.00 -3.07 0.00 0.00 36.82 34.67 2dk8 h ILE 20 CO -0.16 0.00 0.49 -0.33 -0.69 0.00 0.00 178.15 177.47 2dk8 h GLU 21 N 0.01 0.51 0.17 2.37 4.39 0.08 -0.15 114.58 121.96 2dk8 h GLU 21 Ca 0.08 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 2dk8 h GLU 21 Cb 0.11 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2dk8 h GLU 21 CO -0.16 0.34 -0.08 -0.07 -1.16 0.00 0.00 179.01 177.88 2dk8 h LEU 22 N 0.53 -0.19 -1.91 1.33 3.38 -0.11 -1.43 115.31 116.91 2dk8 h LEU 22 Ca 0.36 -0.21 0.42 0.00 0.09 0.00 0.00 57.88 58.54 2dk8 h LEU 22 Cb 0.66 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.40 2dk8 h LEU 22 CO -0.12 0.36 1.10 0.00 0.09 0.00 0.00 178.44 179.86 2dk8 h HIS 24 N 0.00 0.47 -0.00 0.00 3.86 -0.99 -3.27 115.15 115.22 2dk8 h HIS 24 Ca 0.69 -0.33 -0.02 0.00 -1.16 0.00 0.00 60.37 59.54 2dk8 h HIS 24 Cb 2.88 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 31.33 2dk8 h HIS 24 CO 0.00 1.25 -0.12 1.96 0.86 0.00 0.00 177.93 181.88 2dk8 h GLN 25 N -0.44 0.00 -4.38 2.45 1.08 0.32 -3.36 115.11 110.78 2dk8 h GLN 25 Ca -0.11 -0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.45 2dk8 h GLN 25 Cb 1.51 -0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 28.55 2dk8 h GLN 25 CO 0.13 0.12 -0.75 -0.06 -0.95 0.00 0.00 178.83 177.31 2dk8 s PHE 26 N -4.80 2.93 0.11 2.96 0.40 0.22 -4.96 117.98 114.85 2dk8 s PHE 26 Ca -0.04 -2.35 0.15 0.00 -0.60 0.00 0.00 56.93 54.09 2dk8 s PHE 26 Cb 0.16 -2.22 0.35 0.00 0.51 0.00 0.00 43.02 41.83 2dk8 s PHE 26 CO 0.69 -0.88 1.58 -1.00 0.70 0.00 0.00 175.22 176.31 2dk8 h PRO 27 N 7.82 0.00 -0.30 0.24 0.13 -1.73 -3.16 132.00 135.00 2dk8 h PRO 27 Ca -0.11 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.87 2dk8 h PRO 27 Cb 1.03 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 2dk8 h PRO 27 CO 0.48 0.54 -0.38 0.45 -0.23 0.00 0.00 178.00 178.86 2dk8 h HIS 28 N 0.00 0.96 0.00 1.56 3.86 -1.93 -3.42 115.15 116.18 2dk8 h HIS 28 Ca -0.01 -0.31 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 2dk8 h HIS 28 Cb 1.17 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 29.45 2dk8 h HIS 28 CO 0.00 1.09 0.00 0.41 0.86 0.00 0.00 177.93 180.29 2dk8 n GLY 29 N 0.23 2.78 3.24 2.45 0.00 -1.19 -4.75 105.19 107.95 2dk8 n GLY 29 Ca -0.04 -1.80 -0.13 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.82 0.79 0.09 -0.61 -4.36 0.50 -4.83 121.20 110.97 2dk8 s ILE 30 Ca 0.00 -1.99 0.09 0.00 -0.26 0.00 0.00 60.65 58.49 2dk8 s ILE 30 Cb 0.00 -2.02 -0.04 0.00 1.25 0.00 0.00 42.46 41.65 2dk8 s ILE 30 CO 0.00 -0.57 -0.21 0.42 0.24 0.00 0.00 174.94 174.82 2dk8 s THR 31 N -3.58 2.61 0.56 8.37 -4.23 -1.26 0.51 115.64 118.62 2dk8 s THR 31 Ca 0.21 -1.48 0.49 0.00 -1.18 0.00 0.00 61.69 59.74 2dk8 s THR 31 Cb 0.05 -2.15 0.73 0.00 1.34 0.00 0.00 72.50 72.47 2dk8 s THR 31 CO 0.02 0.18 1.57 -0.78 -0.54 0.00 0.00 174.62 175.08 2dk8 h ASP 32 N 4.08 0.00 0.94 3.99 3.58 -1.98 0.62 116.42 127.64 2dk8 h ASP 32 Ca -0.49 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 56.91 2dk8 h ASP 32 Cb 1.16 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.22 2dk8 h ASP 32 CO 0.44 0.00 -0.45 1.56 -2.88 0.00 0.00 179.24 177.91 2dk8 h GLN 33 N 0.00 -1.21 0.00 0.28 4.20 -1.94 -2.00 115.11 114.44 2dk8 h GLN 33 Ca 0.91 0.08 0.00 0.00 0.06 0.00 0.00 58.65 59.70 2dk8 h GLN 33 Cb 3.70 0.28 0.00 0.00 0.30 0.00 0.00 27.48 31.76 2dk8 h GLN 33 CO -0.01 -0.81 0.00 0.28 -0.67 0.00 0.00 178.83 177.62 2dk8 n VAL 34 N -5.54 0.00 -0.59 -0.54 0.31 0.21 0.12 118.33 112.30 2dk8 n VAL 34 Ca -0.16 1.48 0.47 0.00 -0.01 0.00 0.00 64.34 66.12 2dk8 n VAL 34 Cb 0.50 -2.07 0.75 0.00 -0.91 0.00 0.00 33.84 32.11 2dk8 n VAL 34 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2dk8 n ILE 35 N -2.75 -0.13 0.17 2.52 5.41 -1.14 0.18 119.36 123.61 2dk8 n ILE 35 Ca 0.00 1.65 -0.07 0.00 1.00 0.00 0.00 62.75 65.33 2dk8 n ILE 35 Cb 0.00 -2.73 -0.03 0.00 -0.71 0.00 0.00 39.64 36.17 2dk8 n ILE 35 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2dk8 h GLN 36 N 0.00 -0.43 -0.57 0.38 -0.00 0.17 1.46 115.11 116.12 2dk8 h GLN 36 Ca 0.91 0.03 0.02 0.00 -0.00 0.00 0.00 58.65 59.61 2dk8 h GLN 36 Cb 3.29 0.10 -0.03 0.00 0.00 0.00 0.00 27.48 30.84 2dk8 h GLN 36 CO -0.25 -0.29 0.38 -0.91 0.00 0.00 0.00 178.83 177.76 2dk8 h ASN 37 N -0.59 0.60 -0.22 -0.69 2.35 0.21 1.10 115.58 118.32 2dk8 h ASN 37 Ca -0.05 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.59 2dk8 h ASN 37 Cb 0.34 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 2dk8 h ASN 37 CO 0.07 0.42 -0.29 -0.33 -1.65 0.00 0.00 177.43 175.66 2dk8 h GLU 38 N 0.70 0.59 -2.08 0.81 4.39 0.18 -3.37 114.58 115.80 2dk8 h GLU 38 Ca 0.22 -0.34 -0.57 0.00 0.34 0.00 0.00 59.36 59.02 2dk8 h GLU 38 Cb 0.03 0.02 -0.40 0.00 -0.10 0.00 0.00 28.75 28.31 2dk8 h GLU 38 CO -0.06 0.94 -0.90 -1.33 -1.16 0.00 0.00 179.01 176.50 2dk8 n MET 39 N -4.33 1.50 0.00 2.33 2.81 0.50 -4.89 117.12 115.04 2dk8 n MET 39 Ca -0.05 -3.83 0.12 0.00 -1.81 0.00 0.00 57.70 52.12 2dk8 n MET 39 Cb 0.47 -1.67 0.68 0.00 -0.71 0.00 0.00 33.22 31.99 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 1.07 0.75 -0.18 0.03 -0.04 0.37 -2.19 135.00 134.82 2dk8 n PRO 40 Ca 0.25 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.81 2dk8 n PRO 40 Cb 0.49 -1.48 0.27 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.98 0.47 -3.16 0.54 1.44 -1.26 -4.91 115.22 107.36 2dk8 n HIS 41 Ca 0.17 -0.24 -0.20 0.00 -2.01 0.00 0.00 57.72 55.45 2dk8 n HIS 41 Cb 0.08 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.20 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 -1.53 3.72 0.23 0.61 -1.09 -0.93 -4.95 121.20 117.26 2dk8 s ILE 42 Ca 0.35 -0.82 0.05 0.00 -2.23 0.00 0.00 60.65 58.00 2dk8 s ILE 42 Cb 0.19 -3.32 -0.03 0.00 -1.58 0.00 0.00 42.46 37.73 2dk8 s ILE 42 CO 0.27 -0.16 0.35 -1.61 -1.23 0.00 0.00 174.94 172.56 2dk8 s GLU 43 N -4.38 3.44 0.09 2.79 0.41 -1.26 -4.94 118.70 114.85 2dk8 s GLU 43 Ca 0.49 -0.73 -0.22 0.00 -0.41 0.00 0.00 54.97 54.09 2dk8 s GLU 43 Cb -0.10 -2.90 -0.14 0.00 -1.78 0.00 0.00 34.13 29.21 2dk8 s GLU 43 CO 0.34 0.44 1.74 0.00 -0.49 0.00 0.00 175.26 177.29 2dk8 h ALA 44 N 1.33 0.05 -0.33 5.21 0.00 -1.99 0.71 119.26 124.24 2dk8 h ALA 44 Ca -0.51 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 2dk8 h ALA 44 Cb 1.22 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2dk8 h ALA 44 CO 0.62 -0.45 -0.15 1.96 0.00 0.00 0.00 179.25 181.23 2dk8 h GLN 45 N 0.04 0.69 -0.78 0.00 4.20 -1.99 -2.12 115.11 115.15 2dk8 h GLN 45 Ca 0.01 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.43 2dk8 h GLN 45 Cb 0.01 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 2dk8 h GLN 45 CO -0.00 0.89 0.50 1.96 -0.67 0.00 0.00 178.83 181.50 2dk8 h GLN 46 N 0.46 1.03 -0.40 1.46 1.08 -1.90 0.47 115.11 117.31 2dk8 h GLN 46 Ca 0.07 -0.08 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2dk8 h GLN 46 Cb 0.68 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 27.87 2dk8 h GLN 46 CO 0.05 0.70 0.24 0.00 -0.95 0.00 0.00 178.83 178.87 2dk8 h ARG 47 N 1.06 0.54 0.43 1.46 3.08 0.55 -1.38 114.38 120.13 2dk8 h ARG 47 Ca 0.28 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.26 2dk8 h ARG 47 Cb -0.09 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 29.85 2dk8 h ARG 47 CO -0.06 0.41 -0.21 0.00 -1.07 0.00 0.00 179.97 179.04 2dk8 h ALA 48 N 1.10 -0.58 -0.35 0.04 0.00 -0.90 -1.85 119.26 116.73 2dk8 h ALA 48 Ca 0.14 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2dk8 h ALA 48 Cb 0.01 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2dk8 h ALA 48 CO -0.03 -0.67 -0.22 0.28 0.00 0.00 0.00 179.25 178.61 2dk8 h VAL 49 N -0.88 0.00 -0.77 0.00 2.07 0.01 1.62 116.25 118.30 2dk8 h VAL 49 Ca -0.06 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.64 2dk8 h VAL 49 Cb 0.56 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.20 2dk8 h VAL 49 CO 0.10 0.00 0.01 0.00 0.02 0.00 0.00 177.57 177.69 2dk8 h ALA 50 N -0.48 0.80 0.54 1.67 0.00 -1.30 0.54 119.26 121.02 2dk8 h ALA 50 Ca 0.06 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 2dk8 h ALA 50 Cb 0.17 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2dk8 h ALA 50 CO -0.34 -0.43 -0.35 0.82 0.00 0.00 0.00 179.25 178.95 2dk8 h ILE 51 N 0.10 0.00 -0.92 0.00 2.04 0.86 0.17 117.51 119.75 2dk8 h ILE 51 Ca 0.42 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.55 2dk8 h ILE 51 Cb 0.74 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.68 2dk8 h ILE 51 CO -0.67 0.00 0.33 -1.13 0.00 0.00 0.00 178.15 176.68 2dk8 h ASN 52 N -0.84 0.14 0.75 1.72 -0.73 0.34 0.55 115.58 117.52 2dk8 h ASN 52 Ca -0.07 0.20 -0.04 0.00 1.87 0.00 0.00 56.30 58.26 2dk8 h ASN 52 Cb 0.68 0.24 0.00 0.00 0.27 0.00 0.00 38.32 39.51 2dk8 h ASN 52 CO 0.06 -0.16 -0.40 0.03 -0.37 0.00 0.00 177.43 176.60 2dk8 h ARG 53 N 0.23 -1.01 -0.92 6.67 3.08 0.58 0.39 114.38 123.40 2dk8 h ARG 53 Ca 0.61 0.07 0.18 0.00 0.07 0.00 0.00 59.98 60.92 2dk8 h ARG 53 Cb 1.31 0.23 -0.11 0.00 0.08 0.00 0.00 29.97 31.48 2dk8 h ARG 53 CO -0.65 -0.67 0.49 -0.07 -1.07 0.00 0.00 179.97 178.00 2dk8 h LEU 54 N -1.05 0.58 0.34 3.04 3.38 0.12 1.43 115.31 123.13 2dk8 h LEU 54 Ca -0.10 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2dk8 h LEU 54 Cb 0.82 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 2dk8 h LEU 54 CO 0.14 0.18 -0.32 -0.07 0.09 0.00 0.00 178.44 178.46 2dk8 h LEU 55 N 0.61 -0.88 0.64 1.67 3.38 0.37 -0.19 115.31 120.92 2dk8 h LEU 55 Ca 0.54 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.54 2dk8 h LEU 55 Cb 0.87 0.29 0.01 0.00 0.09 0.00 0.00 40.66 41.91 2dk8 h LEU 55 CO -0.42 -0.43 -0.31 0.28 0.09 0.00 0.00 178.44 177.65 2dk8 h SER 56 N -0.65 -0.75 -0.87 -0.43 0.02 0.04 -2.65 113.55 108.26 2dk8 h SER 56 Ca -0.04 0.03 0.29 0.00 -0.84 0.00 0.00 61.79 61.23 2dk8 h SER 56 Cb 0.56 0.20 -0.16 0.00 0.14 0.00 0.00 62.40 63.14 2dk8 h SER 56 CO -0.03 -0.53 0.21 0.23 -1.14 0.00 0.00 176.83 175.57 2dk8 n MET 57 N -5.47 -0.06 0.00 3.45 2.81 0.48 -4.75 117.12 113.58 2dk8 n MET 57 Ca -0.13 1.27 0.00 0.00 -1.81 0.00 0.00 57.70 57.02 2dk8 n MET 57 Cb 0.36 -2.12 0.00 0.00 -0.71 0.00 0.00 33.22 30.75 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 -1.35 1.17 0.11 3.03 0.00 -0.21 -4.99 105.19 102.96 2dk8 n GLY 58 Ca 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.56 0.68 -4.09 1.61 1.13 -0.47 -4.74 117.38 109.95 2dk8 n GLN 59 Ca 0.00 0.20 -0.29 0.00 -1.94 0.00 0.00 57.00 54.97 2dk8 n GLN 59 Cb 0.00 -1.67 -0.07 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 -6.31 3.65 -0.15 1.08 2.96 -0.65 -2.42 118.68 116.84 2dk8 s LEU 60 Ca -0.16 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.65 2dk8 s LEU 60 Cb 0.07 -2.34 0.02 0.00 0.50 0.00 0.00 46.19 44.44 2dk8 s LEU 60 CO 0.77 0.15 -0.19 -0.62 -1.32 0.00 0.00 176.35 175.15 2dk8 s ASP 61 N -2.53 2.93 -0.07 3.68 2.15 0.73 -4.29 116.67 119.27 2dk8 s ASP 61 Ca 0.28 -0.57 -0.23 0.00 0.43 0.00 0.00 52.55 52.46 2dk8 s ASP 61 Cb -0.11 -1.35 -0.04 0.00 -0.30 0.00 0.00 42.92 41.12 2dk8 s ASP 61 CO 0.21 0.01 0.68 -0.22 -0.17 0.00 0.00 175.17 175.69 2dk8 s LEU 62 N 1.14 4.31 -0.26 -1.34 0.20 -1.26 -1.14 118.68 120.34 2dk8 s LEU 62 Ca -0.00 1.16 0.00 0.00 0.69 0.00 0.00 54.13 55.98 2dk8 s LEU 62 Cb -0.14 -3.05 0.08 0.00 -0.43 0.00 0.00 46.19 42.64 2dk8 s LEU 62 CO -0.08 -0.11 0.02 -0.76 -0.29 0.00 0.00 176.35 175.14 2dk8 s LEU 63 N 0.79 2.50 -0.48 -0.68 1.43 0.39 -4.97 118.68 117.67 2dk8 s LEU 63 Ca 0.37 -1.37 -0.29 0.00 -1.03 0.00 0.00 54.13 51.80 2dk8 s LEU 63 Cb -0.18 -1.04 0.02 0.00 0.03 0.00 0.00 46.19 45.03 2dk8 s LEU 63 CO 0.17 -0.32 1.26 -0.13 0.23 0.00 0.00 176.35 177.57 2dk8 s ARG 64 N 1.48 3.61 0.36 1.70 3.00 -1.26 0.12 118.95 127.96 2dk8 s ARG 64 Ca 0.02 0.64 0.06 0.00 0.00 0.00 0.00 55.73 56.45 2dk8 s ARG 64 Cb -0.18 -3.98 -0.02 0.00 0.00 0.00 0.00 34.95 30.77 2dk8 s ARG 64 CO -0.12 -1.53 0.23 0.45 0.00 0.00 0.00 175.30 174.33 2dk8 n SER 65 N 8.40 0.05 -4.63 0.23 2.88 -1.24 -4.96 113.62 114.36 2dk8 n SER 65 Ca 0.13 -3.20 -0.44 0.00 -1.33 0.00 0.00 58.87 54.04 2dk8 n SER 65 Cb 0.49 1.43 -0.01 0.00 -0.75 0.00 0.00 64.21 65.36 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 -1.62 1.87 -2.45 -3.46 5.15 -1.26 -4.09 115.26 109.40 2dk8 n ASN 66 Ca 0.02 1.19 -0.03 0.00 -0.60 0.00 0.00 54.58 55.16 2dk8 n ASN 66 Cb 0.61 -1.36 -0.03 0.00 -0.53 0.00 0.00 39.78 38.47 2dk8 n ASN 66 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2dk8 n THR 67 N 0.28-11.03 -2.64 -0.44 -1.04 -1.26 -4.85 114.28 93.31 2dk8 n THR 67 Ca 0.08 2.06 0.00 0.00 -2.04 0.00 0.00 64.05 64.15 2dk8 n THR 67 Cb 0.33 -6.22 0.00 0.00 -1.82 0.00 0.00 70.33 62.62 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 1.12 -0.03 3.97 3.41 0.00 -1.26 -4.80 105.19 107.61 2dk8 n GLY 68 Ca -0.23 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 44.95 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 3.92 0.10 0.99 1.43 -1.26 -3.68 118.68 120.19 2dk8 s LEU 69 Ca 0.00 -0.23 0.10 0.00 -1.03 0.00 0.00 54.13 52.97 2dk8 s LEU 69 Cb 0.00 -2.68 -0.04 0.00 0.03 0.00 0.00 46.19 43.50 2dk8 s LEU 69 CO 0.00 -0.42 -0.26 -0.22 0.23 0.00 0.00 176.35 175.68 2dk8 s LEU 70 N -4.15 2.28 -0.09 1.79 0.20 0.32 -4.39 118.68 114.63 2dk8 s LEU 70 Ca 0.45 -0.70 0.01 0.00 0.69 0.00 0.00 54.13 54.58 2dk8 s LEU 70 Cb -0.09 -1.18 0.02 0.00 -0.43 0.00 0.00 46.19 44.51 2dk8 s LEU 70 CO 0.31 0.18 -0.10 -0.31 -0.29 0.00 0.00 176.35 176.13 2dk8 s TYR 71 N -1.00 1.51 0.36 5.38 2.02 0.18 0.15 117.35 125.95 2dk8 s TYR 71 Ca 0.12 -0.66 0.05 0.00 -0.37 0.00 0.00 57.07 56.21 2dk8 s TYR 71 Cb -0.10 -1.17 -0.03 0.00 -0.40 0.00 0.00 41.96 40.27 2dk8 s TYR 71 CO 0.05 -0.40 0.19 -0.98 -1.57 0.00 0.00 175.55 172.84 2dk8 s ARG 72 N 1.14 1.81 0.09 -0.62 1.70 -0.29 0.19 118.95 122.97 2dk8 s ARG 72 Ca -0.05 -2.08 -0.31 0.00 -0.47 0.00 0.00 55.73 52.82 2dk8 s ARG 72 Cb -0.14 -0.17 -0.07 0.00 -0.57 0.00 0.00 34.95 34.00 2dk8 s ARG 72 CO -0.02 -0.54 1.32 0.42 -1.08 0.00 0.00 175.30 175.39 2dk8 s ILE 73 N -3.37 3.60 0.68 4.99 -1.09 -1.25 -0.19 121.20 124.57 2dk8 s ILE 73 Ca 0.32 1.14 -0.16 0.00 -2.23 0.00 0.00 60.65 59.72 2dk8 s ILE 73 Cb 0.03 -3.73 0.01 0.00 -1.58 0.00 0.00 42.46 37.19 2dk8 s ILE 73 CO 0.20 0.08 1.18 -0.75 -1.23 0.00 0.00 174.94 174.42 2dk8 s LYS 74 N 1.16 2.52 0.13 2.79 2.20 -1.02 -4.69 119.74 122.83 2dk8 s LYS 74 Ca 0.62 1.66 0.00 0.00 -0.36 0.00 0.00 55.97 57.90 2dk8 s LYS 74 Cb -0.34 -1.89 0.00 0.00 -1.51 0.00 0.00 37.83 34.09 2dk8 s LYS 74 CO 0.30 -1.52 0.00 -3.47 -0.36 0.00 0.00 175.35 170.29 2dk8 n ASP 75 N -2.38 -1.18 -4.11 1.43 2.03 -1.26 -4.99 116.55 106.09 2dk8 n ASP 75 Ca 0.13 0.51 -0.37 0.00 0.52 0.00 0.00 54.79 55.57 2dk8 n ASP 75 Cb 0.51 1.38 -0.09 0.00 -0.72 0.00 0.00 41.12 42.19 2dk8 n ASP 75 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2dk8 s SER 76 N -2.00 5.34 -0.14 1.67 1.04 -1.26 -5.03 113.70 113.32 2dk8 s SER 76 Ca 0.00 -2.77 -0.31 0.00 0.48 0.00 0.00 55.95 53.35 2dk8 s SER 76 Cb 0.00 -1.88 0.13 0.00 0.10 0.00 0.00 66.02 64.37 2dk8 s SER 76 CO 0.00 -0.40 1.07 -0.83 0.98 0.00 0.00 173.24 174.06 2dk8 s GLY 77 N 0.90 -0.28 0.43 7.32 0.00 -1.26 -5.16 107.32 109.27 2dk8 s GLY 77 Ca 0.16 1.75 -0.23 0.00 0.00 0.00 0.00 44.72 46.40 2dk8 s GLY 77 CO -0.04 0.73 1.05 2.56 0.00 0.00 0.00 173.10 177.40 2dk8 s PRO 78 N -1.96 4.04 0.19 2.90 0.04 -1.26 -4.97 135.00 133.98 2dk8 s PRO 78 Ca 0.04 1.46 0.00 0.00 0.04 0.00 0.00 61.00 62.54 2dk8 s PRO 78 Cb -0.01 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 32.15 2dk8 s PRO 78 CO -0.04 -0.24 0.00 0.45 0.04 0.00 0.00 177.00 177.21 2dk8 n SER 79 N -0.38 0.51 -4.54 6.66 2.88 -1.26 -5.09 113.62 112.40 2dk8 n SER 79 Ca 0.06 0.31 -0.25 0.00 -1.33 0.00 0.00 58.87 57.66 2dk8 n SER 79 Cb 0.51 0.01 -0.11 0.00 -0.75 0.00 0.00 64.21 63.87 2dk8 n SER 79 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dk8 s SER 80 N -5.53 3.40 0.00 -3.46 0.15 -1.26 -5.14 113.70 101.86 2dk8 s SER 80 Ca 0.00 -1.30 0.00 0.00 0.70 0.00 0.00 55.95 55.35 2dk8 s SER 80 Cb 0.00 -0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.01 2dk8 s SER 80 CO 0.00 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.65