#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 -7.52 -0.08 1.61 2.88 -1.26 -5.01 113.62 104.24 2dk8 n SER 2 Ca 0.00 1.39 -0.07 0.00 -1.33 0.00 0.00 58.87 58.86 2dk8 n SER 2 Cb 0.00 -4.17 -0.03 0.00 -0.75 0.00 0.00 64.21 59.27 2dk8 n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dk8 n SER 3 N 1.37 1.86 -3.15 -3.46 2.88 -1.26 -4.99 113.62 106.87 2dk8 n SER 3 Ca -0.01 0.52 0.04 0.00 -1.33 0.00 0.00 58.87 58.09 2dk8 n SER 3 Cb 0.01 -0.83 -0.01 0.00 -0.75 0.00 0.00 64.21 62.63 2dk8 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dk8 s GLY 4 N -4.53 -0.99 -0.14 0.46 0.00 -1.26 -5.13 107.32 95.73 2dk8 s GLY 4 Ca -0.21 1.86 -0.29 0.00 0.00 0.00 0.00 44.72 46.08 2dk8 s GLY 4 CO 0.31 3.40 1.00 -0.56 0.00 0.00 0.00 173.10 177.25 2dk8 s SER 5 N 2.86 7.18 0.59 1.64 0.01 -1.26 -4.79 113.70 119.94 2dk8 s SER 5 Ca 0.20 1.46 0.00 0.00 1.31 0.00 0.00 55.95 58.92 2dk8 s SER 5 Cb -0.15 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.54 2dk8 s SER 5 CO -0.21 -0.50 0.00 -0.24 0.41 0.00 0.00 173.24 172.70 2dk8 n SER 6 N 5.36 -7.49 0.00 2.44 2.88 -1.26 -4.93 113.62 110.62 2dk8 n SER 6 Ca 0.09 1.38 0.00 0.00 -1.33 0.00 0.00 58.87 59.01 2dk8 n SER 6 Cb 0.48 -4.73 0.00 0.00 -0.75 0.00 0.00 64.21 59.21 2dk8 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dk8 n GLY 7 N -4.23 1.72 0.16 0.46 0.00 -1.26 -4.68 105.19 97.34 2dk8 n GLY 7 Ca -0.09 -0.70 -0.06 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.28 -3.45 1.61 0.13 -1.91 -3.50 132.00 124.59 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 0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.19 2dk8 h PRO 8 CO 0.00 -0.08 -0.59 -3.47 -0.23 0.00 0.00 178.00 173.63 2dk8 n ASP 9 N -4.96 -6.49 -1.84 1.44 2.03 -1.26 -4.94 116.55 100.52 2dk8 n ASP 9 Ca -0.05 1.04 -0.01 0.00 0.52 0.00 0.00 54.79 56.29 2dk8 n ASP 9 Cb 0.17 -3.54 -0.01 0.00 -0.72 0.00 0.00 41.12 37.02 2dk8 n ASP 9 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dk8 n ALA 10 N 1.13 -2.80 -0.97 -1.67 0.00 -1.26 -4.92 120.51 110.03 2dk8 n ALA 10 Ca 0.00 0.63 -0.36 0.00 0.00 0.00 0.00 53.44 53.71 2dk8 n ALA 10 Cb 0.00 -1.40 0.05 0.00 0.00 0.00 0.00 19.45 18.10 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 0.94 -5.35 0.09 0.00 2.03 -1.26 -4.81 116.55 108.19 2dk8 n ASP 11 Ca -0.08 0.20 -0.05 0.00 0.52 0.00 0.00 54.79 55.38 2dk8 n ASP 11 Cb 0.12 -0.83 -0.02 0.00 -0.72 0.00 0.00 41.12 39.67 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 -1.10 -0.30 -0.68 -0.67 0.13 -1.98 -3.04 132.00 124.37 2dk8 h PRO 12 Ca -0.44 0.02 0.08 0.00 -0.87 0.00 0.00 66.00 64.80 2dk8 h PRO 12 Cb 1.30 0.07 -0.11 0.00 0.13 0.00 0.00 31.00 32.39 2dk8 h PRO 12 CO 0.25 -0.20 -0.50 -0.24 -0.23 0.00 0.00 178.00 177.08 2dk8 h VAL 13 N -0.99 0.03 -0.76 1.56 3.04 -1.99 0.17 116.25 117.31 2dk8 h VAL 13 Ca -0.03 0.00 0.13 0.00 -1.01 0.00 0.00 66.70 65.78 2dk8 h VAL 13 Cb 0.24 0.03 -0.13 0.00 -2.01 0.00 0.00 31.29 29.42 2dk8 h VAL 13 CO 0.05 0.00 -0.36 -0.33 -1.01 0.00 0.00 177.57 175.92 2dk8 h GLU 14 N -0.20 -0.09 -0.28 4.17 4.39 -1.94 0.51 114.58 121.14 2dk8 h GLU 14 Ca 0.16 0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.93 2dk8 h GLU 14 Cb 0.54 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.13 2dk8 h GLU 14 CO -0.75 -0.06 -0.37 0.82 -1.16 0.00 0.00 179.01 177.48 2dk8 h ILE 15 N -0.09 0.19 0.44 3.13 2.04 -0.60 0.11 117.51 122.73 2dk8 h ILE 15 Ca 0.28 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.13 2dk8 h ILE 15 Cb 0.57 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 2dk8 h ILE 15 CO -0.81 0.00 -0.48 -0.33 0.00 0.00 0.00 178.15 176.53 2dk8 h GLU 16 N -0.36 -0.89 -0.99 2.37 5.08 0.62 -1.92 114.58 118.49 2dk8 h GLU 16 Ca 0.13 0.06 0.25 0.00 -1.00 0.00 0.00 59.36 58.79 2dk8 h GLU 16 Cb 0.57 0.20 -0.18 0.00 0.50 0.00 0.00 28.75 29.84 2dk8 h GLU 16 CO -0.48 -0.59 -0.06 -0.91 -1.00 0.00 0.00 179.01 175.97 2dk8 h ASN 17 N -0.92 -0.61 -0.44 1.42 2.35 0.40 1.11 115.58 118.89 2dk8 h ASN 17 Ca -0.05 0.29 0.09 0.00 -0.55 0.00 0.00 56.30 56.07 2dk8 h ASN 17 Cb 0.81 0.53 -0.08 0.00 0.05 0.00 0.00 38.32 39.62 2dk8 h ASN 17 CO -0.08 -0.35 -0.08 0.03 -1.65 0.00 0.00 177.43 175.30 2dk8 h ARG 18 N 0.01 0.02 -0.90 0.81 2.47 -0.02 0.14 114.38 116.90 2dk8 h ARG 18 Ca 0.56 -0.00 0.09 0.00 -1.26 0.00 0.00 59.98 59.37 2dk8 h ARG 18 Cb 1.08 -0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 29.32 2dk8 h ARG 18 CO -0.95 0.02 0.55 0.82 0.56 0.00 0.00 179.97 180.96 2dk8 h ILE 19 N 0.02 0.96 0.45 2.04 2.04 0.17 -0.74 117.51 122.46 2dk8 h ILE 19 Ca 0.21 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2dk8 h ILE 19 Cb 0.33 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 2dk8 h ILE 19 CO -0.43 0.17 -0.31 0.40 0.00 0.00 0.00 178.15 177.97 2dk8 h ILE 20 N 0.93 0.35 -0.94 -0.67 1.08 0.42 1.36 117.51 120.04 2dk8 h ILE 20 Ca 0.43 0.00 0.22 0.00 -0.39 0.00 0.00 64.86 65.11 2dk8 h ILE 20 Cb 0.34 0.35 -0.07 0.00 -3.07 0.00 0.00 36.82 34.37 2dk8 h ILE 20 CO -0.23 0.00 0.62 -0.33 -0.69 0.00 0.00 178.15 177.52 2dk8 h GLU 21 N -0.75 0.38 0.16 2.37 5.08 -0.27 0.33 114.58 121.88 2dk8 h GLU 21 Ca -0.05 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2dk8 h GLU 21 Cb 0.63 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2dk8 h GLU 21 CO 0.03 0.25 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.14 2dk8 h LEU 22 N 0.40 -0.18 -1.91 1.33 3.38 -0.17 -0.76 115.31 117.39 2dk8 h LEU 22 Ca 0.50 -0.11 0.41 0.00 0.09 0.00 0.00 57.88 58.76 2dk8 h LEU 22 Cb 1.26 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 42.00 2dk8 h LEU 22 CO -0.20 0.34 0.99 0.00 0.09 0.00 0.00 178.44 179.67 2dk8 h HIS 24 N 0.04 0.69 -0.04 0.00 3.86 -0.37 -3.23 115.15 116.09 2dk8 h HIS 24 Ca 0.68 -0.46 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 2dk8 h HIS 24 Cb 2.63 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 31.05 2dk8 h HIS 24 CO -0.00 1.33 -0.07 1.96 0.86 0.00 0.00 177.93 182.01 2dk8 h GLN 25 N -0.13 0.05 -4.61 2.45 1.08 0.33 -3.37 115.11 110.92 2dk8 h GLN 25 Ca -0.15 -0.01 -0.65 0.00 -1.45 0.00 0.00 58.65 56.40 2dk8 h GLN 25 Cb 1.66 -0.01 -0.38 0.00 -0.05 0.00 0.00 27.48 28.70 2dk8 h GLN 25 CO 0.17 0.13 -0.77 -0.06 -0.95 0.00 0.00 178.83 177.35 2dk8 s PHE 26 N -4.90 3.15 -0.14 2.96 0.40 0.16 -4.96 117.98 114.66 2dk8 s PHE 26 Ca -0.05 -2.41 0.28 0.00 -0.60 0.00 0.00 56.93 54.16 2dk8 s PHE 26 Cb 0.16 -2.19 0.85 0.00 0.51 0.00 0.00 43.02 42.35 2dk8 s PHE 26 CO 0.69 -0.88 1.79 -1.00 0.70 0.00 0.00 175.22 176.52 2dk8 h PRO 27 N 7.77 0.00 0.14 0.24 0.13 -1.73 -3.06 132.00 135.50 2dk8 h PRO 27 Ca -0.13 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.70 2dk8 h PRO 27 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2dk8 h PRO 27 CO 0.47 0.03 -1.41 0.45 -0.23 0.00 0.00 178.00 177.32 2dk8 h HIS 28 N 0.00 0.55 0.00 1.56 3.86 -1.93 -3.43 115.15 115.76 2dk8 h HIS 28 Ca -0.00 -0.40 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 2dk8 h HIS 28 Cb 0.77 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.22 2dk8 h HIS 28 CO 0.00 1.37 0.00 0.41 0.86 0.00 0.00 177.93 180.57 2dk8 n GLY 29 N 1.62 1.55 3.11 2.45 0.00 -1.16 -4.67 105.19 108.08 2dk8 n GLY 29 Ca -0.13 -2.03 -0.15 0.00 0.00 0.00 0.00 46.02 43.70 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 -1.29 0.77 0.04 -0.61 -4.36 0.50 -4.82 121.20 111.44 2dk8 s ILE 30 Ca 0.00 -1.18 0.01 0.00 -0.26 0.00 0.00 60.65 59.23 2dk8 s ILE 30 Cb 0.00 -0.80 -0.04 0.00 1.25 0.00 0.00 42.46 42.87 2dk8 s ILE 30 CO 0.00 -0.32 0.09 0.42 0.24 0.00 0.00 174.94 175.37 2dk8 s THR 31 N -1.35 4.69 0.56 8.37 -4.23 -1.26 -0.47 115.64 121.95 2dk8 s THR 31 Ca -0.07 -0.59 0.48 0.00 -1.18 0.00 0.00 61.69 60.33 2dk8 s THR 31 Cb -0.10 -3.22 0.71 0.00 1.34 0.00 0.00 72.50 71.23 2dk8 s THR 31 CO 0.01 0.22 1.60 -0.78 -0.54 0.00 0.00 174.62 175.12 2dk8 h ASP 32 N 3.59 0.00 0.50 3.99 3.58 -1.99 0.88 116.42 126.97 2dk8 h ASP 32 Ca -0.47 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 56.95 2dk8 h ASP 32 Cb 1.17 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.22 2dk8 h ASP 32 CO 0.65 0.00 -0.24 1.56 -2.88 0.00 0.00 179.24 178.33 2dk8 h GLN 33 N 0.00 -0.65 0.00 0.28 1.08 -1.95 -2.01 115.11 111.86 2dk8 h GLN 33 Ca 0.87 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 58.12 2dk8 h GLN 33 Cb 3.55 0.15 0.00 0.00 -0.05 0.00 0.00 27.48 31.13 2dk8 h GLN 33 CO -0.01 -0.36 0.00 0.28 -0.95 0.00 0.00 178.83 177.79 2dk8 n VAL 34 N -5.31 0.00 -0.57 -0.54 0.31 0.30 0.47 118.33 112.99 2dk8 n VAL 34 Ca -0.11 1.41 0.45 0.00 -0.01 0.00 0.00 64.34 66.08 2dk8 n VAL 34 Cb 0.31 -2.05 0.74 0.00 -0.91 0.00 0.00 33.84 31.94 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 0.05 -0.00 2.52 2.04 -1.61 1.52 117.51 122.04 2dk8 h ILE 35 Ca 0.00 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 2dk8 h ILE 35 Cb 0.00 0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.11 2dk8 h ILE 35 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 178.15 177.54 2dk8 h GLN 36 N 0.02 0.00 0.00 2.37 4.15 0.80 1.51 115.11 123.96 2dk8 h GLN 36 Ca 0.88 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.30 2dk8 h GLN 36 Cb 3.18 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 30.87 2dk8 h GLN 36 CO -0.23 0.06 0.00 -1.71 -1.93 0.00 0.00 178.83 175.02 2dk8 n ASN 37 N -5.06 0.44 -0.06 -0.69 2.85 0.50 -0.54 115.26 112.69 2dk8 n ASN 37 Ca -0.07 0.59 -0.22 0.00 -0.11 0.00 0.00 54.58 54.77 2dk8 n ASN 37 Cb 0.06 -0.69 -0.13 0.00 1.24 0.00 0.00 39.78 40.27 2dk8 n ASN 37 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 2dk8 h GLU 38 N 0.00 0.11 -1.92 1.20 4.39 0.36 -3.43 114.58 115.29 2dk8 h GLU 38 Ca 0.00 -0.18 -0.54 0.00 0.34 0.00 0.00 59.36 58.97 2dk8 h GLU 38 Cb 0.41 0.07 -0.38 0.00 -0.10 0.00 0.00 28.75 28.76 2dk8 h GLU 38 CO 0.00 1.09 -1.07 -1.33 -1.16 0.00 0.00 179.01 176.54 2dk8 n MET 39 N -4.08 0.67 0.00 2.33 2.81 0.51 -4.92 117.12 114.43 2dk8 n MET 39 Ca -0.31 -3.13 0.12 0.00 -1.81 0.00 0.00 57.70 52.56 2dk8 n MET 39 Cb 0.82 -1.26 0.71 0.00 -0.71 0.00 0.00 33.22 32.78 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 1.53 0.74 0.06 0.03 -0.04 0.30 -2.10 135.00 135.53 2dk8 n PRO 40 Ca 0.21 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.79 2dk8 n PRO 40 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.00 0.57 -1.22 0.54 1.44 -1.26 -4.92 115.22 109.36 2dk8 n HIS 41 Ca 0.18 0.17 -0.31 0.00 -2.01 0.00 0.00 57.72 55.75 2dk8 n HIS 41 Cb 0.08 -0.71 0.11 0.00 0.12 0.00 0.00 29.99 29.59 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 -3.33 3.08 0.23 0.61 -1.09 -0.89 -5.03 121.20 114.78 2dk8 s ILE 42 Ca 0.00 0.35 -0.05 0.00 -2.23 0.00 0.00 60.65 58.72 2dk8 s ILE 42 Cb 0.12 -2.82 -0.05 0.00 -1.58 0.00 0.00 42.46 38.12 2dk8 s ILE 42 CO 0.81 -0.46 0.48 -1.61 -1.23 0.00 0.00 174.94 172.93 2dk8 s GLU 43 N -4.91 3.64 0.29 2.79 2.02 -1.26 -4.90 118.70 116.37 2dk8 s GLU 43 Ca 0.62 -0.03 0.01 0.00 0.02 0.00 0.00 54.97 55.60 2dk8 s GLU 43 Cb -0.18 -2.73 0.55 0.00 0.10 0.00 0.00 34.13 31.88 2dk8 s GLU 43 CO 0.56 0.33 1.85 0.00 0.02 0.00 0.00 175.26 178.02 2dk8 h ALA 44 N 2.19 1.53 -0.03 5.21 0.00 -1.98 1.04 119.26 127.23 2dk8 h ALA 44 Ca -0.47 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2dk8 h ALA 44 Cb 1.18 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2dk8 h ALA 44 CO 0.69 0.24 -0.04 1.96 0.00 0.00 0.00 179.25 182.10 2dk8 h GLN 45 N 1.00 0.08 -0.74 0.00 4.20 -1.98 -0.93 115.11 116.74 2dk8 h GLN 45 Ca 0.48 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.16 2dk8 h GLN 45 Cb 0.45 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 2dk8 h GLN 45 CO -0.24 0.58 0.49 1.96 -0.67 0.00 0.00 178.83 180.95 2dk8 h GLN 46 N -0.43 0.97 -0.68 1.46 1.08 -1.73 1.42 115.11 117.21 2dk8 h GLN 46 Ca 0.00 -0.06 -0.05 0.00 -1.45 0.00 0.00 58.65 57.09 2dk8 h GLN 46 Cb 0.58 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.76 2dk8 h GLN 46 CO 0.01 0.64 0.22 0.00 -0.95 0.00 0.00 178.83 178.75 2dk8 h ARG 47 N 1.00 1.04 -0.00 1.46 3.08 0.11 -1.87 114.38 119.20 2dk8 h ARG 47 Ca 0.27 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 2dk8 h ARG 47 Cb -0.11 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 29.79 2dk8 h ARG 47 CO -0.06 0.90 -0.01 0.00 -1.07 0.00 0.00 179.97 179.73 2dk8 h ALA 48 N 1.10 0.00 -0.39 0.04 0.00 -0.51 -2.79 119.26 116.72 2dk8 h ALA 48 Ca 0.22 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2dk8 h ALA 48 Cb 0.28 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 2dk8 h ALA 48 CO -0.01 -0.17 -0.36 0.28 0.00 0.00 0.00 179.25 178.99 2dk8 h VAL 49 N -0.62 0.00 -0.67 0.00 2.07 0.20 1.28 116.25 118.51 2dk8 h VAL 49 Ca -0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 2dk8 h VAL 49 Cb 0.64 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.28 2dk8 h VAL 49 CO 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.46 2dk8 h ALA 50 N -0.35 0.50 0.42 1.67 0.00 -1.44 0.99 119.26 121.06 2dk8 h ALA 50 Ca 0.07 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 2dk8 h ALA 50 Cb 0.34 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2dk8 h ALA 50 CO -0.45 -0.42 -0.34 0.82 0.00 0.00 0.00 179.25 178.85 2dk8 h ILE 51 N 0.02 0.00 -0.61 0.00 2.04 -0.34 0.33 117.51 118.96 2dk8 h ILE 51 Ca 0.33 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.31 2dk8 h ILE 51 Cb 0.52 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.49 2dk8 h ILE 51 CO -0.67 0.00 -0.19 -1.13 0.00 0.00 0.00 178.15 176.16 2dk8 h ASN 52 N -0.74 -0.69 0.17 1.72 -0.73 0.26 1.24 115.58 116.81 2dk8 h ASN 52 Ca -0.05 0.19 0.01 0.00 1.87 0.00 0.00 56.30 58.32 2dk8 h ASN 52 Cb 0.62 0.42 -0.04 0.00 0.27 0.00 0.00 38.32 39.59 2dk8 h ASN 52 CO 0.00 -0.23 -0.53 0.03 -0.37 0.00 0.00 177.43 176.33 2dk8 h ARG 53 N -0.04 -0.76 -0.56 6.67 3.08 0.13 0.11 114.38 123.01 2dk8 h ARG 53 Ca 0.29 0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.45 2dk8 h ARG 53 Cb 0.48 0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.65 2dk8 h ARG 53 CO -0.65 -0.51 0.27 -0.07 -1.07 0.00 0.00 179.97 177.94 2dk8 h LEU 54 N -0.79 0.35 -0.86 3.04 3.38 0.91 1.03 115.31 122.37 2dk8 h LEU 54 Ca -0.01 0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.20 2dk8 h LEU 54 Cb 0.78 -0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.39 2dk8 h LEU 54 CO -0.26 0.23 0.36 -0.07 0.09 0.00 0.00 178.44 178.79 2dk8 h LEU 55 N 0.50 0.30 0.04 1.67 3.38 0.24 0.22 115.31 121.66 2dk8 h LEU 55 Ca 0.26 0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.37 2dk8 h LEU 55 Cb 0.22 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2dk8 h LEU 55 CO -0.21 0.03 -0.02 -1.28 0.09 0.00 0.00 178.44 177.05 2dk8 h SER 56 N 0.41 -0.05 -1.87 -0.43 0.87 0.86 -3.29 113.55 110.05 2dk8 h SER 56 Ca 0.52 -0.00 0.54 0.00 -1.23 0.00 0.00 61.79 61.62 2dk8 h SER 56 Cb 0.93 0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.83 2dk8 h SER 56 CO -0.50 0.44 1.37 0.23 -0.53 0.00 0.00 176.83 177.85 2dk8 n MET 57 N -4.82 0.00 -0.43 2.24 2.81 0.34 -4.69 117.12 112.57 2dk8 n MET 57 Ca -0.01 1.05 0.00 0.00 -1.81 0.00 0.00 57.70 56.93 2dk8 n MET 57 Cb 0.02 -2.43 0.00 0.00 -0.71 0.00 0.00 33.22 30.11 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 -1.88 0.76 0.08 3.03 0.00 0.66 -4.96 105.19 102.88 2dk8 n GLY 58 Ca 0.42 -0.46 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.38 0.66 -4.61 1.61 1.13 -0.60 -4.68 117.38 108.51 2dk8 n GLN 59 Ca 0.00 0.08 -0.30 0.00 -1.94 0.00 0.00 57.00 54.84 2dk8 n GLN 59 Cb 0.01 -1.65 -0.13 0.00 0.11 0.00 0.00 30.24 28.58 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 -5.54 2.49 -0.13 1.08 2.96 -1.06 -3.17 118.68 115.31 2dk8 s LEU 60 Ca -0.07 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.34 2dk8 s LEU 60 Cb 0.08 -1.43 0.00 0.00 0.50 0.00 0.00 46.19 45.34 2dk8 s LEU 60 CO 0.84 0.23 -0.21 -1.81 -1.32 0.00 0.00 176.35 174.08 2dk8 s ASP 61 N -1.61 3.25 0.14 3.68 1.11 0.16 -4.14 116.67 119.26 2dk8 s ASP 61 Ca 0.15 -0.55 -0.16 0.00 0.18 0.00 0.00 52.55 52.16 2dk8 s ASP 61 Cb -0.10 -1.46 -0.07 0.00 1.07 0.00 0.00 42.92 42.35 2dk8 s ASP 61 CO 0.06 0.11 0.58 -0.22 1.18 0.00 0.00 175.17 176.88 2dk8 s LEU 62 N 0.65 4.38 -0.21 1.23 0.20 -1.26 -0.45 118.68 123.22 2dk8 s LEU 62 Ca -0.10 1.17 -0.04 0.00 0.69 0.00 0.00 54.13 55.85 2dk8 s LEU 62 Cb -0.16 -3.25 0.08 0.00 -0.43 0.00 0.00 46.19 42.43 2dk8 s LEU 62 CO 0.02 0.13 0.15 -0.76 -0.29 0.00 0.00 176.35 175.60 2dk8 s LEU 63 N -1.79 0.19 -0.55 -0.68 1.43 0.40 -4.95 118.68 112.73 2dk8 s LEU 63 Ca 0.37 -0.62 -0.28 0.00 -1.03 0.00 0.00 54.13 52.57 2dk8 s LEU 63 Cb -0.16 -0.01 0.03 0.00 0.03 0.00 0.00 46.19 46.07 2dk8 s LEU 63 CO 0.19 -0.36 1.24 -0.13 0.23 0.00 0.00 176.35 177.52 2dk8 s ARG 64 N 2.21 3.51 0.49 1.70 0.52 -1.26 0.17 118.95 126.29 2dk8 s ARG 64 Ca 0.05 0.38 0.07 0.00 -0.52 0.00 0.00 55.73 55.71 2dk8 s ARG 64 Cb -0.16 -4.02 0.02 0.00 0.52 0.00 0.00 34.95 31.31 2dk8 s ARG 64 CO -0.16 -1.68 0.43 0.45 0.02 0.00 0.00 175.30 174.36 2dk8 s SER 65 N 3.22 4.84 0.20 0.23 0.15 -1.03 -4.96 113.70 116.34 2dk8 s SER 65 Ca 0.47 -1.00 -0.19 0.00 0.70 0.00 0.00 55.95 55.92 2dk8 s SER 65 Cb -0.08 -0.00 0.16 0.00 -1.71 0.00 0.00 66.02 64.39 2dk8 s SER 65 CO 0.27 -0.94 1.58 0.78 1.20 0.00 0.00 173.24 176.13 2dk8 h ASN 66 N 0.81 -1.12 -3.64 5.45 4.21 -2.00 -3.34 115.58 115.94 2dk8 h ASN 66 Ca -0.38 0.24 -0.64 0.00 1.21 0.00 0.00 56.30 56.72 2dk8 h ASN 66 Cb 1.29 0.58 -0.15 0.00 -1.12 0.00 0.00 38.32 38.91 2dk8 h ASN 66 CO 0.56 -0.29 -0.15 0.28 -1.29 0.00 0.00 177.43 176.54 2dk8 s THR 67 N -6.03 5.09 0.00 2.81 -1.32 -1.26 -4.98 115.64 109.95 2dk8 s THR 67 Ca -0.14 0.35 0.00 0.00 -1.21 0.00 0.00 61.69 60.69 2dk8 s THR 67 Cb 0.17 -3.86 0.00 0.00 -1.51 0.00 0.00 72.50 67.30 2dk8 s THR 67 CO 0.70 -0.09 0.00 0.61 -2.21 0.00 0.00 174.62 173.64 2dk8 n GLY 68 N 4.78 0.76 3.75 6.08 0.00 -1.25 -4.74 105.19 114.57 2dk8 n GLY 68 Ca -0.07 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 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 3.30 0.09 0.99 1.43 -1.26 -2.46 118.68 120.76 2dk8 s LEU 69 Ca 0.00 -0.74 0.07 0.00 -1.03 0.00 0.00 54.13 52.42 2dk8 s LEU 69 Cb 0.00 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 2dk8 s LEU 69 CO 0.00 -0.30 -0.18 -0.22 0.23 0.00 0.00 176.35 175.88 2dk8 s LEU 70 N -3.86 2.28 -0.11 1.79 0.20 0.46 -4.44 118.68 115.00 2dk8 s LEU 70 Ca 0.38 -0.65 0.00 0.00 0.69 0.00 0.00 54.13 54.56 2dk8 s LEU 70 Cb -0.03 -0.71 0.02 0.00 -0.43 0.00 0.00 46.19 45.05 2dk8 s LEU 70 CO 0.23 -0.00 -0.10 -0.31 -0.29 0.00 0.00 176.35 175.88 2dk8 s TYR 71 N -1.20 1.58 0.40 5.38 2.02 0.38 0.15 117.35 126.06 2dk8 s TYR 71 Ca 0.02 -0.76 0.04 0.00 -0.37 0.00 0.00 57.07 56.00 2dk8 s TYR 71 Cb -0.10 -1.25 -0.02 0.00 -0.40 0.00 0.00 41.96 40.19 2dk8 s TYR 71 CO 0.03 -0.48 0.16 -0.98 -1.57 0.00 0.00 175.55 172.71 2dk8 s ARG 72 N 1.44 1.93 0.06 -0.62 1.70 0.40 0.19 118.95 124.05 2dk8 s ARG 72 Ca 0.01 -2.18 -0.31 0.00 -0.47 0.00 0.00 55.73 52.78 2dk8 s ARG 72 Cb -0.13 -0.43 -0.06 0.00 -0.57 0.00 0.00 34.95 33.75 2dk8 s ARG 72 CO -0.06 -0.54 1.32 0.42 -1.08 0.00 0.00 175.30 175.36 2dk8 s ILE 73 N -3.23 3.71 0.14 4.99 -1.09 -1.24 0.37 121.20 124.85 2dk8 s ILE 73 Ca 0.26 1.19 -0.31 0.00 -2.23 0.00 0.00 60.65 59.55 2dk8 s ILE 73 Cb 0.02 -3.76 -0.10 0.00 -1.58 0.00 0.00 42.46 37.03 2dk8 s ILE 73 CO 0.17 0.06 1.74 -0.75 -1.23 0.00 0.00 174.94 174.93 2dk8 s LYS 74 N 1.48 4.15 -0.22 2.79 2.20 -1.19 -4.68 119.74 124.27 2dk8 s LYS 74 Ca 0.62 2.53 -0.16 0.00 -0.36 0.00 0.00 55.97 58.59 2dk8 s LYS 74 Cb -0.32 -3.39 0.06 0.00 -1.51 0.00 0.00 37.83 32.67 2dk8 s LYS 74 CO 0.28 -0.77 0.56 0.34 -0.36 0.00 0.00 175.35 175.41 2dk8 s ASP 75 N 2.02 -0.67 -0.28 1.43 2.15 -1.26 -4.99 116.67 115.07 2dk8 s ASP 75 Ca 0.77 1.18 0.01 0.00 0.43 0.00 0.00 52.55 54.94 2dk8 s ASP 75 Cb -0.46 1.13 0.08 0.00 -0.30 0.00 0.00 42.92 43.37 2dk8 s ASP 75 CO 0.34 -0.21 0.02 -0.55 -0.17 0.00 0.00 175.17 174.60 2dk8 s SER 76 N 0.92 4.07 0.00 -0.34 0.15 -1.26 -4.99 113.70 112.25 2dk8 s SER 76 Ca -0.05 -1.52 0.00 0.00 0.70 0.00 0.00 55.95 55.08 2dk8 s SER 76 Cb -0.05 -1.17 0.00 0.00 -1.71 0.00 0.00 66.02 63.09 2dk8 s SER 76 CO -0.08 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.65 2dk8 n GLY 77 N 4.64 0.40 3.19 9.45 0.00 -1.26 -4.95 105.19 116.67 2dk8 n GLY 77 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 2dk8 n GLY 77 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dk8 n PRO 78 N -0.26 2.25 -4.57 1.61 -0.04 -1.26 -4.88 135.00 127.85 2dk8 n PRO 78 Ca 0.00 -2.48 -0.26 0.00 -0.04 0.00 0.00 63.50 60.71 2dk8 n PRO 78 Cb 0.00 -3.31 -0.11 0.00 -0.04 0.00 0.00 33.50 30.05 2dk8 n PRO 78 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dk8 s SER 79 N 4.63 3.70 0.09 3.54 0.15 -1.26 -5.16 113.70 119.40 2dk8 s SER 79 Ca 0.56 -1.27 0.04 0.00 0.70 0.00 0.00 55.95 55.98 2dk8 s SER 79 Cb 0.09 -0.35 -0.03 0.00 -1.71 0.00 0.00 66.02 64.01 2dk8 s SER 79 CO 0.06 -0.32 -0.11 -0.94 1.20 0.00 0.00 173.24 173.12 2dk8 s SER 80 N -3.64 1.51 0.00 5.45 1.04 -1.26 -5.25 113.70 111.55 2dk8 s SER 80 Ca 0.33 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.01 2dk8 s SER 80 Cb 0.06 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.17 2dk8 s SER 80 CO 0.17 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.79