#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kde s GLN 2 N 0.00 1.47 0.22 2.12 0.74 -1.26 0.11 119.66 123.05 2kde s GLN 2 Ca 0.00 -1.43 0.05 0.00 0.05 0.00 0.00 55.36 54.03 2kde s GLN 2 Cb 0.00 -2.78 -0.03 0.00 1.10 0.00 0.00 33.01 31.30 2kde s GLN 2 CO 0.00 -0.81 0.26 0.96 -0.55 0.00 0.00 175.29 175.15 2kde s ILE 3 N 1.19 4.90 -0.05 -2.34 -4.36 -0.45 -0.52 121.20 119.57 2kde s ILE 3 Ca 0.04 -1.08 0.04 0.00 -0.26 0.00 0.00 60.65 59.39 2kde s ILE 3 Cb -0.19 -3.61 -0.02 0.00 1.25 0.00 0.00 42.46 39.89 2kde s ILE 3 CO -0.10 -0.26 -0.16 -0.36 0.24 0.00 0.00 174.94 174.30 2kde s PHE 4 N -1.95 2.65 -0.25 1.37 0.40 -0.19 -0.98 117.98 119.03 2kde s PHE 4 Ca 0.33 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.47 2kde s PHE 4 Cb -0.09 -1.61 0.05 0.00 0.51 0.00 0.00 43.02 41.88 2kde s PHE 4 CO 0.27 0.14 -0.11 0.08 0.70 0.00 0.00 175.22 176.30 2kde s VAL 5 N -0.68 2.26 0.28 -0.44 1.01 0.74 -0.82 120.40 122.74 2kde s VAL 5 Ca 0.11 -1.49 -0.23 0.00 0.00 0.00 0.00 61.98 60.36 2kde s VAL 5 Cb -0.11 -2.27 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 2kde s VAL 5 CO 0.00 0.05 0.85 -0.75 0.00 0.00 0.00 175.10 175.26 2kde s LYS 6 N 1.15 4.45 0.00 2.72 2.20 -0.02 -0.74 119.74 129.50 2kde s LYS 6 Ca -0.06 1.14 0.00 0.00 -0.36 0.00 0.00 55.97 56.69 2kde s LYS 6 Cb -0.19 -2.84 0.00 0.00 -1.51 0.00 0.00 37.83 33.29 2kde s LYS 6 CO -0.06 0.33 0.00 0.25 -0.36 0.00 0.00 175.35 175.52 2kde n THR 7 N 0.65 0.00 -0.91 3.43 -2.24 -0.11 -1.08 114.28 114.02 2kde n THR 7 Ca 0.00 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.59 2kde n THR 7 Cb 0.50 -0.48 0.16 0.00 -2.10 0.00 0.00 70.33 68.42 2kde n THR 7 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2kde n LEU 8 N 0.00 6.19 -1.14 3.22 4.77 -1.26 -4.16 117.00 124.62 2kde n LEU 8 Ca 0.00 -3.29 0.03 0.00 -0.03 0.00 0.00 56.01 52.72 2kde n LEU 8 Cb 0.00 -0.79 0.03 0.00 -2.33 0.00 0.00 43.42 40.33 2kde n LEU 8 CO 0.00 0.96 0.15 0.35 -1.33 0.00 0.00 177.39 177.51 2kde n THR 9 N -0.86 0.21 -2.57 -5.08 -2.24 -1.26 -4.97 114.28 97.52 2kde n THR 9 Ca 0.51 -0.94 -0.19 0.00 -2.27 0.00 0.00 64.05 61.16 2kde n THR 9 Cb 1.50 0.75 0.01 0.00 -2.10 0.00 0.00 70.33 70.48 2kde n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kde n GLY 10 N 0.20 -0.41 2.99 3.38 0.00 -1.26 -4.98 105.19 105.11 2kde n GLY 10 Ca 0.06 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 2kde n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2kde s LYS 11 N -5.17 1.71 -0.08 1.61 2.20 -1.26 -5.00 119.74 113.75 2kde s LYS 11 Ca 0.10 -0.39 0.03 0.00 -0.36 0.00 0.00 55.97 55.35 2kde s LYS 11 Cb -0.04 -1.51 -0.02 0.00 -1.51 0.00 0.00 37.83 34.74 2kde s LYS 11 CO 0.12 -0.07 -0.15 0.99 -0.36 0.00 0.00 175.35 175.88 2kde s THR 12 N 1.00 2.95 -0.05 3.43 2.01 -1.26 -0.93 115.64 122.78 2kde s THR 12 Ca -0.08 -0.74 -0.03 0.00 0.31 0.00 0.00 61.69 61.15 2kde s THR 12 Cb -0.15 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 2kde s THR 12 CO -0.00 0.57 0.10 -0.63 -0.69 0.00 0.00 174.62 173.97 2kde s ILE 13 N -0.29 5.02 -0.35 1.82 1.01 0.08 -4.84 121.20 123.65 2kde s ILE 13 Ca 0.02 -0.16 -0.11 0.00 0.00 0.00 0.00 60.65 60.41 2kde s ILE 13 Cb -0.13 -3.25 0.02 0.00 0.01 0.00 0.00 42.46 39.11 2kde s ILE 13 CO 0.03 0.46 0.19 -0.89 0.00 0.00 0.00 174.94 174.73 2kde s THR 14 N -1.12 4.57 -0.09 2.92 2.01 -1.26 -0.19 115.64 122.49 2kde s THR 14 Ca 0.20 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.50 2kde s THR 14 Cb -0.12 -3.49 -0.02 0.00 0.01 0.00 0.00 72.50 68.89 2kde s THR 14 CO 0.10 -0.14 -0.18 -0.76 -0.69 0.00 0.00 174.62 172.95 2kde s LEU 15 N 1.57 2.48 -0.31 4.42 1.43 -0.15 -4.96 118.68 123.15 2kde s LEU 15 Ca 0.03 -0.37 -0.25 0.00 -1.03 0.00 0.00 54.13 52.51 2kde s LEU 15 Cb -0.19 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.53 2kde s LEU 15 CO 0.06 0.23 0.85 -0.70 0.23 0.00 0.00 176.35 177.03 2kde s GLU 16 N -0.08 3.97 0.00 1.70 2.12 -1.26 -1.34 118.70 123.81 2kde s GLU 16 Ca -0.04 0.67 0.00 0.00 0.36 0.00 0.00 54.97 55.96 2kde s GLU 16 Cb -0.14 -3.74 0.00 0.00 0.26 0.00 0.00 34.13 30.51 2kde s GLU 16 CO 0.04 -0.74 0.00 1.33 -0.54 0.00 0.00 175.26 175.35 2kde n VAL 17 N 5.62 0.00 -4.17 3.70 0.24 0.29 -4.89 118.33 119.13 2kde n VAL 17 Ca 0.05 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.24 2kde n VAL 17 Cb 0.48 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.76 2kde n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2kde s GLU 18 N 0.41 1.27 0.23 7.34 2.02 -1.26 0.99 118.70 129.70 2kde s GLU 18 Ca 0.00 -1.58 0.24 0.00 0.02 0.00 0.00 54.97 53.65 2kde s GLU 18 Cb 0.00 0.30 0.94 0.00 0.10 0.00 0.00 34.13 35.47 2kde s GLU 18 CO 0.00 -0.44 1.71 -0.35 0.02 0.00 0.00 175.26 176.21 2kde n PRO 19 N -0.30 0.19 -0.64 0.39 -0.04 -1.26 -2.56 135.00 130.78 2kde n PRO 19 Ca 0.02 0.37 0.08 0.00 -0.04 0.00 0.00 63.50 63.93 2kde n PRO 19 Cb 0.65 -1.84 0.34 0.00 -0.04 0.00 0.00 33.50 32.62 2kde n PRO 19 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2kde n SER 20 N -2.19 4.79 -4.81 3.54 2.88 -1.26 -1.21 113.62 115.35 2kde n SER 20 Ca 0.03 -2.64 -0.38 0.00 -1.33 0.00 0.00 58.87 54.55 2kde n SER 20 Cb 0.26 -0.58 -0.06 0.00 -0.75 0.00 0.00 64.21 63.08 2kde n SER 20 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2kde s ASP 21 N -1.05 7.08 0.44 -3.46 1.11 -1.06 -4.88 116.67 114.85 2kde s ASP 21 Ca 0.49 1.33 -0.19 0.00 0.18 0.00 0.00 52.55 54.36 2kde s ASP 21 Cb 0.34 -2.38 -0.10 0.00 1.07 0.00 0.00 42.92 41.85 2kde s ASP 21 CO 0.19 0.18 0.93 0.42 1.18 0.00 0.00 175.17 178.07 2kde s THR 22 N -1.27 4.48 0.36 -1.27 -4.23 -1.26 -1.35 115.64 111.10 2kde s THR 22 Ca 0.35 1.32 0.04 0.00 -1.18 0.00 0.00 61.69 62.22 2kde s THR 22 Cb -0.19 -3.64 0.25 0.00 1.34 0.00 0.00 72.50 70.27 2kde s THR 22 CO 0.21 -0.42 2.01 0.40 -0.54 0.00 0.00 174.62 176.28 2kde h ILE 23 N 1.60 1.15 -0.44 2.99 1.08 -1.24 -0.82 117.51 121.83 2kde h ILE 23 Ca -0.48 -0.32 -0.03 0.00 -0.39 0.00 0.00 64.86 63.64 2kde h ILE 23 Cb 1.18 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.29 2kde h ILE 23 CO 0.62 0.15 0.16 -0.08 -0.69 0.00 0.00 178.15 178.31 2kde h GLU 24 N 0.74 0.63 -0.42 2.37 4.22 -1.79 -0.80 114.58 119.53 2kde h GLU 24 Ca 0.20 -0.09 -0.13 0.00 0.08 0.00 0.00 59.36 59.42 2kde h GLU 24 Cb -0.04 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 2kde h GLU 24 CO -0.04 0.54 -0.23 -0.97 -2.18 0.00 0.00 179.01 176.13 2kde h ASN 25 N 0.63 0.92 -0.43 1.04 -0.73 -1.47 -2.11 115.58 113.42 2kde h ASN 25 Ca 0.15 -0.41 -0.03 0.00 1.87 0.00 0.00 56.30 57.88 2kde h ASN 25 Cb 0.16 -0.26 -0.02 0.00 0.27 0.00 0.00 38.32 38.47 2kde h ASN 25 CO -0.01 1.13 0.15 0.58 -0.37 0.00 0.00 177.43 178.91 2kde h VAL 26 N 0.71 1.21 -0.68 2.57 2.07 -0.83 -1.97 116.25 119.34 2kde h VAL 26 Ca 0.09 -0.69 0.02 0.00 0.82 0.00 0.00 66.70 66.94 2kde h VAL 26 Cb 0.80 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 2kde h VAL 26 CO 0.07 0.25 0.45 0.11 0.02 0.00 0.00 177.57 178.46 2kde h LYS 27 N 0.55 0.86 -0.24 1.57 1.57 -1.06 -0.64 116.57 119.17 2kde h LYS 27 Ca 0.14 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.78 2kde h LYS 27 Cb 0.24 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2kde h LYS 27 CO -0.01 0.57 -0.22 0.00 -0.57 0.00 0.00 179.45 179.22 2kde h ALA 28 N 1.59 1.17 -0.37 3.86 0.00 -0.90 -1.29 119.26 123.31 2kde h ALA 28 Ca 0.26 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2kde h ALA 28 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2kde h ALA 28 CO -0.06 0.53 -0.03 0.87 0.00 0.00 0.00 179.25 180.55 2kde h LYS 29 N 0.40 0.67 0.00 0.00 1.57 -0.40 -1.93 116.57 116.88 2kde h LYS 29 Ca 0.06 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.53 2kde h LYS 29 Cb 0.61 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 2kde h LYS 29 CO 0.04 0.80 -0.38 0.82 -0.57 0.00 0.00 179.45 180.16 2kde h ILE 30 N 0.48 1.10 -0.20 1.86 2.04 -1.12 -2.22 117.51 119.45 2kde h ILE 30 Ca 0.10 -1.40 -0.17 0.00 1.00 0.00 0.00 64.86 64.39 2kde h ILE 30 Cb 0.51 1.79 -0.00 0.00 -0.74 0.00 0.00 36.82 38.38 2kde h ILE 30 CO 0.03 0.38 -0.57 -0.61 0.00 0.00 0.00 178.15 177.37 2kde h GLN 31 N 0.00 0.63 0.00 2.37 -0.00 -0.93 0.42 115.11 117.59 2kde h GLN 31 Ca -0.00 -0.41 -0.14 0.00 -0.00 0.00 0.00 58.65 58.09 2kde h GLN 31 Cb 0.76 0.05 -0.02 0.00 0.00 0.00 0.00 27.48 28.28 2kde h GLN 31 CO 0.05 1.03 -0.69 -0.44 0.00 0.00 0.00 178.83 178.78 2kde h ASP 32 N 0.48 0.00 0.10 -0.69 5.19 -1.16 0.32 116.42 120.66 2kde h ASP 32 Ca 0.00 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.23 2kde h ASP 32 Cb 1.14 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.66 2kde h ASP 32 CO 0.11 0.69 -0.91 0.11 -3.12 0.00 0.00 179.24 176.12 2kde h LYS 33 N 0.00 0.21 0.00 3.56 1.79 -1.32 -3.42 116.57 117.40 2kde h LYS 33 Ca -0.01 -0.36 -0.23 0.00 -2.18 0.00 0.00 60.65 57.87 2kde h LYS 33 Cb 1.32 0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 32.07 2kde h LYS 33 CO 0.09 1.17 -1.62 0.39 -1.08 0.00 0.00 179.45 178.41 2kde n GLU 34 N -4.16 0.55 0.00 3.15 1.02 0.13 -5.04 120.64 116.29 2kde n GLU 34 Ca -0.18 0.33 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 2kde n GLU 34 Cb 0.78 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.67 2kde n GLU 34 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kde n GLY 35 N 1.39 1.42 3.76 0.62 0.00 0.11 -5.02 105.19 107.47 2kde n GLY 35 Ca -0.33 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 2kde n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kde s ILE 36 N -1.19 2.32 0.60 -0.61 1.01 -1.26 -4.92 121.20 117.15 2kde s ILE 36 Ca 0.00 0.28 -0.18 0.00 0.00 0.00 0.00 60.65 60.75 2kde s ILE 36 Cb 0.00 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 2kde s ILE 36 CO 0.00 0.03 1.15 -2.16 0.00 0.00 0.00 174.94 173.96 2kde s PRO 37 N -2.46 3.04 0.10 2.79 0.04 -1.26 -4.10 135.00 133.15 2kde s PRO 37 Ca 0.61 1.61 -0.13 0.00 0.04 0.00 0.00 61.00 63.13 2kde s PRO 37 Cb -0.40 -1.96 -0.14 0.00 0.04 0.00 0.00 34.50 32.04 2kde s PRO 37 CO 0.51 -1.10 1.33 -1.00 0.04 0.00 0.00 177.00 176.78 2kde h PRO 38 N 0.72 0.78 -0.08 0.56 0.13 -1.93 -2.61 132.00 129.58 2kde h PRO 38 Ca -0.49 -0.58 0.02 0.00 -0.87 0.00 0.00 66.00 64.08 2kde h PRO 38 Cb 1.27 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.50 2kde h PRO 38 CO 0.55 1.20 0.19 0.38 -0.23 0.00 0.00 178.00 180.09 2kde h ASP 39 N 0.52 0.00 0.13 1.44 3.04 -1.96 -1.93 116.42 117.66 2kde h ASP 39 Ca -0.02 0.00 -0.36 0.00 -3.24 0.00 0.00 57.03 53.40 2kde h ASP 39 Cb 1.27 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.51 2kde h ASP 39 CO 0.14 0.00 -2.15 0.00 -2.04 0.00 0.00 179.24 175.19 2kde n GLN 40 N -3.32 0.70 -1.70 4.15 6.02 -1.17 -4.86 117.38 117.21 2kde n GLN 40 Ca -0.01 0.20 -0.42 0.00 -0.01 0.00 0.00 57.00 56.77 2kde n GLN 40 Cb 0.28 -1.64 -0.03 0.00 1.02 0.00 0.00 30.24 29.86 2kde n GLN 40 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2kde n GLN 41 N -3.27 2.81 -4.18 -1.09 6.02 -0.73 -1.90 117.38 115.03 2kde n GLN 41 Ca -0.34 1.02 -0.33 0.00 -0.01 0.00 0.00 57.00 57.34 2kde n GLN 41 Cb 1.04 -2.90 -0.16 0.00 1.02 0.00 0.00 30.24 29.25 2kde n GLN 41 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2kde s ARG 42 N 2.04 3.02 -0.46 -1.09 0.52 -0.25 -4.93 118.95 117.81 2kde s ARG 42 Ca 0.79 -0.82 -0.19 0.00 -0.52 0.00 0.00 55.73 54.99 2kde s ARG 42 Cb -0.49 -2.58 0.04 0.00 0.52 0.00 0.00 34.95 32.44 2kde s ARG 42 CO 0.35 -0.18 0.59 -0.51 0.02 0.00 0.00 175.30 175.57 2kde s LEU 43 N 1.23 4.77 -0.12 2.53 1.43 -1.26 -0.88 118.68 126.39 2kde s LEU 43 Ca 0.03 -0.65 -0.00 0.00 -1.03 0.00 0.00 54.13 52.47 2kde s LEU 43 Cb -0.13 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.53 2kde s LEU 43 CO -0.11 -0.78 -0.10 -0.63 0.23 0.00 0.00 176.35 174.96 2kde s ILE 44 N 2.59 3.38 -0.03 -0.59 1.09 -0.11 -0.85 121.20 126.68 2kde s ILE 44 Ca 0.17 -0.56 0.03 0.00 -1.10 0.00 0.00 60.65 59.19 2kde s ILE 44 Cb -0.17 -2.42 0.00 0.00 -1.06 0.00 0.00 42.46 38.81 2kde s ILE 44 CO 0.15 0.54 -0.11 0.12 -0.10 0.00 0.00 174.94 175.53 2kde s PHE 45 N 0.02 1.17 -1.31 3.97 5.36 -0.20 -0.81 117.98 126.18 2kde s PHE 45 Ca -0.03 -0.32 0.00 0.00 -0.96 0.00 0.00 56.93 55.62 2kde s PHE 45 Cb -0.14 -0.83 0.00 0.00 -0.34 0.00 0.00 43.02 41.71 2kde s PHE 45 CO 0.04 -0.14 0.00 0.00 -1.46 0.00 0.00 175.22 173.66 2kde n ALA 46 N 3.34 -0.59 -2.15 11.12 0.00 -1.26 -1.69 120.51 129.27 2kde n ALA 46 Ca -0.19 0.15 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 2kde n ALA 46 Cb 0.54 -1.61 0.01 0.00 0.00 0.00 0.00 19.45 18.38 2kde n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kde n GLY 47 N -0.69 0.36 3.64 0.00 0.00 -1.26 -5.07 105.19 102.17 2kde n GLY 47 Ca -0.16 -0.40 -0.02 0.00 0.00 0.00 0.00 46.02 45.43 2kde n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kde s LYS 48 N -4.12 0.60 0.35 1.61 1.02 -0.68 -5.15 119.74 113.38 2kde s LYS 48 Ca 0.00 1.38 -0.27 0.00 0.02 0.00 0.00 55.97 57.10 2kde s LYS 48 Cb -0.00 0.68 -0.09 0.00 -0.52 0.00 0.00 37.83 37.90 2kde s LYS 48 CO 0.09 -0.18 1.19 -1.14 -0.92 0.00 0.00 175.35 174.38 2kde s GLN 49 N 2.56 4.29 0.06 1.68 0.74 -1.26 -1.04 119.66 126.69 2kde s GLN 49 Ca -0.07 1.93 -0.05 0.00 0.05 0.00 0.00 55.36 57.23 2kde s GLN 49 Cb -0.10 -2.92 -0.05 0.00 1.10 0.00 0.00 33.01 31.04 2kde s GLN 49 CO -0.19 -0.14 0.29 -0.51 -0.55 0.00 0.00 175.29 174.18 2kde s LEU 50 N -2.03 4.34 0.59 3.68 1.43 -0.03 -4.93 118.68 121.73 2kde s LEU 50 Ca 0.51 0.51 -0.14 0.00 -1.03 0.00 0.00 54.13 53.99 2kde s LEU 50 Cb -0.34 -2.91 -0.05 0.00 0.03 0.00 0.00 46.19 42.92 2kde s LEU 50 CO 0.43 0.18 1.02 -1.61 0.23 0.00 0.00 176.35 176.60 2kde s GLU 51 N -2.16 3.61 0.27 1.70 2.02 -1.26 -4.78 118.70 118.10 2kde s GLU 51 Ca 0.33 0.91 0.15 0.00 0.02 0.00 0.00 54.97 56.37 2kde s GLU 51 Cb -0.13 -2.08 0.09 0.00 0.10 0.00 0.00 34.13 32.11 2kde s GLU 51 CO 0.21 -0.56 1.45 -0.44 0.02 0.00 0.00 175.26 175.94 2kde h ASP 52 N 0.19 0.00 1.01 -0.19 5.19 -1.98 -3.26 116.42 117.37 2kde h ASP 52 Ca -0.45 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 55.76 2kde h ASP 52 Cb 1.19 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.67 2kde h ASP 52 CO 0.61 0.54 -1.04 1.23 -3.12 0.00 0.00 179.24 177.46 2kde h GLY 53 N 3.34 0.00 -1.09 2.75 0.00 -1.97 -3.04 103.07 103.05 2kde h GLY 53 Ca -0.01 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.83 2kde h GLY 53 CO 0.07 0.00 0.35 0.50 0.00 0.00 0.00 176.54 177.46 2kde s ARG 54 N -2.76 2.25 0.00 4.80 1.81 -1.23 -4.80 118.95 119.01 2kde s ARG 54 Ca 0.00 0.67 0.00 0.00 -1.72 0.00 0.00 55.73 54.69 2kde s ARG 54 Cb 0.09 -1.93 0.00 0.00 -0.45 0.00 0.00 34.95 32.66 2kde s ARG 54 CO 0.80 -1.52 0.00 0.25 -0.68 0.00 0.00 175.30 174.16 2kde n THR 55 N -3.37 0.00 0.11 0.02 -2.24 -1.26 -1.20 114.28 106.34 2kde n THR 55 Ca 0.07 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.84 2kde n THR 55 Cb 0.56 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 2kde n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2kde h LEU 56 N 0.00 0.00 -0.60 3.22 3.38 -1.29 -3.26 115.31 116.76 2kde h LEU 56 Ca 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2kde h LEU 56 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2kde h LEU 56 CO 0.00 0.70 -0.66 0.77 0.09 0.00 0.00 178.44 179.34 2kde h SER 57 N 0.00 0.20 -0.05 -0.43 4.64 -1.43 -2.40 113.55 114.08 2kde h SER 57 Ca -0.01 -0.13 0.02 0.00 -0.47 0.00 0.00 61.79 61.20 2kde h SER 57 Cb 1.48 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2kde h SER 57 CO 0.09 0.81 0.06 0.44 -0.87 0.00 0.00 176.83 177.36 2kde h ASP 58 N 0.12 0.00 -0.52 4.97 3.32 -1.81 -0.82 116.42 121.68 2kde h ASP 58 Ca -0.01 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.88 2kde h ASP 58 Cb 1.19 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.64 2kde h ASP 58 CO 0.10 0.00 0.13 -1.22 -1.72 0.00 0.00 179.24 176.52 2kde n TYR 59 N -3.83 1.72 -3.68 4.55 4.01 -1.14 -4.96 117.16 113.84 2kde n TYR 59 Ca -0.02 -1.21 -0.27 0.00 -0.16 0.00 0.00 57.90 56.24 2kde n TYR 59 Cb 0.15 -0.54 0.04 0.00 -0.31 0.00 0.00 39.34 38.68 2kde n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2kde n ASN 60 N -0.51 -3.99 -4.68 7.72 4.05 -0.31 -4.97 115.26 112.56 2kde n ASN 60 Ca 0.34 -0.95 -0.35 0.00 0.45 0.00 0.00 54.58 54.07 2kde n ASN 60 Cb 1.17 -3.65 -0.09 0.00 1.23 0.00 0.00 39.78 38.44 2kde n ASN 60 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2kde s ILE 61 N -3.56 4.54 0.00 -1.44 1.01 -0.91 -5.04 121.20 115.79 2kde s ILE 61 Ca 0.32 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.82 2kde s ILE 61 Cb -0.10 -2.96 0.00 0.00 0.01 0.00 0.00 42.46 39.41 2kde s ILE 61 CO 0.84 0.56 0.00 0.00 0.00 0.00 0.00 174.94 176.35 2kde n GLN 62 N 2.57 2.54 -1.36 2.79 6.02 -1.26 -4.67 117.38 124.01 2kde n GLN 62 Ca -0.18 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.50 2kde n GLN 62 Cb 0.53 0.00 0.09 0.00 1.02 0.00 0.00 30.24 31.89 2kde n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2kde s LYS 63 N -1.16 2.13 -1.36 -1.09 -2.85 -1.26 -3.36 119.74 110.78 2kde s LYS 63 Ca 0.00 0.95 0.00 0.00 -1.00 0.00 0.00 55.97 55.92 2kde s LYS 63 Cb 0.00 -1.90 0.00 0.00 -2.06 0.00 0.00 37.83 33.87 2kde s LYS 63 CO 0.00 -1.67 0.00 0.39 0.10 0.00 0.00 175.35 174.17 2kde n GLU 64 N -3.51 -1.67 -2.83 1.78 1.02 0.32 -4.91 120.64 110.84 2kde n GLU 64 Ca 0.08 0.76 -0.41 0.00 -0.02 0.00 0.00 57.16 57.57 2kde n GLU 64 Cb 0.54 -5.18 -0.04 0.00 -0.02 0.00 0.00 31.44 26.75 2kde n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2kde s SER 65 N -2.12 7.26 -0.33 1.62 0.01 -1.21 -4.72 113.70 114.22 2kde s SER 65 Ca 0.00 1.52 -0.17 0.00 1.31 0.00 0.00 55.95 58.62 2kde s SER 65 Cb 0.00 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.70 2kde s SER 65 CO 0.00 -0.17 0.46 -0.89 0.41 0.00 0.00 173.24 173.05 2kde s THR 66 N 0.73 5.08 0.08 1.44 2.01 -1.25 -1.02 115.64 122.71 2kde s THR 66 Ca 0.46 0.38 0.01 0.00 0.31 0.00 0.00 61.69 62.84 2kde s THR 66 Cb -0.20 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 2kde s THR 66 CO 0.25 -0.10 0.23 -0.76 -0.69 0.00 0.00 174.62 173.55 2kde s LEU 67 N 2.26 4.35 -0.45 4.42 1.43 0.00 -4.90 118.68 125.79 2kde s LEU 67 Ca 0.17 0.25 -0.18 0.00 -1.03 0.00 0.00 54.13 53.34 2kde s LEU 67 Cb -0.16 -2.95 0.04 0.00 0.03 0.00 0.00 46.19 43.15 2kde s LEU 67 CO 0.12 0.14 0.49 -1.00 0.23 0.00 0.00 176.35 176.33 2kde s HIS 68 N -1.57 3.14 0.29 0.29 3.76 0.01 -0.84 115.29 120.37 2kde s HIS 68 Ca 0.35 -0.46 -0.21 0.00 -0.15 0.00 0.00 55.06 54.59 2kde s HIS 68 Cb -0.13 -3.11 -0.09 0.00 1.11 0.00 0.00 32.58 30.37 2kde s HIS 68 CO 0.28 -0.80 0.81 -1.17 -0.85 0.00 0.00 174.74 173.01 2kde s LEU 69 N 2.23 4.26 0.14 0.89 2.96 -0.24 -0.94 118.68 127.98 2kde s LEU 69 Ca 0.12 1.55 -0.00 0.00 -0.22 0.00 0.00 54.13 55.58 2kde s LEU 69 Cb -0.18 -3.89 -0.04 0.00 0.50 0.00 0.00 46.19 42.58 2kde s LEU 69 CO 0.13 -0.07 0.04 -0.69 -1.32 0.00 0.00 176.35 174.43 2kde s VAL 70 N -1.69 0.24 -0.16 1.68 1.01 -0.06 -4.51 120.40 116.92 2kde s VAL 70 Ca 0.49 -1.92 -0.00 0.00 0.00 0.00 0.00 61.98 60.54 2kde s VAL 70 Cb -0.15 -2.05 -0.00 0.00 0.00 0.00 0.00 36.38 34.18 2kde s VAL 70 CO 0.20 -0.48 -0.14 -0.76 0.00 0.00 0.00 175.10 173.92 2kde s LEU 71 N -3.07 2.53 -0.17 3.92 1.43 -1.26 -1.08 118.68 120.98 2kde s LEU 71 Ca 0.23 -0.45 -0.16 0.00 -1.03 0.00 0.00 54.13 52.73 2kde s LEU 71 Cb 0.07 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.67 2kde s LEU 71 CO 0.02 0.09 0.39 -0.60 0.23 0.00 0.00 176.35 176.47 2kde s ARG 72 N 0.81 4.25 -0.03 1.70 3.52 -0.80 -5.00 118.95 123.39 2kde s ARG 72 Ca -0.05 0.24 0.01 0.00 -0.13 0.00 0.00 55.73 55.79 2kde s ARG 72 Cb -0.15 -3.47 0.03 0.00 -1.56 0.00 0.00 34.95 29.79 2kde s ARG 72 CO 0.00 0.10 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.08 2kde s LEU 73 N 0.85 1.20 -0.83 -0.88 1.43 -1.26 -4.83 118.68 114.36 2kde s LEU 73 Ca 0.20 -0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.23 2kde s LEU 73 Cb -0.14 -0.27 0.26 0.00 0.03 0.00 0.00 46.19 46.07 2kde s LEU 73 CO 0.07 -0.09 2.18 -1.14 0.23 0.00 0.00 176.35 177.60 2kde n ARG 74 N 4.13 3.31 0.17 1.70 3.00 -1.26 -4.42 116.66 123.28 2kde n ARG 74 Ca -0.26 -3.47 0.00 0.00 -0.00 0.00 0.00 57.85 54.12 2kde n ARG 74 Cb 0.50 -2.31 0.00 0.00 0.00 0.00 0.00 32.46 30.66 2kde n ARG 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2kde n GLY 75 N 0.03 -0.89 0.00 5.14 0.00 -1.26 -5.37 105.19 102.84 2kde n GLY 75 Ca 0.52 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.68 2kde n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93