#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 6.42 0.39 1.61 0.15 -1.26 -3.97 113.70 117.04 2dk8 s SER 2 Ca 0.00 -1.77 0.00 0.00 0.70 0.00 0.00 55.95 54.88 2dk8 s SER 2 Cb 0.00 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2dk8 s SER 2 CO 0.00 -1.58 0.00 -0.24 1.20 0.00 0.00 173.24 172.62 2dk8 n SER 3 N 9.47 -3.48 0.00 5.45 2.88 -1.26 -5.18 113.62 121.49 2dk8 n SER 3 Ca 0.40 0.76 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 2dk8 n SER 3 Cb 0.49 3.32 0.00 0.00 -0.75 0.00 0.00 64.21 67.26 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 -1.42 0.76 3.14 0.46 0.00 -1.26 -5.08 105.19 101.80 2dk8 n GLY 4 Ca 0.00 -1.75 0.05 0.00 0.00 0.00 0.00 46.02 44.32 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 -4.00 -0.99 -0.20 1.61 0.15 -1.26 -4.92 113.70 104.08 2dk8 s SER 5 Ca 0.00 0.08 -0.10 0.00 0.70 0.00 0.00 55.95 56.63 2dk8 s SER 5 Cb 0.00 1.60 0.04 0.00 -1.71 0.00 0.00 66.02 65.95 2dk8 s SER 5 CO 0.00 -0.18 0.20 -0.24 1.20 0.00 0.00 173.24 174.22 2dk8 n SER 6 N 5.18 -1.99 0.00 5.45 2.88 -1.26 -5.07 113.62 118.81 2dk8 n SER 6 Ca 0.07 1.35 0.00 0.00 -1.33 0.00 0.00 58.87 58.96 2dk8 n SER 6 Cb 0.56 -5.11 0.00 0.00 -0.75 0.00 0.00 64.21 58.92 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 1.58 4.11 0.15 0.46 0.00 -1.26 -5.06 105.19 105.18 2dk8 n GLY 7 Ca -0.34 -0.60 -0.17 0.00 0.00 0.00 0.00 46.02 44.92 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 0.43 -3.51 1.61 0.13 -1.97 -3.50 132.00 125.19 2dk8 h PRO 8 Ca 0.00 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2dk8 h PRO 8 Cb 0.00 0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.24 2dk8 h PRO 8 CO 0.00 1.07 -0.68 -0.25 -0.23 0.00 0.00 178.00 177.91 2dk8 n ASP 9 N -4.25 -7.01 -3.66 1.44 8.00 -1.26 -5.02 116.55 104.79 2dk8 n ASP 9 Ca -0.10 1.06 -0.28 0.00 0.71 0.00 0.00 54.79 56.18 2dk8 n ASP 9 Cb 0.64 -3.89 -0.16 0.00 -0.02 0.00 0.00 41.12 37.69 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 -0.38 0.92 1.00 2.24 0.00 -1.26 -5.13 121.76 119.15 2dk8 s ALA 10 Ca 0.00 -0.95 -0.18 0.00 0.00 0.00 0.00 51.96 50.84 2dk8 s ALA 10 Cb 0.00 -1.31 -0.13 0.00 0.00 0.00 0.00 23.12 21.69 2dk8 s ALA 10 CO 0.00 -1.40 -0.74 -3.47 0.00 0.00 0.00 175.76 170.15 2dk8 n ASP 11 N 5.10 -5.11 0.09 0.00 2.03 -1.26 -4.79 116.55 112.60 2dk8 n ASP 11 Ca -0.06 0.17 -0.05 0.00 0.52 0.00 0.00 54.79 55.37 2dk8 n ASP 11 Cb 0.45 -0.79 -0.02 0.00 -0.72 0.00 0.00 41.12 40.04 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 -1.09 -0.31 -0.64 -0.67 0.13 -2.00 -3.04 132.00 124.38 2dk8 h PRO 12 Ca -0.44 0.02 0.10 0.00 -0.87 0.00 0.00 66.00 64.81 2dk8 h PRO 12 Cb 1.31 0.07 -0.11 0.00 0.13 0.00 0.00 31.00 32.40 2dk8 h PRO 12 CO 0.24 -0.20 -0.42 -0.24 -0.23 0.00 0.00 178.00 177.15 2dk8 h VAL 13 N -1.00 0.09 -0.69 1.56 3.04 -1.99 0.78 116.25 118.02 2dk8 h VAL 13 Ca -0.03 0.00 0.10 0.00 -1.01 0.00 0.00 66.70 65.76 2dk8 h VAL 13 Cb 0.24 0.09 -0.12 0.00 -2.01 0.00 0.00 31.29 29.49 2dk8 h VAL 13 CO 0.05 0.00 -0.44 -0.33 -1.01 0.00 0.00 177.57 175.85 2dk8 h GLU 14 N -0.19 -0.16 -0.40 4.17 4.39 -1.94 0.27 114.58 120.73 2dk8 h GLU 14 Ca 0.20 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.99 2dk8 h GLU 14 Cb 0.56 0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 29.15 2dk8 h GLU 14 CO -0.73 -0.10 -0.37 0.82 -1.16 0.00 0.00 179.01 177.47 2dk8 h ILE 15 N -0.16 0.18 0.13 3.13 2.04 -0.77 -0.09 117.51 121.96 2dk8 h ILE 15 Ca 0.21 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.08 2dk8 h ILE 15 Cb 0.55 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 2dk8 h ILE 15 CO -0.76 0.00 -0.46 -0.33 0.00 0.00 0.00 178.15 176.60 2dk8 h GLU 16 N -0.28 -0.64 -0.99 2.37 5.08 0.37 -1.08 114.58 119.41 2dk8 h GLU 16 Ca 0.16 0.04 0.25 0.00 -1.00 0.00 0.00 59.36 58.82 2dk8 h GLU 16 Cb 0.56 0.15 -0.19 0.00 0.50 0.00 0.00 28.75 29.77 2dk8 h GLU 16 CO -0.55 -0.43 -0.05 -0.91 -1.00 0.00 0.00 179.01 176.06 2dk8 h ASN 17 N -0.67 -0.61 -0.37 1.42 2.35 0.17 1.02 115.58 118.89 2dk8 h ASN 17 Ca -0.01 0.29 0.08 0.00 -0.55 0.00 0.00 56.30 56.11 2dk8 h ASN 17 Cb 0.66 0.53 -0.08 0.00 0.05 0.00 0.00 38.32 39.48 2dk8 h ASN 17 CO -0.24 -0.35 -0.15 0.03 -1.65 0.00 0.00 177.43 175.07 2dk8 h ARG 18 N 0.00 -0.08 -0.65 0.81 2.47 0.24 0.45 114.38 117.61 2dk8 h ARG 18 Ca 0.57 0.01 0.05 0.00 -1.26 0.00 0.00 59.98 59.34 2dk8 h ARG 18 Cb 1.10 0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 29.39 2dk8 h ARG 18 CO -0.96 -0.06 0.37 0.82 0.56 0.00 0.00 179.97 180.71 2dk8 h ILE 19 N -0.09 1.00 0.26 2.04 2.04 0.16 -1.70 117.51 121.21 2dk8 h ILE 19 Ca 0.18 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2dk8 h ILE 19 Cb 0.37 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 2dk8 h ILE 19 CO -0.43 0.13 -0.46 0.40 0.00 0.00 0.00 178.15 177.80 2dk8 h ILE 20 N 0.70 0.00 -1.10 -0.67 1.08 0.82 1.46 117.51 119.80 2dk8 h ILE 20 Ca 0.29 0.00 0.31 0.00 -0.39 0.00 0.00 64.86 65.07 2dk8 h ILE 20 Cb 0.14 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 33.78 2dk8 h ILE 20 CO -0.16 0.00 0.70 -0.33 -0.69 0.00 0.00 178.15 177.66 2dk8 h GLU 21 N -0.76 0.32 0.22 2.37 5.08 -0.65 0.54 114.58 121.70 2dk8 h GLU 21 Ca -0.03 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2dk8 h GLU 21 Cb 0.71 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2dk8 h GLU 21 CO -0.16 0.21 -0.11 -0.07 -1.00 0.00 0.00 179.01 177.88 2dk8 h LEU 22 N 0.32 -0.25 -1.89 1.33 3.38 -0.15 0.31 115.31 118.37 2dk8 h LEU 22 Ca 0.67 -0.22 0.26 0.00 0.09 0.00 0.00 57.88 58.68 2dk8 h LEU 22 Cb 1.76 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 42.54 2dk8 h LEU 22 CO -0.37 0.27 0.74 0.00 0.09 0.00 0.00 178.44 179.17 2dk8 h HIS 24 N 0.00 0.39 -0.30 0.00 3.86 0.09 -3.11 115.15 116.08 2dk8 h HIS 24 Ca 0.43 -0.29 0.09 0.00 -1.16 0.00 0.00 60.37 59.44 2dk8 h HIS 24 Cb 1.91 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 30.36 2dk8 h HIS 24 CO 0.00 1.38 0.23 1.96 0.86 0.00 0.00 177.93 182.36 2dk8 h GLN 25 N -0.48 0.00 -4.79 2.45 1.08 0.40 -3.35 115.11 110.42 2dk8 h GLN 25 Ca -0.20 0.00 -0.67 0.00 -1.45 0.00 0.00 58.65 56.33 2dk8 h GLN 25 Cb 1.58 0.00 -0.37 0.00 -0.05 0.00 0.00 27.48 28.64 2dk8 h GLN 25 CO 0.07 0.00 -0.75 -0.06 -0.95 0.00 0.00 178.83 177.13 2dk8 s PHE 26 N -4.98 3.40 -1.06 2.96 0.40 0.92 -4.95 117.98 114.68 2dk8 s PHE 26 Ca -0.05 -2.42 0.22 0.00 -0.60 0.00 0.00 56.93 54.08 2dk8 s PHE 26 Cb 0.18 -2.26 0.96 0.00 0.51 0.00 0.00 43.02 42.41 2dk8 s PHE 26 CO 0.68 -0.89 1.70 -0.35 0.70 0.00 0.00 175.22 177.06 2dk8 n PRO 27 N 4.43 0.04 -0.10 0.24 -0.04 -1.26 -2.98 135.00 135.33 2dk8 n PRO 27 Ca -0.09 0.12 -0.17 0.00 -0.04 0.00 0.00 63.50 63.32 2dk8 n PRO 27 Cb 0.42 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.25 2dk8 n PRO 27 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2dk8 n HIS 28 N -1.47 0.23 0.00 0.54 8.25 -1.26 -4.84 115.22 116.67 2dk8 n HIS 28 Ca 0.06 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2dk8 n HIS 28 Cb 0.24 -1.03 0.00 0.00 1.12 0.00 0.00 29.99 30.32 2dk8 n HIS 28 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dk8 n GLY 29 N 2.12 0.94 3.27 -1.41 0.00 -1.16 -4.65 105.19 104.31 2dk8 n GLY 29 Ca -0.41 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 43.49 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 -1.39 0.00 0.08 -0.61 -4.36 0.15 -4.77 121.20 110.29 2dk8 s ILE 30 Ca 0.00 -1.93 0.07 0.00 -0.26 0.00 0.00 60.65 58.54 2dk8 s ILE 30 Cb 0.00 -2.49 -0.03 0.00 1.25 0.00 0.00 42.46 41.19 2dk8 s ILE 30 CO 0.00 0.00 -0.19 0.42 0.24 0.00 0.00 174.94 175.41 2dk8 s THR 31 N -3.88 1.58 0.44 8.37 -4.23 -1.26 -0.91 115.64 115.74 2dk8 s THR 31 Ca 0.38 -1.41 0.31 0.00 -1.18 0.00 0.00 61.69 59.79 2dk8 s THR 31 Cb 0.05 -1.43 0.49 0.00 1.34 0.00 0.00 72.50 72.94 2dk8 s THR 31 CO 0.17 -0.03 1.59 -2.24 -0.54 0.00 0.00 174.62 173.57 2dk8 h ASP 32 N 4.32 0.22 0.55 3.99 2.03 -2.00 0.84 116.42 126.36 2dk8 h ASP 32 Ca -0.44 0.16 -0.02 0.00 -0.73 0.00 0.00 57.03 56.00 2dk8 h ASP 32 Cb 1.18 0.16 0.00 0.00 -0.83 0.00 0.00 39.33 39.84 2dk8 h ASP 32 CO 0.41 -0.26 -0.30 1.56 -1.03 0.00 0.00 179.24 179.62 2dk8 h GLN 33 N 0.02 -0.75 -0.09 4.15 1.08 -1.95 -1.01 115.11 116.56 2dk8 h GLN 33 Ca 0.87 0.05 0.01 0.00 -1.45 0.00 0.00 58.65 58.13 2dk8 h GLN 33 Cb 2.73 0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 30.31 2dk8 h GLN 33 CO -0.49 -0.50 -0.12 0.28 -0.95 0.00 0.00 178.83 177.05 2dk8 h VAL 34 N -0.78 0.00 -0.71 -0.54 2.07 0.30 1.05 116.25 117.64 2dk8 h VAL 34 Ca -0.07 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.66 2dk8 h VAL 34 Cb 0.62 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2dk8 h VAL 34 CO 0.10 0.00 0.81 0.40 0.02 0.00 0.00 177.57 178.89 2dk8 h ILE 35 N -0.09 0.19 0.10 4.57 2.04 -1.47 0.76 117.51 123.61 2dk8 h ILE 35 Ca 0.02 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 2dk8 h ILE 35 Cb 0.13 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2dk8 h ILE 35 CO -0.13 0.00 -0.05 -0.61 0.00 0.00 0.00 178.15 177.36 2dk8 h GLN 36 N 0.00 -0.13 0.00 2.37 4.15 0.24 1.47 115.11 123.20 2dk8 h GLN 36 Ca 0.34 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.75 2dk8 h GLN 36 Cb 1.95 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 29.67 2dk8 h GLN 36 CO -0.00 0.34 -0.06 -0.91 -1.93 0.00 0.00 178.83 176.27 2dk8 h ASN 37 N -0.68 0.00 0.01 -0.69 2.35 0.31 0.24 115.58 117.12 2dk8 h ASN 37 Ca -0.01 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.59 2dk8 h ASN 37 Cb 0.53 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.88 2dk8 h ASN 37 CO 0.02 0.06 -0.80 -0.33 -1.65 0.00 0.00 177.43 174.72 2dk8 h GLU 38 N 0.00 0.02 -2.08 0.81 4.39 0.30 -3.42 114.58 114.60 2dk8 h GLU 38 Ca -0.00 -0.04 -0.57 0.00 0.34 0.00 0.00 59.36 59.09 2dk8 h GLU 38 Cb 0.63 0.01 -0.40 0.00 -0.10 0.00 0.00 28.75 28.89 2dk8 h GLU 38 CO 0.01 1.02 -0.91 -1.33 -1.16 0.00 0.00 179.01 176.63 2dk8 n MET 39 N -4.45 1.52 0.00 2.33 2.81 0.50 -4.89 117.12 114.94 2dk8 n MET 39 Ca -0.23 -3.84 0.12 0.00 -1.81 0.00 0.00 57.70 51.93 2dk8 n MET 39 Cb 0.63 -1.68 0.63 0.00 -0.71 0.00 0.00 33.22 32.09 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 1.01 0.51 -0.37 0.03 -0.04 0.83 -2.37 135.00 134.60 2dk8 n PRO 40 Ca 0.25 0.04 0.07 0.00 -0.04 0.00 0.00 63.50 63.82 2dk8 n PRO 40 Cb 0.49 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.68 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 -1.16 0.90 -3.87 0.54 1.44 -1.26 -4.89 115.22 106.91 2dk8 n HIS 41 Ca 0.14 -0.37 -0.28 0.00 -2.01 0.00 0.00 57.72 55.20 2dk8 n HIS 41 Cb 0.14 -0.13 -0.03 0.00 0.12 0.00 0.00 29.99 30.08 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 -1.64 5.31 0.47 0.61 -1.09 -1.00 -4.96 121.20 118.90 2dk8 s ILE 42 Ca 0.33 -0.51 -0.13 0.00 -2.23 0.00 0.00 60.65 58.12 2dk8 s ILE 42 Cb 0.20 -3.71 -0.07 0.00 -1.58 0.00 0.00 42.46 37.31 2dk8 s ILE 42 CO 0.18 -0.04 0.88 -1.61 -1.23 0.00 0.00 174.94 173.11 2dk8 s GLU 43 N -3.04 3.81 0.49 2.79 2.02 -1.26 -4.87 118.70 118.64 2dk8 s GLU 43 Ca 0.36 0.67 0.15 0.00 0.02 0.00 0.00 54.97 56.17 2dk8 s GLU 43 Cb -0.12 -2.26 1.16 0.00 0.10 0.00 0.00 34.13 33.02 2dk8 s GLU 43 CO 0.28 -0.19 2.10 0.00 0.02 0.00 0.00 175.26 177.47 2dk8 h ALA 44 N 0.91 1.89 0.09 5.21 0.00 -1.99 0.34 119.26 125.71 2dk8 h ALA 44 Ca -0.47 -0.05 -0.27 0.00 0.00 0.00 0.00 54.91 54.12 2dk8 h ALA 44 Cb 1.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2dk8 h ALA 44 CO 0.63 0.09 -1.44 1.96 0.00 0.00 0.00 179.25 180.48 2dk8 h GLN 45 N 0.04 0.20 -0.92 0.00 4.20 -1.99 -3.18 115.11 113.46 2dk8 h GLN 45 Ca 0.01 -0.34 0.03 0.00 0.06 0.00 0.00 58.65 58.42 2dk8 h GLN 45 Cb 0.09 0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 2dk8 h GLN 45 CO 0.00 1.16 0.60 1.96 -0.67 0.00 0.00 178.83 181.89 2dk8 h GLN 46 N -0.39 1.13 -0.35 1.46 1.08 -1.85 1.05 115.11 117.23 2dk8 h GLN 46 Ca -0.32 -0.07 -0.03 0.00 -1.45 0.00 0.00 58.65 56.78 2dk8 h GLN 46 Cb 1.70 -0.25 -0.01 0.00 -0.05 0.00 0.00 27.48 28.86 2dk8 h GLN 46 CO 0.01 0.75 0.08 0.00 -0.95 0.00 0.00 178.83 178.72 2dk8 h ARG 47 N 1.16 0.56 -0.15 1.46 3.08 -0.48 -2.16 114.38 117.86 2dk8 h ARG 47 Ca 0.36 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.21 2dk8 h ARG 47 Cb -0.00 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 2dk8 h ARG 47 CO -0.11 0.61 -0.15 0.00 -1.07 0.00 0.00 179.97 179.25 2dk8 h ALA 48 N 0.93 0.22 -0.08 0.04 0.00 -1.35 -2.55 119.26 116.46 2dk8 h ALA 48 Ca 0.11 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.70 2dk8 h ALA 48 Cb 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2dk8 h ALA 48 CO 0.00 0.11 -0.09 0.28 0.00 0.00 0.00 179.25 179.54 2dk8 h VAL 49 N -0.01 0.00 -0.75 0.00 2.07 0.12 1.39 116.25 119.08 2dk8 h VAL 49 Ca 0.02 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.71 2dk8 h VAL 49 Cb 0.69 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.32 2dk8 h VAL 49 CO 0.04 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.58 2dk8 h ALA 50 N -1.04 0.70 0.33 1.67 0.00 -1.47 0.43 119.26 119.88 2dk8 h ALA 50 Ca 0.01 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2dk8 h ALA 50 Cb 0.10 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2dk8 h ALA 50 CO -0.11 -0.43 -0.39 0.82 0.00 0.00 0.00 179.25 179.15 2dk8 h ILE 51 N 0.07 0.00 -0.78 0.00 2.04 -0.51 0.42 117.51 118.75 2dk8 h ILE 51 Ca 0.40 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.44 2dk8 h ILE 51 Cb 0.68 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.63 2dk8 h ILE 51 CO -0.69 0.00 0.08 -1.13 0.00 0.00 0.00 178.15 176.41 2dk8 h ASN 52 N -0.73 -0.21 0.60 1.72 -0.73 0.33 1.01 115.58 117.56 2dk8 h ASN 52 Ca -0.04 0.19 -0.02 0.00 1.87 0.00 0.00 56.30 58.30 2dk8 h ASN 52 Cb 0.65 0.30 -0.01 0.00 0.27 0.00 0.00 38.32 39.53 2dk8 h ASN 52 CO -0.08 -0.15 -0.46 0.03 -0.37 0.00 0.00 177.43 176.39 2dk8 h ARG 53 N 0.15 -0.98 -0.73 6.67 -0.00 0.56 0.14 114.38 120.19 2dk8 h ARG 53 Ca 0.44 0.07 0.11 0.00 -0.50 0.00 0.00 59.98 60.10 2dk8 h ARG 53 Cb 0.81 0.22 -0.08 0.00 0.00 0.00 0.00 29.97 30.92 2dk8 h ARG 53 CO -0.64 -0.66 0.35 -0.07 0.00 0.00 0.00 179.97 178.95 2dk8 h LEU 54 N -1.02 0.42 -0.33 3.04 3.38 0.12 1.41 115.31 122.33 2dk8 h LEU 54 Ca -0.08 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2dk8 h LEU 54 Cb 0.85 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.53 2dk8 h LEU 54 CO 0.02 0.22 -0.23 -0.07 0.09 0.00 0.00 178.44 178.46 2dk8 h LEU 55 N 0.56 -0.77 0.34 1.67 3.38 0.15 0.24 115.31 120.87 2dk8 h LEU 55 Ca 0.37 0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.48 2dk8 h LEU 55 Cb 0.45 0.38 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2dk8 h LEU 55 CO -0.31 -0.26 -0.16 -1.28 0.09 0.00 0.00 178.44 176.52 2dk8 h SER 56 N -0.20 -0.38 -1.71 -0.43 0.87 0.40 -3.13 113.55 108.97 2dk8 h SER 56 Ca 0.17 -0.11 0.50 0.00 -1.23 0.00 0.00 61.79 61.11 2dk8 h SER 56 Cb 0.46 0.10 -0.07 0.00 -0.44 0.00 0.00 62.40 62.45 2dk8 h SER 56 CO -0.45 0.08 1.34 0.24 -0.53 0.00 0.00 176.83 177.51 2dk8 h MET 57 N -1.04 0.00 0.00 2.24 2.86 0.21 -3.43 114.93 115.77 2dk8 h MET 57 Ca -0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2dk8 h MET 57 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 2dk8 h MET 57 CO 0.08 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.46 2dk8 n GLY 58 N -1.87 0.66 0.07 8.32 0.00 0.68 -4.94 105.19 108.10 2dk8 n GLY 58 Ca 0.38 -0.59 0.06 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.56 0.64 -4.38 1.61 1.13 -0.21 -4.66 117.38 108.94 2dk8 n GLN 59 Ca 0.00 -0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 54.77 2dk8 n GLN 59 Cb 0.00 -1.66 -0.13 0.00 0.11 0.00 0.00 30.24 28.56 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 -5.13 2.43 -0.17 1.08 2.96 -0.90 -3.04 118.68 115.91 2dk8 s LEU 60 Ca -0.05 -0.69 0.01 0.00 -0.22 0.00 0.00 54.13 53.18 2dk8 s LEU 60 Cb 0.11 -1.32 0.02 0.00 0.50 0.00 0.00 46.19 45.50 2dk8 s LEU 60 CO 0.85 0.18 -0.19 -1.81 -1.32 0.00 0.00 176.35 174.07 2dk8 s ASP 61 N -2.05 3.01 -0.25 3.68 1.01 0.21 -4.32 116.67 117.96 2dk8 s ASP 61 Ca 0.15 -0.61 -0.21 0.00 0.71 0.00 0.00 52.55 52.59 2dk8 s ASP 61 Cb -0.10 -1.40 -0.02 0.00 1.01 0.00 0.00 42.92 42.41 2dk8 s ASP 61 CO 0.07 -0.01 0.68 -0.22 0.21 0.00 0.00 175.17 175.90 2dk8 s LEU 62 N 1.33 4.07 -0.30 1.23 0.20 -1.26 -0.26 118.68 123.68 2dk8 s LEU 62 Ca 0.05 0.79 0.02 0.00 0.69 0.00 0.00 54.13 55.68 2dk8 s LEU 62 Cb -0.13 -2.94 0.07 0.00 -0.43 0.00 0.00 46.19 42.76 2dk8 s LEU 62 CO -0.12 -0.41 -0.02 -0.22 -0.29 0.00 0.00 176.35 175.29 2dk8 s LEU 63 N 2.59 4.03 -0.52 -0.68 0.20 0.38 -4.95 118.68 119.74 2dk8 s LEU 63 Ca 0.28 -1.63 -0.28 0.00 0.69 0.00 0.00 54.13 53.19 2dk8 s LEU 63 Cb -0.15 -1.62 0.01 0.00 -0.43 0.00 0.00 46.19 43.99 2dk8 s LEU 63 CO 0.08 -0.28 1.43 -0.13 -0.29 0.00 0.00 176.35 177.16 2dk8 s ARG 64 N 1.08 3.36 -0.07 1.98 0.52 -1.26 0.31 118.95 124.87 2dk8 s ARG 64 Ca -0.02 0.61 -0.05 0.00 -0.52 0.00 0.00 55.73 55.76 2dk8 s ARG 64 Cb -0.20 -4.10 0.03 0.00 0.52 0.00 0.00 34.95 31.20 2dk8 s ARG 64 CO -0.05 -1.85 0.17 -1.12 0.02 0.00 0.00 175.30 172.47 2dk8 s SER 65 N 4.40 -0.17 0.83 0.23 0.01 -1.25 -4.96 113.70 112.79 2dk8 s SER 65 Ca 0.56 0.35 0.00 0.00 1.31 0.00 0.00 55.95 58.17 2dk8 s SER 65 Cb -0.12 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.41 2dk8 s SER 65 CO 0.27 -0.11 0.00 0.59 0.41 0.00 0.00 173.24 174.41 2dk8 n ASN 66 N 3.61 -1.07 0.00 2.44 4.13 -1.26 -4.31 115.26 118.80 2dk8 n ASN 66 Ca -0.19 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.07 2dk8 n ASN 66 Cb 0.55 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.79 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 0.00 0.00 -0.66 3.41 -1.04 -1.26 -4.81 114.28 109.92 2dk8 n THR 67 Ca 0.00 0.48 -0.27 0.00 -2.04 0.00 0.00 64.05 62.22 2dk8 n THR 67 Cb 0.00 -1.36 0.24 0.00 -1.82 0.00 0.00 70.33 67.39 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 0.00 -3.24 3.98 3.41 0.00 -1.26 -5.05 105.19 103.03 2dk8 n GLY 68 Ca 0.00 -1.40 -0.20 0.00 0.00 0.00 0.00 46.02 44.42 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 3.90 0.12 0.99 1.43 -1.26 -3.88 118.68 119.98 2dk8 s LEU 69 Ca 0.62 -0.09 0.11 0.00 -1.03 0.00 0.00 54.13 53.74 2dk8 s LEU 69 Cb -0.08 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.26 2dk8 s LEU 69 CO 0.49 -0.50 -0.27 -0.22 0.23 0.00 0.00 176.35 176.09 2dk8 s LEU 70 N -4.26 2.32 -0.13 1.79 0.20 0.15 -4.40 118.68 114.35 2dk8 s LEU 70 Ca 0.46 -0.73 -0.00 0.00 0.69 0.00 0.00 54.13 54.55 2dk8 s LEU 70 Cb -0.10 -1.24 0.03 0.00 -0.43 0.00 0.00 46.19 44.45 2dk8 s LEU 70 CO 0.33 0.19 -0.10 -0.31 -0.29 0.00 0.00 176.35 176.16 2dk8 s TYR 71 N -1.04 1.81 0.41 5.38 2.02 -0.09 0.14 117.35 125.99 2dk8 s TYR 71 Ca 0.14 -0.99 0.04 0.00 -0.37 0.00 0.00 57.07 55.89 2dk8 s TYR 71 Cb -0.10 -1.40 -0.04 0.00 -0.40 0.00 0.00 41.96 40.02 2dk8 s TYR 71 CO 0.06 -0.59 0.06 -0.98 -1.57 0.00 0.00 175.55 172.53 2dk8 s ARG 72 N 1.60 1.92 0.00 -0.62 1.70 0.64 0.30 118.95 124.49 2dk8 s ARG 72 Ca 0.05 -2.15 -0.30 0.00 -0.47 0.00 0.00 55.73 52.86 2dk8 s ARG 72 Cb -0.13 -1.03 -0.05 0.00 -0.57 0.00 0.00 34.95 33.16 2dk8 s ARG 72 CO -0.09 -0.31 1.37 0.42 -1.08 0.00 0.00 175.30 175.61 2dk8 s ILE 73 N -3.09 3.76 0.39 4.99 -1.09 -1.17 0.67 121.20 125.65 2dk8 s ILE 73 Ca 0.25 1.15 -0.27 0.00 -2.23 0.00 0.00 60.65 59.54 2dk8 s ILE 73 Cb 0.05 -3.74 -0.09 0.00 -1.58 0.00 0.00 42.46 37.10 2dk8 s ILE 73 CO 0.13 0.01 1.36 -0.75 -1.23 0.00 0.00 174.94 174.45 2dk8 s LYS 74 N 2.26 4.04 0.09 2.79 2.20 -1.17 -4.70 119.74 125.26 2dk8 s LYS 74 Ca 0.63 2.29 0.00 0.00 -0.36 0.00 0.00 55.97 58.53 2dk8 s LYS 74 Cb -0.31 -2.85 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 2dk8 s LYS 74 CO 0.26 -0.48 0.00 -3.47 -0.36 0.00 0.00 175.35 171.30 2dk8 n ASP 75 N 0.29 -0.81 -4.34 1.43 -0.08 -1.26 -4.96 116.55 106.82 2dk8 n ASP 75 Ca 0.03 0.18 -0.46 0.00 -1.51 0.00 0.00 54.79 53.03 2dk8 n ASP 75 Cb 0.42 1.14 -0.04 0.00 2.34 0.00 0.00 41.12 44.98 2dk8 n ASP 75 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2dk8 s SER 76 N -2.13 6.33 0.00 1.67 0.01 -1.26 -4.97 113.70 113.35 2dk8 s SER 76 Ca 0.00 -1.89 0.00 0.00 1.31 0.00 0.00 55.95 55.37 2dk8 s SER 76 Cb 0.00 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 63.99 2dk8 s SER 76 CO 0.00 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.38 2dk8 n GLY 77 N 5.01 1.34 3.62 3.44 0.00 -1.26 -5.12 105.19 112.22 2dk8 n GLY 77 Ca -0.05 -0.53 -0.43 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 3.84 -0.30 1.61 0.04 -1.26 -4.93 135.00 132.00 2dk8 s PRO 78 Ca 0.00 1.23 -0.14 0.00 0.04 0.00 0.00 61.00 62.14 2dk8 s PRO 78 Cb 0.00 -3.92 0.18 0.00 0.04 0.00 0.00 34.50 30.79 2dk8 s PRO 78 CO 0.00 -1.22 1.04 0.45 0.04 0.00 0.00 177.00 177.31 2dk8 s SER 79 N 3.16 -0.49 -0.06 6.66 0.15 -1.26 -5.11 113.70 116.74 2dk8 s SER 79 Ca 0.59 0.43 0.01 0.00 0.70 0.00 0.00 55.95 57.68 2dk8 s SER 79 Cb -0.17 1.46 0.02 0.00 -1.71 0.00 0.00 66.02 65.62 2dk8 s SER 79 CO 0.25 -0.09 -0.07 -0.94 1.20 0.00 0.00 173.24 173.59 2dk8 s SER 80 N 2.72 1.39 0.00 5.45 1.04 -1.26 -5.17 113.70 117.87 2dk8 s SER 80 Ca -0.00 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2dk8 s SER 80 Cb -0.08 -0.61 0.00 0.00 0.10 0.00 0.00 66.02 65.42 2dk8 s SER 80 CO -0.14 -0.04 0.10 0.61 0.98 0.00 0.00 173.24 174.76