#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 4.62 0.10 2.12 -2.07 -1.26 0.55 119.66 123.72 2k39 s GLN 2 Ca 0.00 1.60 0.01 0.00 -1.82 0.00 0.00 55.36 55.15 2k39 s GLN 2 Cb 0.00 -3.33 -0.04 0.00 -1.09 0.00 0.00 33.01 28.55 2k39 s GLN 2 CO 0.00 0.09 -0.03 0.96 -1.32 0.00 0.00 175.29 175.00 2k39 s ILE 3 N 0.03 0.47 0.01 3.63 -4.36 -0.86 -0.98 121.20 119.14 2k39 s ILE 3 Ca 0.49 -1.91 0.04 0.00 -0.26 0.00 0.00 60.65 59.02 2k39 s ILE 3 Cb -0.27 -1.77 -0.03 0.00 1.25 0.00 0.00 42.46 41.64 2k39 s ILE 3 CO 0.32 -0.78 -0.10 -0.36 0.24 0.00 0.00 174.94 174.26 2k39 s PHE 4 N -3.78 2.79 -0.17 1.37 0.08 0.26 -2.63 117.98 115.90 2k39 s PHE 4 Ca 0.15 -0.11 -0.02 0.00 0.12 0.00 0.00 56.93 57.07 2k39 s PHE 4 Cb 0.06 -1.57 0.05 0.00 -0.57 0.00 0.00 43.02 41.00 2k39 s PHE 4 CO -0.04 0.33 0.00 0.08 -0.10 0.00 0.00 175.22 175.50 2k39 s VAL 5 N -0.96 0.71 -0.02 -0.44 1.01 0.28 -1.38 120.40 119.59 2k39 s VAL 5 Ca 0.16 -0.52 -0.30 0.00 0.00 0.00 0.00 61.98 61.32 2k39 s VAL 5 Cb -0.11 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2k39 s VAL 5 CO 0.07 -0.05 1.32 -0.75 0.00 0.00 0.00 175.10 175.69 2k39 s LYS 6 N 1.79 4.31 0.48 2.72 2.47 0.76 -0.17 119.74 132.09 2k39 s LYS 6 Ca -0.00 1.85 -0.03 0.00 -1.56 0.00 0.00 55.97 56.23 2k39 s LYS 6 Cb -0.16 -3.57 -0.01 0.00 -1.46 0.00 0.00 37.83 32.63 2k39 s LYS 6 CO -0.07 -0.52 0.74 0.95 0.16 0.00 0.00 175.35 176.61 2k39 s THR 7 N 2.33 4.25 -0.84 3.43 -4.23 0.04 -1.00 115.64 119.62 2k39 s THR 7 Ca 0.61 -0.20 0.25 0.00 -1.18 0.00 0.00 61.69 61.17 2k39 s THR 7 Cb -0.29 -3.61 0.24 0.00 1.34 0.00 0.00 72.50 70.19 2k39 s THR 7 CO 0.25 -0.52 1.79 0.00 -0.54 0.00 0.00 174.62 175.60 2k39 n LEU 8 N -2.22 0.39 0.01 4.79 -0.00 -1.12 -3.13 117.00 115.71 2k39 n LEU 8 Ca 0.01 0.55 0.13 0.00 -0.00 0.00 0.00 56.01 56.71 2k39 n LEU 8 Cb 0.57 -0.44 0.58 0.00 -0.00 0.00 0.00 43.42 44.13 2k39 n LEU 8 CO 0.50 -0.17 0.94 0.35 -0.00 0.00 0.00 177.39 179.01 2k39 n THR 9 N -1.88 0.11 0.00 1.47 -2.24 -1.26 -4.91 114.28 105.57 2k39 n THR 9 Ca 0.05 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2k39 n THR 9 Cb 0.34 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 68.03 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 1.38 1.08 3.76 3.38 0.00 -1.19 -5.09 105.19 108.52 2k39 n GLY 10 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.83 3.12 -0.38 1.61 2.20 -1.26 -4.97 119.74 119.24 2k39 s LYS 11 Ca 0.00 -0.34 -0.01 0.00 -0.36 0.00 0.00 55.97 55.26 2k39 s LYS 11 Cb 0.00 -2.92 0.10 0.00 -1.51 0.00 0.00 37.83 33.51 2k39 s LYS 11 CO 0.00 0.72 0.14 0.99 -0.36 0.00 0.00 175.35 176.84 2k39 s THR 12 N -0.98 2.98 -0.15 3.43 2.01 -1.26 -0.78 115.64 120.89 2k39 s THR 12 Ca 0.15 -2.08 -0.28 0.00 0.31 0.00 0.00 61.69 59.79 2k39 s THR 12 Cb -0.12 -3.05 -0.01 0.00 0.01 0.00 0.00 72.50 69.33 2k39 s THR 12 CO 0.05 -0.62 0.97 -0.63 -0.69 0.00 0.00 174.62 173.70 2k39 s ILE 13 N 1.08 4.78 -0.23 1.82 1.01 0.76 -4.89 121.20 125.54 2k39 s ILE 13 Ca 0.08 1.93 -0.08 0.00 0.00 0.00 0.00 60.65 62.59 2k39 s ILE 13 Cb -0.22 -4.27 -0.03 0.00 0.01 0.00 0.00 42.46 37.95 2k39 s ILE 13 CO -0.05 -0.03 0.08 -0.89 0.00 0.00 0.00 174.94 174.04 2k39 s THR 14 N 2.33 4.55 -0.07 2.92 2.01 -1.26 -0.56 115.64 125.56 2k39 s THR 14 Ca 0.45 -0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.37 2k39 s THR 14 Cb -0.17 -3.10 0.01 0.00 0.01 0.00 0.00 72.50 69.25 2k39 s THR 14 CO 0.14 0.38 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.52 2k39 s LEU 15 N 1.16 1.78 -0.22 4.42 1.43 -1.08 -5.04 118.68 121.14 2k39 s LEU 15 Ca 0.05 -0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 2k39 s LEU 15 Cb -0.14 -0.99 -0.02 0.00 0.03 0.00 0.00 46.19 45.07 2k39 s LEU 15 CO 0.03 0.08 1.46 -0.70 0.23 0.00 0.00 176.35 177.45 2k39 s GLU 16 N 0.53 3.95 0.46 1.70 2.56 -1.26 -2.03 118.70 124.61 2k39 s GLU 16 Ca -0.15 1.59 0.08 0.00 0.00 0.00 0.00 54.97 56.49 2k39 s GLU 16 Cb -0.16 -3.93 0.01 0.00 2.00 0.00 0.00 34.13 32.04 2k39 s GLU 16 CO 0.05 -1.08 0.45 0.14 -0.56 0.00 0.00 175.26 174.26 2k39 s VAL 17 N 4.51 2.43 0.02 3.70 -7.23 0.19 -4.84 120.40 119.17 2k39 s VAL 17 Ca 0.64 -1.30 -0.07 0.00 -1.81 0.00 0.00 61.98 59.44 2k39 s VAL 17 Cb -0.23 -2.73 -0.05 0.00 0.56 0.00 0.00 36.38 33.94 2k39 s VAL 17 CO 0.25 0.00 0.28 -0.70 -0.31 0.00 0.00 175.10 174.62 2k39 s GLU 18 N -4.24 3.60 0.56 4.82 -6.30 -1.26 -0.10 118.70 115.77 2k39 s GLU 18 Ca 0.48 -0.04 0.29 0.00 -2.50 0.00 0.00 54.97 53.19 2k39 s GLU 18 Cb -0.04 -3.07 1.46 0.00 0.00 0.00 0.00 34.13 32.49 2k39 s GLU 18 CO 0.28 0.64 1.93 -1.35 0.02 0.00 0.00 175.26 176.78 2k39 h PRO 19 N 3.95 0.00 -0.02 4.30 0.11 -1.95 -2.18 132.00 136.20 2k39 h PRO 19 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2k39 h PRO 19 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2k39 h PRO 19 CO 0.66 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.32 2k39 n SER 20 N -4.08 0.25 -4.78 -2.05 3.41 -1.26 -1.93 113.62 103.17 2k39 n SER 20 Ca 0.12 -1.47 -0.32 0.00 -0.26 0.00 0.00 58.87 56.93 2k39 n SER 20 Cb 0.73 -0.02 0.06 0.00 -0.26 0.00 0.00 64.21 64.72 2k39 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2k39 s ASP 21 N -1.57 5.05 0.36 4.04 1.01 -0.82 -4.81 116.67 119.93 2k39 s ASP 21 Ca 0.28 1.90 0.08 0.00 0.71 0.00 0.00 52.55 55.52 2k39 s ASP 21 Cb 0.13 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.48 2k39 s ASP 21 CO 0.22 -1.67 0.18 0.42 0.21 0.00 0.00 175.17 174.53 2k39 s THR 22 N -2.57 2.86 0.26 -1.27 -4.23 -1.26 -0.31 115.64 109.12 2k39 s THR 22 Ca 0.64 -1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 59.48 2k39 s THR 22 Cb -0.18 -2.99 0.23 0.00 1.34 0.00 0.00 72.50 70.90 2k39 s THR 22 CO 0.46 -0.13 1.77 0.40 -0.54 0.00 0.00 174.62 176.58 2k39 h ILE 23 N 1.46 0.76 -1.03 2.99 1.08 -1.91 -0.95 117.51 119.91 2k39 h ILE 23 Ca -0.43 -0.22 0.27 0.00 -0.39 0.00 0.00 64.86 64.08 2k39 h ILE 23 Cb 1.25 0.06 -0.08 0.00 -3.07 0.00 0.00 36.82 34.98 2k39 h ILE 23 CO 0.64 0.12 0.68 -0.08 -0.69 0.00 0.00 178.15 178.82 2k39 h GLU 24 N 0.65 0.31 0.00 2.37 4.57 -1.96 -2.47 114.58 118.05 2k39 h GLU 24 Ca 0.45 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.61 2k39 h GLU 24 Cb 0.59 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 2k39 h GLU 24 CO -0.34 0.21 -0.38 -0.91 -1.18 0.00 0.00 179.01 176.41 2k39 h ASN 25 N 0.32 0.00 0.00 1.04 4.21 -1.57 -0.17 115.58 119.41 2k39 h ASN 25 Ca 0.56 -0.12 -0.03 0.00 1.21 0.00 0.00 56.30 57.93 2k39 h ASN 25 Cb 1.56 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.76 2k39 h ASN 25 CO -0.22 0.06 -0.16 0.58 -1.29 0.00 0.00 177.43 176.40 2k39 h VAL 26 N 0.00 1.25 -0.27 2.81 2.07 -1.48 -2.78 116.25 117.85 2k39 h VAL 26 Ca 0.00 -1.99 -0.03 0.00 0.82 0.00 0.00 66.70 65.50 2k39 h VAL 26 Cb 0.77 2.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 2k39 h VAL 26 CO 0.00 0.42 0.03 0.11 0.02 0.00 0.00 177.57 178.15 2k39 h LYS 27 N -1.00 0.39 -0.12 1.57 1.57 -1.45 -1.51 116.57 116.02 2k39 h LYS 27 Ca -0.04 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.49 2k39 h LYS 27 Cb 0.80 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.04 2k39 h LYS 27 CO -0.02 0.39 -0.72 0.00 -0.57 0.00 0.00 179.45 178.53 2k39 h ALA 28 N 1.66 0.51 0.00 3.86 0.00 -1.13 -0.63 119.26 123.53 2k39 h ALA 28 Ca 0.09 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 2k39 h ALA 28 Cb 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2k39 h ALA 28 CO 0.00 0.73 -0.32 0.87 0.00 0.00 0.00 179.25 180.53 2k39 h LYS 29 N 0.38 0.00 -0.17 0.00 1.57 -1.03 -2.23 116.57 115.09 2k39 h LYS 29 Ca -0.03 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.58 2k39 h LYS 29 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 2k39 h LYS 29 CO 0.13 0.32 -0.54 0.82 -0.57 0.00 0.00 179.45 179.62 2k39 h ILE 30 N 0.00 1.32 -0.99 1.86 2.04 -1.09 -3.23 117.51 117.41 2k39 h ILE 30 Ca -0.00 -1.78 0.13 0.00 1.00 0.00 0.00 64.86 64.21 2k39 h ILE 30 Cb 0.60 1.95 -0.09 0.00 -0.74 0.00 0.00 36.82 38.54 2k39 h ILE 30 CO 0.04 0.55 0.62 -0.61 0.00 0.00 0.00 178.15 178.75 2k39 h GLN 31 N 0.36 0.91 0.00 2.37 4.15 -0.74 0.48 115.11 122.64 2k39 h GLN 31 Ca -0.02 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.35 2k39 h GLN 31 Cb 1.16 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.64 2k39 h GLN 31 CO 0.11 0.60 0.00 0.22 -1.93 0.00 0.00 178.83 177.84 2k39 h ASP 32 N 0.94 0.00 0.00 -0.69 3.58 -1.44 -2.13 116.42 116.67 2k39 h ASP 32 Ca 0.51 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.96 2k39 h ASP 32 Cb 0.56 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.61 2k39 h ASP 32 CO -0.29 0.00 -0.58 0.29 -2.88 0.00 0.00 179.24 175.78 2k39 n LYS 33 N -3.07 0.40 -0.02 0.28 5.02 -0.41 -4.78 118.16 115.57 2k39 n LYS 33 Ca -0.00 0.35 -0.06 0.00 -2.02 0.00 0.00 58.31 56.58 2k39 n LYS 33 Cb 0.25 -1.42 -0.13 0.00 -0.02 0.00 0.00 35.03 33.72 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2k39 n GLU 34 N -4.15 0.64 0.00 1.97 -0.58 0.16 -4.98 120.64 113.69 2k39 n GLU 34 Ca -0.08 0.22 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 2k39 n GLU 34 Cb 0.30 -1.75 0.00 0.00 -0.57 0.00 0.00 31.44 29.42 2k39 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k39 n GLY 35 N 1.53 2.59 3.65 0.62 0.00 -0.80 -5.01 105.19 107.77 2k39 n GLY 35 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.47 3.03 0.76 -0.61 1.01 -1.26 -4.89 121.20 116.76 2k39 s ILE 36 Ca 0.00 0.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.56 2k39 s ILE 36 Cb 0.00 -3.02 0.05 0.00 0.01 0.00 0.00 42.46 39.50 2k39 s ILE 36 CO 0.00 -0.01 1.12 -2.16 0.00 0.00 0.00 174.94 173.89 2k39 s PRO 37 N 4.81 2.22 0.44 2.79 0.04 -1.26 -3.92 135.00 140.12 2k39 s PRO 37 Ca 0.90 1.34 0.14 0.00 0.04 0.00 0.00 61.00 63.42 2k39 s PRO 37 Cb -0.41 -1.88 1.05 0.00 0.04 0.00 0.00 34.50 33.30 2k39 s PRO 37 CO 0.40 -1.70 2.01 -1.35 0.04 0.00 0.00 177.00 176.41 2k39 h PRO 38 N -0.83 0.36 -0.00 0.56 0.11 -1.92 -2.07 132.00 128.20 2k39 h PRO 38 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2k39 h PRO 38 Cb 1.25 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2k39 h PRO 38 CO 0.50 0.24 -0.32 -3.47 -0.21 0.00 0.00 178.00 174.74 2k39 n ASP 39 N -4.47 0.33 0.01 -2.05 2.03 -1.26 -3.50 116.55 107.64 2k39 n ASP 39 Ca 0.07 -0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.42 2k39 n ASP 39 Cb 0.30 -0.01 -0.10 0.00 -0.72 0.00 0.00 41.12 40.59 2k39 n ASP 39 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2k39 n GLN 40 N -1.49 0.64 -2.34 -0.67 7.27 -0.89 -4.92 117.38 114.98 2k39 n GLN 40 Ca 0.06 0.03 -0.43 0.00 0.07 0.00 0.00 57.00 56.74 2k39 n GLN 40 Cb 0.34 -1.68 -0.02 0.00 2.41 0.00 0.00 30.24 31.28 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2k39 s GLN 41 N -3.15 4.26 -0.28 3.69 -0.21 -0.83 -2.02 119.66 121.12 2k39 s GLN 41 Ca -0.05 1.78 -0.11 0.00 0.02 0.00 0.00 55.36 57.00 2k39 s GLN 41 Cb 0.10 -3.71 -0.04 0.00 1.00 0.00 0.00 33.01 30.36 2k39 s GLN 41 CO 0.84 -0.64 0.19 0.50 -2.12 0.00 0.00 175.29 174.06 2k39 s ARG 42 N 3.07 3.88 -0.30 2.91 3.52 -0.72 -4.94 118.95 126.37 2k39 s ARG 42 Ca 0.59 -0.37 0.03 0.00 -0.13 0.00 0.00 55.73 55.85 2k39 s ARG 42 Cb -0.26 -3.66 0.08 0.00 -1.56 0.00 0.00 34.95 29.56 2k39 s ARG 42 CO 0.20 -0.21 -0.01 -1.17 -0.81 0.00 0.00 175.30 173.30 2k39 s LEU 43 N 1.75 4.01 0.14 -0.88 2.96 -1.26 -0.22 118.68 125.19 2k39 s LEU 43 Ca 0.07 -1.80 -0.03 0.00 -0.22 0.00 0.00 54.13 52.15 2k39 s LEU 43 Cb -0.16 -1.52 -0.05 0.00 0.50 0.00 0.00 46.19 44.96 2k39 s LEU 43 CO 0.10 -0.31 0.35 -0.63 -1.32 0.00 0.00 176.35 174.55 2k39 s ILE 44 N 1.05 5.21 -0.24 6.68 -1.09 0.14 -3.97 121.20 128.98 2k39 s ILE 44 Ca 0.03 -0.14 -0.02 0.00 -2.23 0.00 0.00 60.65 58.29 2k39 s ILE 44 Cb -0.19 -3.65 0.13 0.00 -1.58 0.00 0.00 42.46 37.17 2k39 s ILE 44 CO -0.08 -0.00 0.36 0.12 -1.23 0.00 0.00 174.94 174.11 2k39 s PHE 45 N -1.69 -0.76 -0.89 3.97 5.36 -1.02 -0.45 117.98 122.50 2k39 s PHE 45 Ca 0.39 0.68 0.00 0.00 -0.96 0.00 0.00 56.93 57.04 2k39 s PHE 45 Cb -0.12 -0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.50 2k39 s PHE 45 CO 0.26 -0.74 0.00 0.00 -1.46 0.00 0.00 175.22 173.29 2k39 n ALA 46 N 5.36 -0.29 0.00 11.12 0.00 -1.26 -2.40 120.51 133.03 2k39 n ALA 46 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2k39 n ALA 46 Cb 0.50 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 -1.05 1.16 3.45 0.00 0.00 -1.26 -5.11 105.19 102.38 2k39 n GLY 47 Ca -0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 2k39 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k39 s LYS 48 N -0.24 1.60 0.43 1.61 -2.85 -1.01 -5.14 119.74 114.13 2k39 s LYS 48 Ca 0.00 -1.78 -0.21 0.00 -1.00 0.00 0.00 55.97 52.98 2k39 s LYS 48 Cb 0.00 -1.39 -0.11 0.00 -2.06 0.00 0.00 37.83 34.27 2k39 s LYS 48 CO 0.00 0.15 0.95 -0.65 0.10 0.00 0.00 175.35 175.90 2k39 s GLN 49 N -3.64 4.23 -0.36 1.78 -1.52 -1.26 -2.44 119.66 116.44 2k39 s GLN 49 Ca 0.29 1.15 -0.03 0.00 -1.95 0.00 0.00 55.36 54.82 2k39 s GLN 49 Cb 0.01 -2.22 0.08 0.00 -0.22 0.00 0.00 33.01 30.66 2k39 s GLN 49 CO 0.13 -0.03 0.13 -0.51 -0.25 0.00 0.00 175.29 174.75 2k39 s LEU 50 N -3.12 4.68 0.16 2.90 1.43 -1.25 -4.92 118.68 118.55 2k39 s LEU 50 Ca 0.61 -1.64 -0.06 0.00 -1.03 0.00 0.00 54.13 52.02 2k39 s LEU 50 Cb -0.10 -1.80 -0.06 0.00 0.03 0.00 0.00 46.19 44.26 2k39 s LEU 50 CO 0.14 -0.42 0.42 -0.70 0.23 0.00 0.00 176.35 176.02 2k39 s GLU 51 N 1.23 3.67 0.52 1.70 2.56 -1.26 -4.98 118.70 122.13 2k39 s GLU 51 Ca 0.02 0.01 -0.18 0.00 0.00 0.00 0.00 54.97 54.82 2k39 s GLU 51 Cb -0.21 -2.80 -0.07 0.00 2.00 0.00 0.00 34.13 33.04 2k39 s GLU 51 CO -0.02 0.43 1.02 -0.51 -0.56 0.00 0.00 175.26 175.63 2k39 s ASP 52 N -2.39 6.31 0.00 -1.70 1.01 -1.26 -4.33 116.67 114.31 2k39 s ASP 52 Ca 0.42 1.78 0.00 0.00 0.71 0.00 0.00 52.55 55.47 2k39 s ASP 52 Cb -0.12 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.27 2k39 s ASP 52 CO 0.24 -0.80 0.00 0.61 0.21 0.00 0.00 175.17 175.42 2k39 n GLY 53 N -0.81 3.21 3.75 0.21 0.00 -1.26 -5.07 105.19 105.21 2k39 n GLY 53 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.50 1.88 0.33 1.61 3.00 -1.26 -4.97 118.95 119.04 2k39 s ARG 54 Ca 0.00 0.97 0.07 0.00 0.00 0.00 0.00 55.73 56.76 2k39 s ARG 54 Cb 0.00 -1.87 -0.01 0.00 0.00 0.00 0.00 34.95 33.07 2k39 s ARG 54 CO 0.00 -1.85 0.44 0.95 0.00 0.00 0.00 175.30 174.84 2k39 s THR 55 N -2.95 4.04 0.12 0.02 -4.23 -1.26 -3.44 115.64 107.94 2k39 s THR 55 Ca 0.62 -1.04 -0.19 0.00 -1.18 0.00 0.00 61.69 59.90 2k39 s THR 55 Cb -0.17 -3.39 -0.05 0.00 1.34 0.00 0.00 72.50 70.22 2k39 s THR 55 CO 0.56 -0.16 1.75 -0.07 -0.54 0.00 0.00 174.62 176.15 2k39 h LEU 56 N 0.95 0.30 -0.92 4.79 3.38 -0.67 -2.30 115.31 120.83 2k39 h LEU 56 Ca -0.46 -0.05 0.26 0.00 0.09 0.00 0.00 57.88 57.72 2k39 h LEU 56 Cb 1.26 -0.08 -0.16 0.00 0.09 0.00 0.00 40.66 41.77 2k39 h LEU 56 CO 0.54 0.26 0.16 0.77 0.09 0.00 0.00 178.44 180.26 2k39 h SER 57 N 0.31 -0.20 0.21 -0.43 4.64 -1.62 0.53 113.55 116.99 2k39 h SER 57 Ca 0.09 0.24 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 2k39 h SER 57 Cb 0.02 0.36 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2k39 h SER 57 CO -0.02 -0.26 -0.10 0.44 -0.87 0.00 0.00 176.83 176.02 2k39 h ASP 58 N 0.10 -0.23 1.01 4.97 3.32 -1.74 -2.52 116.42 121.33 2k39 h ASP 58 Ca 0.58 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.50 2k39 h ASP 58 Cb 1.22 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2k39 h ASP 58 CO -0.77 -0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 175.53 2k39 n TYR 59 N -5.13 0.79 -0.68 4.55 4.01 -0.91 -4.93 117.16 114.86 2k39 n TYR 59 Ca -0.09 0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.92 2k39 n TYR 59 Cb 0.20 -0.94 0.00 0.00 -0.31 0.00 0.00 39.34 38.28 2k39 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2k39 n ASN 60 N -2.19 -1.80 -4.78 7.72 5.15 0.17 -5.01 115.26 114.52 2k39 n ASN 60 Ca 0.04 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.64 2k39 n ASN 60 Cb 0.31 -0.32 -0.06 0.00 -0.53 0.00 0.00 39.78 39.18 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2k39 s ILE 61 N -2.00 4.03 0.25 -1.44 1.01 -0.16 -4.96 121.20 117.92 2k39 s ILE 61 Ca 0.00 1.70 -0.01 0.00 0.00 0.00 0.00 60.65 62.34 2k39 s ILE 61 Cb 0.00 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 2k39 s ILE 61 CO 0.00 0.15 0.25 -1.58 0.00 0.00 0.00 174.94 173.76 2k39 s GLN 62 N -2.04 1.43 -0.00 2.79 2.00 -1.26 -4.53 119.66 118.04 2k39 s GLN 62 Ca 0.51 -1.66 -0.30 0.00 -2.00 0.00 0.00 55.36 51.91 2k39 s GLN 62 Cb -0.21 0.33 -0.08 0.00 0.80 0.00 0.00 33.01 33.85 2k39 s GLN 62 CO 0.27 -0.52 1.87 0.21 -0.50 0.00 0.00 175.29 176.61 2k39 s LYS 63 N -3.90 4.13 0.00 1.67 2.20 -1.26 -1.97 119.74 120.62 2k39 s LYS 63 Ca 0.36 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.42 2k39 s LYS 63 Cb 0.04 -4.11 0.00 0.00 -1.51 0.00 0.00 37.83 32.25 2k39 s LYS 63 CO 0.15 -0.94 0.00 0.39 -0.36 0.00 0.00 175.35 174.59 2k39 n GLU 64 N 7.43 0.00 -2.35 4.03 1.02 -0.16 -5.00 120.64 125.61 2k39 n GLU 64 Ca 0.19 0.19 -0.40 0.00 -0.02 0.00 0.00 57.16 57.13 2k39 n GLU 64 Cb 0.42 -2.59 -0.03 0.00 -0.02 0.00 0.00 31.44 29.21 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 -2.39 6.96 -0.26 1.62 0.01 -0.83 -4.66 113.70 114.15 2k39 s SER 65 Ca 0.00 2.38 -0.06 0.00 1.31 0.00 0.00 55.95 59.58 2k39 s SER 65 Cb 0.00 -2.63 -0.01 0.00 0.21 0.00 0.00 66.02 63.60 2k39 s SER 65 CO 0.00 -0.37 0.05 -0.89 0.41 0.00 0.00 173.24 172.44 2k39 s THR 66 N -1.24 3.92 -0.08 1.44 2.01 -1.26 0.89 115.64 121.33 2k39 s THR 66 Ca 0.49 -0.49 -0.05 0.00 0.31 0.00 0.00 61.69 61.94 2k39 s THR 66 Cb -0.33 -2.91 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 2k39 s THR 66 CO 0.43 0.24 0.15 -0.76 -0.69 0.00 0.00 174.62 173.99 2k39 s LEU 67 N 1.53 4.37 -0.19 4.42 1.02 -0.48 -4.55 118.68 124.80 2k39 s LEU 67 Ca 0.04 0.42 -0.05 0.00 0.02 0.00 0.00 54.13 54.57 2k39 s LEU 67 Cb -0.16 -2.25 -0.02 0.00 0.02 0.00 0.00 46.19 43.77 2k39 s LEU 67 CO 0.01 0.36 -0.01 -1.00 0.02 0.00 0.00 176.35 175.73 2k39 s HIS 68 N -1.13 3.04 -0.13 0.29 3.76 0.41 -0.17 115.29 121.35 2k39 s HIS 68 Ca 0.19 -0.44 -0.13 0.00 -0.15 0.00 0.00 55.06 54.53 2k39 s HIS 68 Cb -0.12 -2.06 -0.05 0.00 1.11 0.00 0.00 32.58 31.46 2k39 s HIS 68 CO 0.09 -0.21 0.29 -1.17 -0.85 0.00 0.00 174.74 172.89 2k39 s LEU 69 N 0.90 4.30 0.24 0.89 2.96 -0.17 0.25 118.68 128.05 2k39 s LEU 69 Ca 0.01 0.58 0.11 0.00 -0.22 0.00 0.00 54.13 54.61 2k39 s LEU 69 Cb -0.14 -2.37 -0.05 0.00 0.50 0.00 0.00 46.19 44.13 2k39 s LEU 69 CO 0.02 0.17 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.33 2k39 s VAL 70 N 0.03 2.31 -0.04 1.68 1.01 0.70 -2.79 120.40 123.30 2k39 s VAL 70 Ca 0.17 -2.25 -0.03 0.00 0.00 0.00 0.00 61.98 59.87 2k39 s VAL 70 Cb -0.13 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 2k39 s VAL 70 CO 0.05 -0.34 0.14 -0.76 0.00 0.00 0.00 175.10 174.19 2k39 s LEU 71 N -3.21 4.23 0.05 3.92 1.43 -1.26 -1.75 118.68 122.09 2k39 s LEU 71 Ca 0.26 0.33 -0.25 0.00 -1.03 0.00 0.00 54.13 53.44 2k39 s LEU 71 Cb -0.05 -2.34 -0.06 0.00 0.03 0.00 0.00 46.19 43.77 2k39 s LEU 71 CO 0.12 0.31 0.76 -0.60 0.23 0.00 0.00 176.35 177.18 2k39 s ARG 72 N -1.57 4.49 -0.10 1.70 3.52 -0.86 -4.86 118.95 121.28 2k39 s ARG 72 Ca 0.22 1.06 0.02 0.00 -0.13 0.00 0.00 55.73 56.90 2k39 s ARG 72 Cb -0.12 -3.36 -0.02 0.00 -1.56 0.00 0.00 34.95 29.89 2k39 s ARG 72 CO 0.12 0.29 -0.15 -0.51 -0.81 0.00 0.00 175.30 174.25 2k39 s LEU 73 N -0.10 2.66 0.00 -0.88 1.43 -1.26 -4.92 118.68 115.62 2k39 s LEU 73 Ca 0.38 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 2k39 s LEU 73 Cb -0.21 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2k39 s LEU 73 CO 0.23 0.23 0.01 -2.11 0.23 0.00 0.00 176.35 174.94 2k39 n ARG 74 N 3.06 0.87 0.00 1.70 1.85 -1.26 -5.01 116.66 117.87 2k39 n ARG 74 Ca -0.18 -0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.67 2k39 n ARG 74 Cb 0.52 -0.11 0.00 0.00 -1.05 0.00 0.00 32.46 31.82 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2k39 n GLY 75 N 0.13 3.61 0.00 2.89 0.00 -1.26 -5.34 105.19 105.21 2k39 n GLY 75 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.00 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93