#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 -9.04 -4.54 1.61 7.64 -1.26 -4.57 113.62 103.46 2dk8 n SER 2 Ca 0.00 1.43 -0.32 0.00 1.01 0.00 0.00 58.87 60.99 2dk8 n SER 2 Cb 0.00 -5.10 -0.08 0.00 -1.01 0.00 0.00 64.21 58.03 2dk8 n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dk8 n SER 3 N 1.91 1.54 0.00 6.43 3.41 -1.26 -3.94 113.62 121.71 2dk8 n SER 3 Ca 0.00 -0.56 0.00 0.00 -0.26 0.00 0.00 58.87 58.05 2dk8 n SER 3 Cb 0.00 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 62.56 2dk8 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dk8 n GLY 4 N 6.23 1.22 3.61 5.00 0.00 -1.26 -5.02 105.19 114.96 2dk8 n GLY 4 Ca 0.47 -0.74 -0.02 0.00 0.00 0.00 0.00 46.02 45.73 2dk8 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dk8 s SER 5 N 0.00 -0.11 -0.46 1.61 0.01 -1.25 -5.06 113.70 108.44 2dk8 s SER 5 Ca 0.00 -0.07 -0.35 0.00 1.31 0.00 0.00 55.95 56.84 2dk8 s SER 5 Cb 0.00 0.17 -0.13 0.00 0.21 0.00 0.00 66.02 66.26 2dk8 s SER 5 CO 0.00 -0.29 2.26 -1.54 0.41 0.00 0.00 173.24 174.08 2dk8 n SER 6 N -0.27 1.73 0.00 2.44 3.41 -1.26 -4.48 113.62 115.19 2dk8 n SER 6 Ca -0.04 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.91 2dk8 n SER 6 Cb 0.60 -1.20 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 2dk8 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dk8 n GLY 7 N 6.64 -0.23 3.20 5.00 0.00 -1.26 -5.00 105.19 113.54 2dk8 n GLY 7 Ca 0.46 -0.73 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 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 2.25 -3.39 1.61 -0.04 -1.26 -4.70 135.00 129.46 2dk8 n PRO 8 Ca 0.00 -2.48 0.03 0.00 -0.04 0.00 0.00 63.50 61.00 2dk8 n PRO 8 Cb 0.00 -3.31 -0.05 0.00 -0.04 0.00 0.00 33.50 30.10 2dk8 n PRO 8 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dk8 s ASP 9 N 4.64 -0.13 -0.11 3.54 1.01 -1.26 -4.99 116.67 119.37 2dk8 s ASP 9 Ca 0.56 0.19 0.09 0.00 0.71 0.00 0.00 52.55 54.09 2dk8 s ASP 9 Cb 0.09 1.11 0.45 0.00 1.01 0.00 0.00 42.92 45.58 2dk8 s ASP 9 CO 0.06 -0.03 1.23 0.00 0.21 0.00 0.00 175.17 176.64 2dk8 n ALA 10 N 4.00 3.13 -1.58 5.23 0.00 -1.26 -4.74 120.51 125.29 2dk8 n ALA 10 Ca -0.11 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.30 2dk8 n ALA 10 Cb 0.56 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.95 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 0.43 -8.50 0.09 0.00 2.03 -1.26 -3.97 116.55 105.37 2dk8 n ASP 11 Ca 0.15 1.78 -0.05 0.00 0.52 0.00 0.00 54.79 57.19 2dk8 n ASP 11 Cb 0.71 -5.05 -0.02 0.00 -0.72 0.00 0.00 41.12 36.04 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 0.41 -0.31 -0.98 -0.67 0.13 -1.95 -2.83 132.00 125.80 2dk8 h PRO 12 Ca 0.00 0.02 0.17 0.00 -0.87 0.00 0.00 66.00 65.32 2dk8 h PRO 12 Cb 0.81 0.07 -0.17 0.00 0.13 0.00 0.00 31.00 31.84 2dk8 h PRO 12 CO 0.00 -0.21 -0.34 -0.24 -0.23 0.00 0.00 178.00 176.99 2dk8 h VAL 13 N -1.03 0.01 0.19 1.56 3.04 -1.99 0.20 116.25 118.23 2dk8 h VAL 13 Ca -0.03 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 2dk8 h VAL 13 Cb 0.25 0.01 -0.03 0.00 -2.01 0.00 0.00 31.29 29.51 2dk8 h VAL 13 CO 0.05 0.00 -0.41 -0.33 -1.01 0.00 0.00 177.57 175.88 2dk8 h GLU 14 N -0.01 -0.63 -0.68 4.17 4.39 -1.78 0.23 114.58 120.28 2dk8 h GLU 14 Ca 0.39 0.04 0.08 0.00 0.34 0.00 0.00 59.36 60.21 2dk8 h GLU 14 Cb 0.64 0.14 -0.10 0.00 -0.10 0.00 0.00 28.75 29.33 2dk8 h GLU 14 CO -0.99 -0.42 -0.53 0.82 -1.16 0.00 0.00 179.01 176.73 2dk8 h ILE 15 N -0.65 0.02 -0.17 3.13 2.04 -0.55 0.27 117.51 121.59 2dk8 h ILE 15 Ca -0.02 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.87 2dk8 h ILE 15 Cb 0.62 0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 36.66 2dk8 h ILE 15 CO -0.16 0.00 -0.52 -0.33 0.00 0.00 0.00 178.15 177.13 2dk8 h GLU 16 N -0.21 -0.51 -0.97 2.37 5.08 -0.37 -1.38 114.58 118.60 2dk8 h GLU 16 Ca 0.14 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.65 2dk8 h GLU 16 Cb 0.53 0.12 -0.14 0.00 0.50 0.00 0.00 28.75 29.76 2dk8 h GLU 16 CO -0.75 -0.34 -0.49 -0.91 -1.00 0.00 0.00 179.01 175.52 2dk8 h ASN 17 N -0.53 -1.80 -0.82 1.42 2.35 0.95 0.65 115.58 117.80 2dk8 h ASN 17 Ca 0.04 0.32 0.15 0.00 -0.55 0.00 0.00 56.30 56.26 2dk8 h ASN 17 Cb 0.64 0.85 -0.15 0.00 0.05 0.00 0.00 38.32 39.70 2dk8 h ASN 17 CO -0.44 -0.26 -0.27 0.03 -1.65 0.00 0.00 177.43 174.84 2dk8 h ARG 18 N -0.02 -0.03 -0.46 0.81 2.47 0.07 0.67 114.38 117.89 2dk8 h ARG 18 Ca 0.25 0.00 0.05 0.00 -1.26 0.00 0.00 59.98 59.02 2dk8 h ARG 18 Cb 0.51 0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 28.79 2dk8 h ARG 18 CO -0.94 -0.02 0.20 0.82 0.56 0.00 0.00 179.97 180.59 2dk8 h ILE 19 N -0.03 0.91 0.07 2.04 2.04 0.85 -1.30 117.51 122.09 2dk8 h ILE 19 Ca 0.36 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 66.10 2dk8 h ILE 19 Cb 0.60 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.10 2dk8 h ILE 19 CO -0.85 0.07 -0.49 0.40 0.00 0.00 0.00 178.15 177.28 2dk8 h ILE 20 N 0.41 0.05 -1.01 -0.67 1.08 0.23 1.55 117.51 119.15 2dk8 h ILE 20 Ca 0.21 0.00 0.25 0.00 -0.39 0.00 0.00 64.86 64.93 2dk8 h ILE 20 Cb 0.16 0.05 -0.09 0.00 -3.07 0.00 0.00 36.82 33.87 2dk8 h ILE 20 CO -0.18 0.00 0.65 -0.33 -0.69 0.00 0.00 178.15 177.60 2dk8 h GLU 21 N -0.69 0.43 0.17 2.37 5.08 -0.50 0.39 114.58 121.83 2dk8 h GLU 21 Ca 0.01 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2dk8 h GLU 21 Cb 0.72 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2dk8 h GLU 21 CO -0.31 0.28 -0.08 -0.07 -1.00 0.00 0.00 179.01 177.84 2dk8 h LEU 22 N 0.44 -0.19 -1.99 1.33 3.38 0.32 0.03 115.31 118.63 2dk8 h LEU 22 Ca 0.58 -0.33 0.29 0.00 0.09 0.00 0.00 57.88 58.50 2dk8 h LEU 22 Cb 1.38 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 42.14 2dk8 h LEU 22 CO -0.29 0.36 0.73 0.00 0.09 0.00 0.00 178.44 179.33 2dk8 h HIS 24 N 0.00 0.64 -0.34 0.00 3.86 -0.18 -3.23 115.15 115.90 2dk8 h HIS 24 Ca 0.48 -0.42 -0.03 0.00 -1.16 0.00 0.00 60.37 59.24 2dk8 h HIS 24 Cb 1.94 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 30.35 2dk8 h HIS 24 CO 0.00 1.29 0.09 1.96 0.86 0.00 0.00 177.93 182.12 2dk8 h GLN 25 N -0.19 0.48 -4.80 2.45 1.08 0.22 -3.37 115.11 110.99 2dk8 h GLN 25 Ca -0.13 -0.07 -0.67 0.00 -1.45 0.00 0.00 58.65 56.33 2dk8 h GLN 25 Cb 1.59 -0.09 -0.38 0.00 -0.05 0.00 0.00 27.48 28.55 2dk8 h GLN 25 CO 0.16 0.45 -0.76 -0.06 -0.95 0.00 0.00 178.83 177.66 2dk8 s PHE 26 N -5.14 3.44 0.15 2.96 0.40 0.18 -4.96 117.98 115.02 2dk8 s PHE 26 Ca -0.07 -2.53 0.13 0.00 -0.60 0.00 0.00 56.93 53.85 2dk8 s PHE 26 Cb 0.16 -2.29 0.28 0.00 0.51 0.00 0.00 43.02 41.68 2dk8 s PHE 26 CO 0.75 -0.90 1.55 -1.00 0.70 0.00 0.00 175.22 176.31 2dk8 h PRO 27 N 7.73 0.00 -0.15 0.24 0.13 -1.74 -3.12 132.00 135.10 2dk8 h PRO 27 Ca -0.14 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.81 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 0.49 0.62 -0.65 0.45 -0.23 0.00 0.00 178.00 178.68 2dk8 h HIS 28 N 0.00 0.74 0.00 1.56 3.86 -1.93 -3.41 115.15 115.98 2dk8 h HIS 28 Ca -0.01 -0.30 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 2dk8 h HIS 28 Cb 1.23 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.57 2dk8 h HIS 28 CO 0.00 1.06 0.00 0.41 0.86 0.00 0.00 177.93 180.26 2dk8 n GLY 29 N 0.45 2.78 3.51 2.45 0.00 -1.18 -4.67 105.19 108.54 2dk8 n GLY 29 Ca -0.04 -1.92 -0.24 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.92 1.24 0.08 -0.61 -4.36 0.52 -4.81 121.20 111.34 2dk8 s ILE 30 Ca 0.00 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.45 2dk8 s ILE 30 Cb 0.00 -2.72 -0.03 0.00 1.25 0.00 0.00 42.46 40.96 2dk8 s ILE 30 CO 0.00 0.00 -0.15 0.42 0.24 0.00 0.00 174.94 175.45 2dk8 s THR 31 N -3.16 1.22 0.45 8.37 -4.23 -1.26 -0.52 115.64 116.51 2dk8 s THR 31 Ca 0.32 -1.40 0.33 0.00 -1.18 0.00 0.00 61.69 59.77 2dk8 s THR 31 Cb 0.08 -1.20 0.52 0.00 1.34 0.00 0.00 72.50 73.23 2dk8 s THR 31 CO 0.15 -0.23 1.58 -2.24 -0.54 0.00 0.00 174.62 173.34 2dk8 h ASP 32 N 4.15 0.19 0.46 3.99 3.04 -2.00 1.03 116.42 127.28 2dk8 h ASP 32 Ca -0.41 0.15 -0.02 0.00 -3.24 0.00 0.00 57.03 53.50 2dk8 h ASP 32 Cb 1.19 0.15 0.00 0.00 -1.04 0.00 0.00 39.33 39.64 2dk8 h ASP 32 CO 0.42 -0.24 -0.22 1.56 -2.04 0.00 0.00 179.24 178.71 2dk8 h GLN 33 N 0.01 -0.60 -0.06 4.15 4.20 -1.96 -0.96 115.11 119.89 2dk8 h GLN 33 Ca 0.88 0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.65 2dk8 h GLN 33 Cb 2.89 0.14 -0.03 0.00 0.30 0.00 0.00 27.48 30.77 2dk8 h GLN 33 CO -0.44 -0.40 -0.22 0.28 -0.67 0.00 0.00 178.83 177.38 2dk8 h VAL 34 N -0.62 0.00 -0.59 -0.54 2.07 0.70 0.72 116.25 117.98 2dk8 h VAL 34 Ca -0.06 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.63 2dk8 h VAL 34 Cb 0.48 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 2dk8 h VAL 34 CO 0.10 0.00 0.74 0.40 0.02 0.00 0.00 177.57 178.84 2dk8 h ILE 35 N -0.24 0.19 0.15 4.57 2.04 -1.45 0.92 117.51 123.69 2dk8 h ILE 35 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 2dk8 h ILE 35 Cb 0.28 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2dk8 h ILE 35 CO -0.18 0.00 -0.07 -0.61 0.00 0.00 0.00 178.15 177.29 2dk8 h GLN 36 N 0.00 -0.19 0.00 2.37 4.15 0.17 1.48 115.11 123.09 2dk8 h GLN 36 Ca 0.28 0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.66 2dk8 h GLN 36 Cb 1.77 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 29.49 2dk8 h GLN 36 CO -0.00 0.26 -0.26 -0.91 -1.93 0.00 0.00 178.83 175.99 2dk8 h ASN 37 N -0.82 0.00 0.05 -0.69 2.35 0.28 0.51 115.58 117.27 2dk8 h ASN 37 Ca -0.02 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.58 2dk8 h ASN 37 Cb 0.54 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.90 2dk8 h ASN 37 CO 0.03 0.26 -0.74 -0.33 -1.65 0.00 0.00 177.43 175.00 2dk8 h GLU 38 N 0.00 0.11 -2.06 0.81 4.39 0.63 -3.41 114.58 115.05 2dk8 h GLU 38 Ca -0.00 -0.19 -0.57 0.00 0.34 0.00 0.00 59.36 58.93 2dk8 h GLU 38 Cb 0.67 0.07 -0.40 0.00 -0.10 0.00 0.00 28.75 28.99 2dk8 h GLU 38 CO 0.03 1.09 -0.99 -1.33 -1.16 0.00 0.00 179.01 176.66 2dk8 n MET 39 N -4.32 1.12 0.00 2.33 2.81 0.51 -4.90 117.12 114.67 2dk8 n MET 39 Ca -0.19 -3.56 0.11 0.00 -1.81 0.00 0.00 57.70 52.25 2dk8 n MET 39 Cb 0.68 -1.47 0.54 0.00 -0.71 0.00 0.00 33.22 32.27 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 1.31 0.23 0.16 0.03 -0.04 0.18 -2.27 135.00 134.59 2dk8 n PRO 40 Ca 0.23 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.90 2dk8 n PRO 40 Cb 0.50 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.72 2dk8 n PRO 40 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 2dk8 h HIS 41 N 0.00 0.00 -4.20 0.54 2.07 -1.90 -3.46 115.15 108.20 2dk8 h HIS 41 Ca 0.00 0.00 -0.50 0.00 -2.85 0.00 0.00 60.37 57.02 2dk8 h HIS 41 Cb 0.26 0.00 0.14 0.00 2.57 0.00 0.00 27.41 30.38 2dk8 h HIS 41 CO 0.00 0.00 0.29 0.42 -3.07 0.00 0.00 177.93 175.57 2dk8 s ILE 42 N -3.17 3.02 0.45 6.12 -1.09 -0.96 -5.05 121.20 120.52 2dk8 s ILE 42 Ca 0.08 0.33 0.02 0.00 -2.23 0.00 0.00 60.65 58.86 2dk8 s ILE 42 Cb 0.09 -2.85 0.01 0.00 -1.58 0.00 0.00 42.46 38.13 2dk8 s ILE 42 CO 0.65 -0.43 0.65 -1.61 -1.23 0.00 0.00 174.94 172.97 2dk8 s GLU 43 N -4.94 2.91 0.06 2.79 2.02 -1.26 -4.94 118.70 115.34 2dk8 s GLU 43 Ca 0.62 -0.73 -0.31 0.00 0.02 0.00 0.00 54.97 54.56 2dk8 s GLU 43 Cb -0.17 -2.61 -0.18 0.00 0.10 0.00 0.00 34.13 31.27 2dk8 s GLU 43 CO 0.56 -0.33 1.58 0.00 0.02 0.00 0.00 175.26 177.09 2dk8 h ALA 44 N 0.42 -0.81 -0.00 5.21 0.00 -1.98 0.93 119.26 123.03 2dk8 h ALA 44 Ca -0.44 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 2dk8 h ALA 44 Cb 1.27 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.37 2dk8 h ALA 44 CO 0.54 -0.93 0.00 0.37 0.00 0.00 0.00 179.25 179.23 2dk8 h GLN 45 N -0.85 0.01 -0.94 0.00 -0.00 -1.98 -1.75 115.11 109.60 2dk8 h GLN 45 Ca -0.08 -0.00 0.24 0.00 -0.00 0.00 0.00 58.65 58.80 2dk8 h GLN 45 Cb 0.63 -0.00 -0.06 0.00 0.00 0.00 0.00 27.48 28.05 2dk8 h GLN 45 CO 0.14 0.24 0.64 1.96 0.00 0.00 0.00 178.83 181.80 2dk8 h GLN 46 N -0.22 0.26 -0.02 1.69 1.08 -1.95 1.65 115.11 117.61 2dk8 h GLN 46 Ca 0.00 -0.02 -0.19 0.00 -1.45 0.00 0.00 58.65 56.99 2dk8 h GLN 46 Cb 0.23 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 2dk8 h GLN 46 CO 0.00 0.17 -0.83 0.00 -0.95 0.00 0.00 178.83 177.22 2dk8 h ARG 47 N 0.27 0.25 0.01 1.46 3.08 -0.39 -2.97 114.38 116.08 2dk8 h ARG 47 Ca 0.48 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 60.29 2dk8 h ARG 47 Cb 1.44 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.55 2dk8 h ARG 47 CO -0.14 0.94 -0.00 0.00 -1.07 0.00 0.00 179.97 179.70 2dk8 h ALA 48 N 0.98 -0.01 -0.25 0.04 0.00 0.11 -2.97 119.26 117.15 2dk8 h ALA 48 Ca -0.04 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.69 2dk8 h ALA 48 Cb 1.43 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 2dk8 h ALA 48 CO 0.13 -0.01 -0.15 0.28 0.00 0.00 0.00 179.25 179.50 2dk8 n VAL 49 N -4.72 -0.17 -0.24 0.00 0.31 0.50 0.18 118.33 114.20 2dk8 n VAL 49 Ca -0.04 1.73 0.00 0.00 -0.01 0.00 0.00 64.34 66.02 2dk8 n VAL 49 Cb 0.20 -2.25 0.07 0.00 -0.91 0.00 0.00 33.84 30.95 2dk8 n VAL 49 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dk8 h ALA 50 N -0.62 0.45 0.34 3.52 0.00 -1.69 0.68 119.26 121.94 2dk8 h ALA 50 Ca 0.04 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 2dk8 h ALA 50 Cb 0.10 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2dk8 h ALA 50 CO -0.24 -0.42 -0.44 0.82 0.00 0.00 0.00 179.25 178.97 2dk8 h ILE 51 N -0.00 0.00 -0.49 0.00 2.04 -0.08 0.26 117.51 119.23 2dk8 h ILE 51 Ca 0.33 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.29 2dk8 h ILE 51 Cb 0.51 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.49 2dk8 h ILE 51 CO -0.71 0.00 -0.26 -1.13 0.00 0.00 0.00 178.15 176.05 2dk8 h ASN 52 N -0.81 -0.89 -0.15 1.72 -0.73 0.35 0.76 115.58 115.83 2dk8 h ASN 52 Ca -0.04 0.19 0.04 0.00 1.87 0.00 0.00 56.30 58.36 2dk8 h ASN 52 Cb 0.72 0.46 -0.07 0.00 0.27 0.00 0.00 38.32 39.71 2dk8 h ASN 52 CO -0.11 -0.27 -0.47 0.03 -0.37 0.00 0.00 177.43 176.24 2dk8 h ARG 53 N -0.15 -0.51 -0.71 6.67 -0.00 0.79 0.40 114.38 120.88 2dk8 h ARG 53 Ca 0.22 0.03 0.08 0.00 -0.50 0.00 0.00 59.98 59.81 2dk8 h ARG 53 Cb 0.50 0.11 -0.06 0.00 0.00 0.00 0.00 29.97 30.52 2dk8 h ARG 53 CO -0.58 -0.34 0.38 -0.07 0.00 0.00 0.00 179.97 179.37 2dk8 h LEU 54 N -0.52 0.54 -0.40 3.04 3.38 0.75 1.41 115.31 123.52 2dk8 h LEU 54 Ca 0.06 0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.15 2dk8 h LEU 54 Cb 0.65 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.28 2dk8 h LEU 54 CO -0.43 0.33 -0.00 -0.07 0.09 0.00 0.00 178.44 178.36 2dk8 h LEU 55 N 0.68 -0.17 0.36 1.67 3.38 0.23 0.11 115.31 121.57 2dk8 h LEU 55 Ca 0.33 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.38 2dk8 h LEU 55 Cb 0.28 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2dk8 h LEU 55 CO -0.22 -0.05 -0.17 -1.28 0.09 0.00 0.00 178.44 176.81 2dk8 h SER 56 N 0.10 -0.41 -1.42 -0.43 0.87 0.99 -3.21 113.55 110.05 2dk8 h SER 56 Ca 0.20 0.01 0.47 0.00 -1.23 0.00 0.00 61.79 61.24 2dk8 h SER 56 Cb 0.28 0.11 -0.12 0.00 -0.44 0.00 0.00 62.40 62.23 2dk8 h SER 56 CO -0.33 -0.01 0.94 0.23 -0.53 0.00 0.00 176.83 177.13 2dk8 n MET 57 N -4.87 -0.03 -0.20 2.24 2.81 0.47 -4.71 117.12 112.84 2dk8 n MET 57 Ca -0.06 1.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.96 2dk8 n MET 57 Cb 0.19 -2.30 0.00 0.00 -0.71 0.00 0.00 33.22 30.40 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 -1.57 0.90 0.07 3.03 0.00 0.24 -4.97 105.19 102.88 2dk8 n GLY 58 Ca 0.38 -0.21 0.04 0.00 0.00 0.00 0.00 46.02 46.23 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 -2.17 0.65 -4.59 1.61 1.13 -0.26 -4.75 117.38 109.00 2dk8 n GLN 59 Ca 0.00 -0.00 -0.28 0.00 -1.94 0.00 0.00 57.00 54.78 2dk8 n GLN 59 Cb 0.00 -1.64 -0.14 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 -5.18 2.24 -0.16 1.08 2.96 -0.84 -3.35 118.68 115.42 2dk8 s LEU 60 Ca -0.06 -0.65 0.00 0.00 -0.22 0.00 0.00 54.13 53.21 2dk8 s LEU 60 Cb 0.10 -1.14 0.00 0.00 0.50 0.00 0.00 46.19 45.65 2dk8 s LEU 60 CO 0.85 0.18 -0.16 -0.62 -1.32 0.00 0.00 176.35 175.28 2dk8 s ASP 61 N -1.60 3.58 -0.21 3.68 -1.08 0.13 -4.16 116.67 117.01 2dk8 s ASP 61 Ca 0.11 -0.50 -0.23 0.00 -0.52 0.00 0.00 52.55 51.41 2dk8 s ASP 61 Cb -0.10 -1.55 -0.02 0.00 -1.46 0.00 0.00 42.92 39.79 2dk8 s ASP 61 CO 0.04 0.06 0.72 -0.22 0.52 0.00 0.00 175.17 176.29 2dk8 s LEU 62 N 0.93 4.13 -0.27 -1.34 0.20 -1.26 -1.19 118.68 119.88 2dk8 s LEU 62 Ca -0.03 0.93 0.03 0.00 0.69 0.00 0.00 54.13 55.75 2dk8 s LEU 62 Cb -0.15 -3.02 0.07 0.00 -0.43 0.00 0.00 46.19 42.65 2dk8 s LEU 62 CO -0.02 -0.37 -0.07 -0.22 -0.29 0.00 0.00 176.35 175.38 2dk8 s LEU 63 N 2.24 3.45 -0.51 -0.68 0.20 0.25 -4.95 118.68 118.69 2dk8 s LEU 63 Ca 0.32 -1.48 -0.28 0.00 0.69 0.00 0.00 54.13 53.38 2dk8 s LEU 63 Cb -0.16 -1.48 0.01 0.00 -0.43 0.00 0.00 46.19 44.14 2dk8 s LEU 63 CO 0.10 -0.23 1.42 -0.13 -0.29 0.00 0.00 176.35 177.22 2dk8 s ARG 64 N 1.14 3.38 0.40 1.98 0.52 -1.26 0.12 118.95 125.22 2dk8 s ARG 64 Ca -0.05 0.62 0.08 0.00 -0.52 0.00 0.00 55.73 55.85 2dk8 s ARG 64 Cb -0.20 -4.10 -0.06 0.00 0.52 0.00 0.00 34.95 31.12 2dk8 s ARG 64 CO -0.06 -1.83 0.12 -1.54 0.02 0.00 0.00 175.30 172.01 2dk8 s SER 65 N 4.34 4.29 -0.44 0.23 1.04 -1.22 -4.94 113.70 117.00 2dk8 s SER 65 Ca 0.56 -1.11 -0.44 0.00 0.48 0.00 0.00 55.95 55.43 2dk8 s SER 65 Cb -0.12 -0.48 -0.18 0.00 0.10 0.00 0.00 66.02 65.34 2dk8 s SER 65 CO 0.27 -0.47 1.78 0.59 0.98 0.00 0.00 173.24 176.39 2dk8 n ASN 66 N -1.14 1.44 -1.80 7.02 4.13 -1.26 -4.03 115.26 119.63 2dk8 n ASN 66 Ca -0.02 1.02 0.00 0.00 1.68 0.00 0.00 54.58 57.25 2dk8 n ASN 66 Cb 0.65 -0.97 0.00 0.00 -1.54 0.00 0.00 39.78 37.92 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 4.83 -8.56 -1.27 3.41 -1.04 -1.26 -4.93 114.28 105.45 2dk8 n THR 67 Ca 0.35 2.73 0.17 0.00 -2.04 0.00 0.00 64.05 65.27 2dk8 n THR 67 Cb 0.00 -4.13 -0.05 0.00 -1.82 0.00 0.00 70.33 64.34 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 1.01 -1.78 3.79 3.41 0.00 -1.26 -4.91 105.19 105.45 2dk8 n GLY 68 Ca 0.00 -0.97 -0.22 0.00 0.00 0.00 0.00 46.02 44.83 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 -6.41 3.41 0.23 0.99 1.43 -1.26 -3.39 118.68 113.68 2dk8 s LEU 69 Ca 0.00 -0.66 0.10 0.00 -1.03 0.00 0.00 54.13 52.54 2dk8 s LEU 69 Cb 0.00 -1.95 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 2dk8 s LEU 69 CO 0.00 -0.34 -0.18 -0.22 0.23 0.00 0.00 176.35 175.85 2dk8 s LEU 70 N -3.92 2.55 -0.05 1.79 0.20 0.32 -4.51 118.68 115.06 2dk8 s LEU 70 Ca 0.39 -1.00 -0.01 0.00 0.69 0.00 0.00 54.13 54.21 2dk8 s LEU 70 Cb -0.04 -0.89 0.03 0.00 -0.43 0.00 0.00 46.19 44.86 2dk8 s LEU 70 CO 0.24 -0.05 0.01 -0.31 -0.29 0.00 0.00 176.35 175.95 2dk8 s TYR 71 N -2.61 0.49 0.39 5.38 2.02 0.32 0.85 117.35 124.19 2dk8 s TYR 71 Ca 0.25 -0.06 0.04 0.00 -0.37 0.00 0.00 57.07 56.92 2dk8 s TYR 71 Cb -0.03 -0.64 -0.03 0.00 -0.40 0.00 0.00 41.96 40.86 2dk8 s TYR 71 CO 0.10 -0.24 0.11 -0.98 -1.57 0.00 0.00 175.55 172.97 2dk8 s ARG 72 N 1.65 1.88 0.00 -0.62 1.70 -0.33 0.20 118.95 123.42 2dk8 s ARG 72 Ca -0.01 -2.13 -0.30 0.00 -0.47 0.00 0.00 55.73 52.82 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 -0.03 -0.42 1.34 0.42 -1.08 0.00 0.00 175.30 175.52 2dk8 s ILE 73 N -3.23 3.82 0.36 4.99 -1.09 -1.22 -0.69 121.20 124.12 2dk8 s ILE 73 Ca 0.26 1.21 -0.29 0.00 -2.23 0.00 0.00 60.65 59.61 2dk8 s ILE 73 Cb 0.04 -3.78 -0.11 0.00 -1.58 0.00 0.00 42.46 37.03 2dk8 s ILE 73 CO 0.14 0.01 1.50 -0.75 -1.23 0.00 0.00 174.94 174.62 2dk8 s LYS 74 N 2.13 4.12 0.15 2.79 2.20 -1.21 -4.76 119.74 125.16 2dk8 s LYS 74 Ca 0.62 2.55 -0.29 0.00 -0.36 0.00 0.00 55.97 58.49 2dk8 s LYS 74 Cb -0.30 -2.99 -0.03 0.00 -1.51 0.00 0.00 37.83 33.00 2dk8 s LYS 74 CO 0.26 -0.54 1.56 0.22 -0.36 0.00 0.00 175.35 176.49 2dk8 h ASP 75 N 3.43 -1.71 -2.88 1.43 1.82 -1.92 -3.22 116.42 113.37 2dk8 h ASP 75 Ca -0.50 0.25 -0.70 0.00 -0.39 0.00 0.00 57.03 55.69 2dk8 h ASP 75 Cb 1.23 0.74 -0.19 0.00 0.68 0.00 0.00 39.33 41.79 2dk8 h ASP 75 CO 0.68 -0.36 0.31 -0.44 -1.61 0.00 0.00 179.24 177.82 2dk8 s SER 76 N -5.15 6.33 0.00 2.28 0.01 -1.26 -4.90 113.70 111.02 2dk8 s SER 76 Ca -0.14 -1.64 0.00 0.00 1.31 0.00 0.00 55.95 55.48 2dk8 s SER 76 Cb 0.11 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 64.01 2dk8 s SER 76 CO 0.64 -1.09 0.00 0.61 0.41 0.00 0.00 173.24 173.81 2dk8 n GLY 77 N 5.18 0.13 3.80 3.44 0.00 -1.22 -4.85 105.19 111.68 2dk8 n GLY 77 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 3.57 -0.13 1.61 0.04 -1.26 -5.01 135.00 133.83 2dk8 s PRO 78 Ca 0.00 1.25 -0.06 0.00 0.04 0.00 0.00 61.00 62.23 2dk8 s PRO 78 Cb 0.00 -2.07 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 2dk8 s PRO 78 CO 0.00 -0.61 -0.09 1.03 0.04 0.00 0.00 177.00 177.37 2dk8 h SER 79 N 0.96 0.00 -3.91 6.66 0.87 -2.03 -3.47 113.55 112.63 2dk8 h SER 79 Ca -0.48 -0.02 -0.68 0.00 -1.23 0.00 0.00 61.79 59.37 2dk8 h SER 79 Cb 1.22 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 62.96 2dk8 h SER 79 CO 0.58 0.68 -0.83 -0.55 -0.53 0.00 0.00 176.83 176.18 2dk8 s SER 80 N -5.69 3.64 0.00 6.23 0.15 -1.26 -5.25 113.70 111.52 2dk8 s SER 80 Ca -0.10 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 55.98 2dk8 s SER 80 Cb 0.01 -0.46 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 2dk8 s SER 80 CO 0.15 0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.41