#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k39 s GLN 2 N 0.00 4.32 0.10 2.12 -0.44 -1.26 -1.47 119.66 123.02 2k39 s GLN 2 Ca 0.00 0.77 0.10 0.00 -2.50 0.00 0.00 55.36 53.73 2k39 s GLN 2 Cb 0.00 -3.32 -0.04 0.00 -1.64 0.00 0.00 33.01 28.01 2k39 s GLN 2 CO 0.00 0.42 -0.25 0.96 0.50 0.00 0.00 175.29 176.91 2k39 s ILE 3 N -0.37 2.31 -0.33 -2.34 -4.36 -0.28 -0.47 121.20 115.35 2k39 s ILE 3 Ca 0.31 -1.59 -0.13 0.00 -0.26 0.00 0.00 60.65 58.98 2k39 s ILE 3 Cb -0.19 -1.99 -0.02 0.00 1.25 0.00 0.00 42.46 41.51 2k39 s ILE 3 CO 0.18 0.19 0.25 -0.36 0.24 0.00 0.00 174.94 175.44 2k39 s PHE 4 N -0.98 3.23 -0.64 1.37 0.08 -0.56 -0.38 117.98 120.10 2k39 s PHE 4 Ca 0.14 -0.14 -0.22 0.00 0.12 0.00 0.00 56.93 56.83 2k39 s PHE 4 Cb -0.10 -2.49 0.07 0.00 -0.57 0.00 0.00 43.02 39.93 2k39 s PHE 4 CO 0.05 -0.35 0.92 0.08 -0.10 0.00 0.00 175.22 175.82 2k39 s VAL 5 N 1.77 4.41 0.64 -0.44 1.01 -0.61 -0.99 120.40 126.19 2k39 s VAL 5 Ca 0.07 -0.44 -0.14 0.00 0.00 0.00 0.00 61.98 61.48 2k39 s VAL 5 Cb -0.17 -4.65 -0.01 0.00 0.00 0.00 0.00 36.38 31.55 2k39 s VAL 5 CO 0.11 -1.39 1.06 -0.75 0.00 0.00 0.00 175.10 174.13 2k39 s LYS 6 N 3.84 3.11 0.17 2.72 2.20 -0.34 -1.71 119.74 129.73 2k39 s LYS 6 Ca 0.21 1.12 -0.12 0.00 -0.36 0.00 0.00 55.97 56.82 2k39 s LYS 6 Cb -0.18 -2.01 0.01 0.00 -1.51 0.00 0.00 37.83 34.14 2k39 s LYS 6 CO 0.10 -0.97 0.37 -0.08 -0.36 0.00 0.00 175.35 174.41 2k39 s THR 7 N -2.68 0.06 0.33 3.43 -1.32 -0.79 -2.07 115.64 112.60 2k39 s THR 7 Ca 0.62 -1.12 0.13 0.00 -1.21 0.00 0.00 61.69 60.10 2k39 s THR 7 Cb -0.15 -1.68 0.32 0.00 -1.51 0.00 0.00 72.50 69.47 2k39 s THR 7 CO 0.44 -0.26 1.69 0.25 -2.21 0.00 0.00 174.62 174.53 2k39 h LEU 8 N 2.42 0.58 -0.18 9.08 5.85 -1.88 -2.90 115.31 128.29 2k39 h LEU 8 Ca -0.31 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2k39 h LEU 8 Cb 1.24 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.36 2k39 h LEU 8 CO 0.45 -0.04 -0.01 0.35 -0.34 0.00 0.00 178.44 178.84 2k39 n THR 9 N -4.98 0.00 -0.13 1.05 -2.24 -1.26 -4.86 114.28 101.85 2k39 n THR 9 Ca 0.30 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 2k39 n THR 9 Cb 0.89 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2k39 n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k39 n GLY 10 N 1.10 0.90 3.72 3.38 0.00 -1.09 -5.06 105.19 108.13 2k39 n GLY 10 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2k39 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k39 s LYS 11 N -0.87 4.54 -0.11 1.61 2.20 -1.25 -4.98 119.74 120.87 2k39 s LYS 11 Ca 0.00 1.65 0.00 0.00 -0.36 0.00 0.00 55.97 57.26 2k39 s LYS 11 Cb 0.00 -3.35 -0.02 0.00 -1.51 0.00 0.00 37.83 32.95 2k39 s LYS 11 CO 0.00 -0.06 -0.11 0.95 -0.36 0.00 0.00 175.35 175.77 2k39 s THR 12 N 0.50 3.25 -0.15 3.43 -4.23 -1.26 -1.88 115.64 115.30 2k39 s THR 12 Ca 0.53 -0.61 -0.07 0.00 -1.18 0.00 0.00 61.69 60.36 2k39 s THR 12 Cb -0.27 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.17 2k39 s THR 12 CO 0.31 0.54 0.10 -0.63 -0.54 0.00 0.00 174.62 174.39 2k39 s ILE 13 N 0.06 5.12 -0.33 2.99 1.01 -0.69 -4.99 121.20 124.36 2k39 s ILE 13 Ca -0.04 0.07 -0.27 0.00 0.00 0.00 0.00 60.65 60.41 2k39 s ILE 13 Cb -0.14 -3.26 0.01 0.00 0.01 0.00 0.00 42.46 39.08 2k39 s ILE 13 CO 0.04 0.54 1.00 0.28 0.00 0.00 0.00 174.94 176.80 2k39 s THR 14 N -0.33 4.56 -0.12 2.92 -1.32 -1.26 -1.57 115.64 118.52 2k39 s THR 14 Ca 0.10 1.52 0.02 0.00 -1.21 0.00 0.00 61.69 62.12 2k39 s THR 14 Cb -0.12 -4.36 -0.01 0.00 -1.51 0.00 0.00 72.50 66.50 2k39 s THR 14 CO 0.01 -0.47 -0.18 -0.22 -2.21 0.00 0.00 174.62 171.55 2k39 s LEU 15 N 3.53 2.43 0.31 9.08 2.96 0.49 -5.01 118.68 132.48 2k39 s LEU 15 Ca 0.42 -0.44 -0.26 0.00 -0.22 0.00 0.00 54.13 53.63 2k39 s LEU 15 Cb -0.12 -1.52 -0.10 0.00 0.50 0.00 0.00 46.19 44.95 2k39 s LEU 15 CO 0.16 0.16 0.93 -0.70 -1.32 0.00 0.00 176.35 175.58 2k39 s GLU 16 N 0.38 4.59 0.20 1.98 2.56 -1.26 -1.13 118.70 126.01 2k39 s GLU 16 Ca -0.14 1.31 -0.08 0.00 0.00 0.00 0.00 54.97 56.06 2k39 s GLU 16 Cb -0.17 -2.85 -0.02 0.00 2.00 0.00 0.00 34.13 33.09 2k39 s GLU 16 CO 0.07 0.31 0.30 0.14 -0.56 0.00 0.00 175.26 175.52 2k39 s VAL 17 N -1.57 0.03 0.04 3.70 -7.23 -0.54 -4.96 120.40 109.87 2k39 s VAL 17 Ca 0.49 -1.55 0.02 0.00 -1.81 0.00 0.00 61.98 59.12 2k39 s VAL 17 Cb -0.19 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 2k39 s VAL 17 CO 0.24 -0.14 0.06 -0.70 -0.31 0.00 0.00 175.10 174.26 2k39 s GLU 18 N -4.03 2.92 0.35 4.82 2.12 -1.26 0.72 118.70 124.34 2k39 s GLU 18 Ca 0.24 -0.61 0.19 0.00 0.36 0.00 0.00 54.97 55.15 2k39 s GLU 18 Cb 0.03 -2.76 0.51 0.00 0.26 0.00 0.00 34.13 32.17 2k39 s GLU 18 CO 0.06 0.60 1.65 -1.00 -0.54 0.00 0.00 175.26 176.03 2k39 h PRO 19 N 3.77 0.00 0.00 4.30 0.13 -1.93 -3.06 132.00 135.21 2k39 h PRO 19 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2k39 h PRO 19 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2k39 h PRO 19 CO 0.63 0.39 0.00 -1.13 -0.23 0.00 0.00 178.00 177.66 2k39 n SER 20 N -3.39 0.00 -4.70 1.44 3.41 -1.26 -2.81 113.62 106.31 2k39 n SER 20 Ca 0.01 0.45 -0.30 0.00 -0.26 0.00 0.00 58.87 58.77 2k39 n SER 20 Cb 0.57 -0.47 0.14 0.00 -0.26 0.00 0.00 64.21 64.20 2k39 n SER 20 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2k39 s ASP 21 N -2.93 3.37 0.08 4.04 -1.08 -1.16 -4.85 116.67 114.15 2k39 s ASP 21 Ca 0.03 1.62 0.08 0.00 -0.52 0.00 0.00 52.55 53.77 2k39 s ASP 21 Cb 0.04 -2.28 -0.03 0.00 -1.46 0.00 0.00 42.92 39.19 2k39 s ASP 21 CO 0.10 -2.72 -0.22 0.42 0.52 0.00 0.00 175.17 173.27 2k39 s THR 22 N -2.86 1.78 0.15 1.71 -4.23 -1.26 -2.07 115.64 108.87 2k39 s THR 22 Ca 0.64 -1.45 -0.17 0.00 -1.18 0.00 0.00 61.69 59.53 2k39 s THR 22 Cb -0.19 -1.59 0.02 0.00 1.34 0.00 0.00 72.50 72.08 2k39 s THR 22 CO 0.58 0.06 1.73 0.40 -0.54 0.00 0.00 174.62 176.85 2k39 h ILE 23 N 4.15 0.83 -0.38 2.99 1.08 -1.91 -1.81 117.51 122.46 2k39 h ILE 23 Ca -0.46 -0.06 -0.10 0.00 -0.39 0.00 0.00 64.86 63.85 2k39 h ILE 23 Cb 1.17 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 35.55 2k39 h ILE 23 CO 0.41 0.03 -0.18 1.05 -0.69 0.00 0.00 178.15 178.77 2k39 h GLU 24 N 0.17 0.73 -0.58 2.37 9.09 -1.95 -0.54 114.58 123.87 2k39 h GLU 24 Ca 0.16 -0.27 -0.10 0.00 0.05 0.00 0.00 59.36 59.19 2k39 h GLU 24 Cb 0.18 -0.05 -0.02 0.00 -1.65 0.00 0.00 28.75 27.21 2k39 h GLU 24 CO -0.21 0.86 -0.04 -0.97 0.05 0.00 0.00 179.01 178.70 2k39 h ASN 25 N 0.65 1.03 -0.30 3.06 -1.24 -1.89 -2.16 115.58 114.73 2k39 h ASN 25 Ca 0.10 -0.31 -0.17 0.00 0.71 0.00 0.00 56.30 56.63 2k39 h ASN 25 Cb 0.67 -0.28 -0.00 0.00 0.73 0.00 0.00 38.32 39.43 2k39 h ASN 25 CO 0.05 1.10 -0.46 0.58 -1.29 0.00 0.00 177.43 177.41 2k39 h VAL 26 N 0.95 1.28 -0.31 2.57 2.07 -1.21 -1.85 116.25 119.74 2k39 h VAL 26 Ca 0.16 -1.64 0.09 0.00 0.82 0.00 0.00 66.70 66.13 2k39 h VAL 26 Cb 0.60 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2k39 h VAL 26 CO 0.04 0.54 0.23 0.11 0.02 0.00 0.00 177.57 178.51 2k39 h LYS 27 N 0.70 0.00 -0.12 1.57 1.57 -0.85 -0.33 116.57 119.11 2k39 h LYS 27 Ca 0.04 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.61 2k39 h LYS 27 Cb 1.06 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.38 2k39 h LYS 27 CO 0.11 0.00 -0.72 0.00 -0.57 0.00 0.00 179.45 178.26 2k39 h ALA 28 N 1.82 0.24 -0.14 3.86 0.00 -1.00 -2.66 119.26 121.39 2k39 h ALA 28 Ca 0.15 -0.58 -0.05 0.00 0.00 0.00 0.00 54.91 54.42 2k39 h ALA 28 Cb 0.61 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2k39 h ALA 28 CO -0.00 0.58 -0.15 0.87 0.00 0.00 0.00 179.25 180.55 2k39 h LYS 29 N 0.38 0.22 -0.43 0.00 1.57 -0.33 0.50 116.57 118.49 2k39 h LYS 29 Ca -0.06 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 2k39 h LYS 29 Cb 1.36 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.62 2k39 h LYS 29 CO 0.15 0.37 0.14 0.82 -0.57 0.00 0.00 179.45 180.36 2k39 h ILE 30 N 0.21 1.18 -0.15 1.86 2.04 -1.18 -3.18 117.51 118.28 2k39 h ILE 30 Ca 0.04 -0.59 -0.21 0.00 1.00 0.00 0.00 64.86 65.10 2k39 h ILE 30 Cb 0.39 0.70 0.01 0.00 -0.74 0.00 0.00 36.82 37.18 2k39 h ILE 30 CO 0.02 0.22 -0.75 -0.61 0.00 0.00 0.00 178.15 177.03 2k39 h GLN 31 N 0.61 0.72 -0.90 2.37 -0.00 0.37 -1.25 115.11 117.03 2k39 h GLN 31 Ca 0.15 -0.58 0.35 0.00 -0.00 0.00 0.00 58.65 58.57 2k39 h GLN 31 Cb 0.17 0.12 -0.16 0.00 0.00 0.00 0.00 27.48 27.61 2k39 h GLN 31 CO -0.01 1.19 0.37 -3.47 0.00 0.00 0.00 178.83 176.91 2k39 n ASP 32 N -3.92 0.21 0.00 -0.69 2.03 -0.90 0.04 116.55 113.33 2k39 n ASP 32 Ca -0.07 1.50 0.00 0.00 0.52 0.00 0.00 54.79 56.74 2k39 n ASP 32 Cb 0.73 -0.69 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 2k39 n ASP 32 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2k39 n LYS 33 N -5.10 0.00 0.16 -0.67 4.76 -0.92 -4.74 118.16 111.66 2k39 n LYS 33 Ca 0.31 0.36 0.12 0.00 -2.87 0.00 0.00 58.31 56.23 2k39 n LYS 33 Cb 1.05 -0.86 0.10 0.00 -1.84 0.00 0.00 35.03 33.48 2k39 n LYS 33 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2k39 h GLU 34 N 0.00 0.00 0.00 1.97 4.39 -1.23 -3.48 114.58 116.23 2k39 h GLU 34 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2k39 h GLU 34 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2k39 h GLU 34 CO 0.00 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.26 2k39 n GLY 35 N 1.14 0.18 3.76 -3.84 0.00 0.11 -5.04 105.19 101.50 2k39 n GLY 35 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 2k39 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k39 s ILE 36 N -2.00 4.59 0.34 -0.61 1.01 -1.26 -4.97 121.20 118.30 2k39 s ILE 36 Ca 0.00 1.60 -0.28 0.00 0.00 0.00 0.00 60.65 61.97 2k39 s ILE 36 Cb 0.00 -4.10 -0.12 0.00 0.01 0.00 0.00 42.46 38.25 2k39 s ILE 36 CO 0.00 0.45 1.30 -2.65 0.00 0.00 0.00 174.94 174.04 2k39 n PRO 37 N 2.20 2.16 -0.04 2.79 -0.02 -1.26 -4.53 135.00 136.30 2k39 n PRO 37 Ca -0.05 0.76 0.25 0.00 -2.02 0.00 0.00 63.50 62.44 2k39 n PRO 37 Cb 0.50 -2.35 0.69 0.00 -0.02 0.00 0.00 33.50 32.31 2k39 n PRO 37 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2k39 h PRO 38 N 2.59 0.00 -1.07 0.52 0.13 -1.96 -2.68 132.00 129.53 2k39 h PRO 38 Ca -0.46 0.00 0.33 0.00 -0.87 0.00 0.00 66.00 65.00 2k39 h PRO 38 Cb 1.28 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.27 2k39 h PRO 38 CO 0.63 0.00 0.64 0.22 -0.23 0.00 0.00 178.00 179.26 2k39 h ASP 39 N 0.00 0.46 0.02 1.44 1.82 -1.96 -1.33 116.42 116.88 2k39 h ASP 39 Ca 0.32 0.16 0.00 0.00 -0.39 0.00 0.00 57.03 57.12 2k39 h ASP 39 Cb 1.65 0.11 0.00 0.00 0.68 0.00 0.00 39.33 41.77 2k39 h ASP 39 CO -0.00 -0.10 -0.37 0.00 -1.61 0.00 0.00 179.24 177.15 2k39 n GLN 40 N -4.91 1.30 -3.48 0.28 3.00 -1.01 -4.74 117.38 107.82 2k39 n GLN 40 Ca 0.32 -1.03 -0.39 0.00 -0.01 0.00 0.00 57.00 55.88 2k39 n GLN 40 Cb 1.05 -1.48 -0.10 0.00 0.00 0.00 0.00 30.24 29.71 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2k39 s GLN 41 N -2.41 3.77 -0.28 -1.09 -1.52 -0.50 -0.02 119.66 117.61 2k39 s GLN 41 Ca 0.21 -0.32 -0.04 0.00 -1.95 0.00 0.00 55.36 53.26 2k39 s GLN 41 Cb 0.19 -3.73 0.02 0.00 -0.22 0.00 0.00 33.01 29.27 2k39 s GLN 41 CO 0.52 -0.35 0.01 0.50 -0.25 0.00 0.00 175.29 175.72 2k39 s ARG 42 N 1.90 2.85 0.25 2.91 3.52 -0.93 -4.80 118.95 124.65 2k39 s ARG 42 Ca 0.10 -0.99 -0.23 0.00 -0.13 0.00 0.00 55.73 54.48 2k39 s ARG 42 Cb -0.16 -3.18 -0.09 0.00 -1.56 0.00 0.00 34.95 29.96 2k39 s ARG 42 CO 0.11 -0.47 0.82 -0.51 -0.81 0.00 0.00 175.30 174.44 2k39 s LEU 43 N 1.38 4.40 0.02 -0.88 1.43 -1.26 -0.84 118.68 122.92 2k39 s LEU 43 Ca 0.00 1.62 0.03 0.00 -1.03 0.00 0.00 54.13 54.75 2k39 s LEU 43 Cb -0.17 -3.69 -0.01 0.00 0.03 0.00 0.00 46.19 42.34 2k39 s LEU 43 CO -0.01 0.03 -0.09 -0.51 0.23 0.00 0.00 176.35 176.00 2k39 s ILE 44 N -1.48 0.69 -0.42 -0.59 2.07 0.45 -2.32 121.20 119.61 2k39 s ILE 44 Ca 0.44 -0.65 0.03 0.00 -1.41 0.00 0.00 60.65 59.06 2k39 s ILE 44 Cb -0.19 -0.64 0.16 0.00 0.13 0.00 0.00 42.46 41.92 2k39 s ILE 44 CO 0.23 -0.00 0.30 0.12 -1.91 0.00 0.00 174.94 173.68 2k39 s PHE 45 N -0.61 1.29 0.00 3.50 5.36 0.93 -2.13 117.98 126.33 2k39 s PHE 45 Ca -0.00 -2.21 0.00 0.00 -0.96 0.00 0.00 56.93 53.76 2k39 s PHE 45 Cb -0.06 -1.18 0.00 0.00 -0.34 0.00 0.00 43.02 41.44 2k39 s PHE 45 CO 0.00 -0.80 0.00 0.00 -1.46 0.00 0.00 175.22 172.96 2k39 n ALA 46 N 3.22 0.00 0.00 11.12 0.00 -1.26 -3.61 120.51 129.98 2k39 n ALA 46 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2k39 n ALA 46 Cb 0.42 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.48 2k39 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k39 n GLY 47 N -1.91 0.82 3.25 0.00 0.00 -1.26 -5.09 105.19 101.01 2k39 n GLY 47 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2k39 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k39 s LYS 48 N -0.39 2.21 0.03 1.61 2.20 -1.24 -5.12 119.74 119.04 2k39 s LYS 48 Ca 0.00 -0.85 -0.30 0.00 -0.36 0.00 0.00 55.97 54.46 2k39 s LYS 48 Cb 0.00 -1.97 -0.05 0.00 -1.51 0.00 0.00 37.83 34.30 2k39 s LYS 48 CO 0.00 0.42 1.27 -0.65 -0.36 0.00 0.00 175.35 176.02 2k39 s GLN 49 N -0.29 4.37 -0.10 4.03 1.11 -1.26 -0.05 119.66 127.47 2k39 s GLN 49 Ca 0.01 1.83 -0.16 0.00 0.01 0.00 0.00 55.36 57.05 2k39 s GLN 49 Cb -0.12 -3.42 -0.05 0.00 -1.01 0.00 0.00 33.01 28.42 2k39 s GLN 49 CO 0.02 -0.38 0.41 -0.51 0.01 0.00 0.00 175.29 174.83 2k39 s LEU 50 N 1.56 4.31 0.03 2.90 1.43 -0.98 -4.92 118.68 123.01 2k39 s LEU 50 Ca 0.60 0.76 0.03 0.00 -1.03 0.00 0.00 54.13 54.49 2k39 s LEU 50 Cb -0.30 -2.58 -0.02 0.00 0.03 0.00 0.00 46.19 43.33 2k39 s LEU 50 CO 0.27 0.10 -0.09 -0.70 0.23 0.00 0.00 176.35 176.17 2k39 s GLU 51 N 0.20 0.60 0.27 1.70 2.56 -1.26 -4.65 118.70 118.13 2k39 s GLU 51 Ca 0.23 -0.59 -0.22 0.00 0.00 0.00 0.00 54.97 54.39 2k39 s GLU 51 Cb -0.15 -0.50 -0.09 0.00 2.00 0.00 0.00 34.13 35.39 2k39 s GLU 51 CO 0.09 0.12 0.82 -0.51 -0.56 0.00 0.00 175.26 175.22 2k39 s ASP 52 N -1.02 7.15 0.00 -1.70 1.11 -1.26 -4.00 116.67 116.94 2k39 s ASP 52 Ca -0.03 1.58 0.00 0.00 0.18 0.00 0.00 52.55 54.28 2k39 s ASP 52 Cb -0.07 -2.48 0.00 0.00 1.07 0.00 0.00 42.92 41.44 2k39 s ASP 52 CO 0.00 -0.03 0.00 0.61 1.18 0.00 0.00 175.17 176.93 2k39 n GLY 53 N 0.56 1.07 3.62 0.21 0.00 -1.26 -5.11 105.19 104.27 2k39 n GLY 53 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2k39 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k39 s ARG 54 N -0.32 2.03 0.59 1.61 0.52 -1.26 -5.13 118.95 116.99 2k39 s ARG 54 Ca 0.00 -2.25 0.04 0.00 -0.52 0.00 0.00 55.73 53.00 2k39 s ARG 54 Cb 0.00 -1.03 0.08 0.00 0.52 0.00 0.00 34.95 34.52 2k39 s ARG 54 CO 0.00 -0.40 0.82 0.95 0.02 0.00 0.00 175.30 176.69 2k39 s THR 55 N -3.06 2.38 0.50 0.02 -4.23 -1.26 -4.08 115.64 105.91 2k39 s THR 55 Ca 0.18 -0.80 0.17 0.00 -1.18 0.00 0.00 61.69 60.06 2k39 s THR 55 Cb 0.03 -2.58 0.32 0.00 1.34 0.00 0.00 72.50 71.60 2k39 s THR 55 CO 0.10 0.00 2.07 -0.07 -0.54 0.00 0.00 174.62 176.18 2k39 h LEU 56 N -0.01 0.11 -1.61 4.79 4.07 -1.41 -2.76 115.31 118.49 2k39 h LEU 56 Ca -0.36 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.56 2k39 h LEU 56 Cb 1.28 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.99 2k39 h LEU 56 CO 0.43 0.07 -0.19 -1.28 -1.08 0.00 0.00 178.44 176.39 2k39 h SER 57 N 0.12 0.00 1.77 -0.43 0.87 -1.80 -2.03 113.55 112.05 2k39 h SER 57 Ca 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2k39 h SER 57 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2k39 h SER 57 CO -0.02 0.19 0.00 0.44 -0.53 0.00 0.00 176.83 176.92 2k39 h ASP 58 N 0.00 0.00 -0.31 6.23 5.19 -1.83 -3.27 116.42 122.44 2k39 h ASP 58 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2k39 h ASP 58 Cb 0.48 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.99 2k39 h ASP 58 CO 0.02 0.00 0.00 -1.22 -3.12 0.00 0.00 179.24 174.92 2k39 n TYR 59 N -3.10 0.40 -2.29 4.55 4.01 -1.02 -4.99 117.16 114.73 2k39 n TYR 59 Ca 0.03 -0.34 -0.12 0.00 -0.16 0.00 0.00 57.90 57.32 2k39 n TYR 59 Cb 0.48 -0.01 -0.00 0.00 -0.31 0.00 0.00 39.34 39.49 2k39 n TYR 59 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2k39 n ASN 60 N 0.81 -3.81 -4.67 7.72 6.94 -0.79 -4.98 115.26 116.48 2k39 n ASN 60 Ca 0.13 -0.03 -0.43 0.00 -0.02 0.00 0.00 54.58 54.23 2k39 n ASN 60 Cb 0.44 -2.99 -0.02 0.00 -2.36 0.00 0.00 39.78 34.85 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2k39 s ILE 61 N -2.63 4.64 0.35 1.53 1.01 -1.06 -5.03 121.20 120.02 2k39 s ILE 61 Ca 0.02 1.95 0.08 0.00 0.00 0.00 0.00 60.65 62.71 2k39 s ILE 61 Cb -0.01 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.16 2k39 s ILE 61 CO 0.03 -0.09 0.15 -1.10 0.00 0.00 0.00 174.94 173.93 2k39 s GLN 62 N 2.70 2.37 0.38 2.79 -0.21 -1.26 -4.79 119.66 121.63 2k39 s GLN 62 Ca 0.48 -1.57 -0.24 0.00 0.02 0.00 0.00 55.36 54.05 2k39 s GLN 62 Cb -0.18 -2.17 -0.13 0.00 1.00 0.00 0.00 33.01 31.54 2k39 s GLN 62 CO 0.13 0.09 0.66 0.36 -2.12 0.00 0.00 175.29 174.40 2k39 n LYS 63 N -1.17 0.71 -1.62 2.91 2.85 -1.26 -3.12 118.16 117.47 2k39 n LYS 63 Ca -0.03 0.26 -0.17 0.00 -1.05 0.00 0.00 58.31 57.32 2k39 n LYS 63 Cb 0.61 -1.56 -0.06 0.00 -0.65 0.00 0.00 35.03 33.37 2k39 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2k39 n GLU 64 N 0.62 -1.21 -2.76 -1.58 1.02 0.38 -4.96 120.64 112.14 2k39 n GLU 64 Ca 0.12 1.06 -0.32 0.00 -0.02 0.00 0.00 57.16 58.00 2k39 n GLU 64 Cb 0.37 -5.32 -0.05 0.00 -0.02 0.00 0.00 31.44 26.42 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2k39 s SER 65 N -2.74 6.69 -0.38 1.62 0.01 -1.18 -4.87 113.70 112.86 2k39 s SER 65 Ca 0.00 1.42 -0.06 0.00 1.31 0.00 0.00 55.95 58.61 2k39 s SER 65 Cb 0.00 -2.44 0.07 0.00 0.21 0.00 0.00 66.02 63.86 2k39 s SER 65 CO 0.00 -0.41 0.17 -0.89 0.41 0.00 0.00 173.24 172.52 2k39 s THR 66 N -2.33 3.74 0.47 1.44 2.01 -1.26 -1.49 115.64 118.22 2k39 s THR 66 Ca 0.56 -1.47 -0.14 0.00 0.31 0.00 0.00 61.69 60.96 2k39 s THR 66 Cb -0.10 -3.28 -0.07 0.00 0.01 0.00 0.00 72.50 69.06 2k39 s THR 66 CO 0.25 -0.41 0.89 -0.76 -0.69 0.00 0.00 174.62 173.90 2k39 s LEU 67 N 1.33 3.70 0.09 4.42 1.43 -0.16 -4.87 118.68 124.63 2k39 s LEU 67 Ca 0.02 1.37 0.09 0.00 -1.03 0.00 0.00 54.13 54.58 2k39 s LEU 67 Cb -0.22 -4.28 -0.04 0.00 0.03 0.00 0.00 46.19 41.68 2k39 s LEU 67 CO 0.00 -0.51 -0.21 -2.28 0.23 0.00 0.00 176.35 173.58 2k39 s HIS 68 N -2.53 2.46 0.05 0.29 5.65 -0.90 -1.19 115.29 119.11 2k39 s HIS 68 Ca 0.55 -0.31 0.04 0.00 0.25 0.00 0.00 55.06 55.59 2k39 s HIS 68 Cb -0.10 -1.36 -0.04 0.00 -1.18 0.00 0.00 32.58 29.90 2k39 s HIS 68 CO 0.32 0.31 -0.02 -1.17 -0.65 0.00 0.00 174.74 173.53 2k39 s LEU 69 N -1.83 3.39 0.30 8.88 2.96 -0.88 -0.41 118.68 131.09 2k39 s LEU 69 Ca 0.15 -0.14 0.04 0.00 -0.22 0.00 0.00 54.13 53.96 2k39 s LEU 69 Cb -0.10 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 2k39 s LEU 69 CO 0.07 0.22 0.18 0.68 -1.32 0.00 0.00 176.35 176.18 2k39 s VAL 70 N -1.19 0.23 0.07 1.68 -7.23 -0.02 -4.56 120.40 109.38 2k39 s VAL 70 Ca 0.22 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.43 2k39 s VAL 70 Cb -0.11 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 2k39 s VAL 70 CO 0.14 0.00 0.05 -0.22 -0.31 0.00 0.00 175.10 174.75 2k39 s LEU 71 N -3.36 3.67 -0.63 1.32 2.96 -1.26 -2.18 118.68 119.20 2k39 s LEU 71 Ca 0.36 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 54.23 2k39 s LEU 71 Cb 0.04 -2.34 0.16 0.00 0.50 0.00 0.00 46.19 44.55 2k39 s LEU 71 CO 0.19 0.19 0.41 -0.60 -1.32 0.00 0.00 176.35 175.22 2k39 s ARG 72 N -2.26 2.38 -0.16 1.98 3.52 0.97 -4.72 118.95 120.66 2k39 s ARG 72 Ca 0.27 -2.81 -0.13 0.00 -0.13 0.00 0.00 55.73 52.93 2k39 s ARG 72 Cb -0.12 -3.52 -0.05 0.00 -1.56 0.00 0.00 34.95 29.70 2k39 s ARG 72 CO 0.19 -1.18 0.27 -0.51 -0.81 0.00 0.00 175.30 173.26 2k39 s LEU 73 N -0.58 4.26 0.00 -0.88 1.43 -1.26 -4.36 118.68 117.29 2k39 s LEU 73 Ca 0.20 0.49 0.00 0.00 -1.03 0.00 0.00 54.13 53.78 2k39 s LEU 73 Cb -0.18 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.71 2k39 s LEU 73 CO -0.05 0.14 0.00 -1.14 0.23 0.00 0.00 176.35 175.52 2k39 n ARG 74 N 3.40 0.00 -2.31 1.70 0.63 -1.26 -4.78 116.66 114.04 2k39 n ARG 74 Ca -0.13 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.75 2k39 n ARG 74 Cb 0.52 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.42 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k39 n GLY 75 N 0.00 3.91 0.87 5.14 0.00 -1.26 -5.24 105.19 108.61 2k39 n GLY 75 Ca 0.00 -2.23 0.11 0.00 0.00 0.00 0.00 46.02 43.90 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93