#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 4.28 0.32 3.17 1.11 -1.26 -1.02 119.66 126.26 2k39 s GLN 2 Ca 0.00 0.68 0.08 0.00 0.01 0.00 0.00 55.36 56.13 2k39 s GLN 2 Cb 0.00 -3.53 -0.04 0.00 -1.01 0.00 0.00 33.01 28.43 2k39 s GLN 2 CO 0.00 -0.13 0.17 0.96 0.01 0.00 0.00 175.29 176.30 2k39 s ILE 3 N 1.52 3.33 0.05 1.08 -4.36 -0.50 -0.45 121.20 121.87 2k39 s ILE 3 Ca 0.31 -1.60 0.08 0.00 -0.26 0.00 0.00 60.65 59.18 2k39 s ILE 3 Cb -0.16 -3.06 -0.03 0.00 1.25 0.00 0.00 42.46 40.46 2k39 s ILE 3 CO 0.12 -0.21 -0.22 -0.36 0.24 0.00 0.00 174.94 174.51 2k39 s PHE 4 N -2.36 2.45 -0.11 1.37 0.08 0.03 -3.05 117.98 116.39 2k39 s PHE 4 Ca 0.37 -0.32 0.03 0.00 0.12 0.00 0.00 56.93 57.13 2k39 s PHE 4 Cb -0.04 -1.41 0.01 0.00 -0.57 0.00 0.00 43.02 41.00 2k39 s PHE 4 CO 0.24 0.22 -0.20 0.08 -0.10 0.00 0.00 175.22 175.46 2k39 s VAL 5 N -0.91 1.83 -0.35 -0.44 1.01 -0.62 -1.41 120.40 119.50 2k39 s VAL 5 Ca 0.14 -0.86 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 2k39 s VAL 5 Cb -0.10 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.66 2k39 s VAL 5 CO 0.04 0.51 1.45 -0.75 0.00 0.00 0.00 175.10 176.35 2k39 s LYS 6 N 0.66 3.65 -0.18 2.72 2.20 0.11 -1.80 119.74 127.10 2k39 s LYS 6 Ca -0.12 1.15 -0.05 0.00 -0.36 0.00 0.00 55.97 56.59 2k39 s LYS 6 Cb -0.16 -4.01 -0.03 0.00 -1.51 0.00 0.00 37.83 32.12 2k39 s LYS 6 CO 0.03 -1.46 -0.01 0.99 -0.36 0.00 0.00 175.35 174.53 2k39 s THR 7 N 5.32 3.95 -1.04 3.43 2.01 -0.53 -2.15 115.64 126.64 2k39 s THR 7 Ca 0.63 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.31 2k39 s THR 7 Cb -0.17 -2.76 0.00 0.00 0.01 0.00 0.00 72.50 69.58 2k39 s THR 7 CO 0.30 0.46 0.69 0.00 -0.69 0.00 0.00 174.62 175.38 2k39 n LEU 8 N 3.93 0.00 -0.17 4.42 -0.00 -1.26 -1.97 117.00 121.95 2k39 n LEU 8 Ca -0.17 0.24 0.11 0.00 -0.00 0.00 0.00 56.01 56.19 2k39 n LEU 8 Cb 0.52 -0.24 0.56 0.00 -0.00 0.00 0.00 43.42 44.26 2k39 n LEU 8 CO 0.32 -0.24 0.87 0.35 -0.00 0.00 0.00 177.39 178.69 2k39 n THR 9 N -1.19 0.05 -0.44 1.47 -2.24 -1.26 -4.86 114.28 105.81 2k39 n THR 9 Ca 0.00 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2k39 n THR 9 Cb 0.08 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 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 0.93 0.88 3.19 3.38 0.00 -0.83 -5.08 105.19 107.65 2k39 n GLY 10 Ca 0.16 -0.39 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.99 2.05 -0.71 1.61 2.20 -0.93 -5.03 119.74 117.94 2k39 s LYS 11 Ca 0.00 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 54.89 2k39 s LYS 11 Cb 0.00 -1.77 0.18 0.00 -1.51 0.00 0.00 37.83 34.73 2k39 s LYS 11 CO 0.00 0.30 0.52 0.99 -0.36 0.00 0.00 175.35 176.81 2k39 s THR 12 N -0.06 3.55 0.70 3.43 2.01 -1.26 -1.45 115.64 122.55 2k39 s THR 12 Ca -0.03 -3.59 -0.11 0.00 0.31 0.00 0.00 61.69 58.27 2k39 s THR 12 Cb -0.12 -3.29 0.01 0.00 0.01 0.00 0.00 72.50 69.10 2k39 s THR 12 CO 0.03 -0.96 1.06 0.27 -0.69 0.00 0.00 174.62 174.33 2k39 s ILE 13 N -0.80 3.94 -0.03 1.82 -4.36 -0.75 -4.81 121.20 116.21 2k39 s ILE 13 Ca 0.22 0.63 0.04 0.00 -0.26 0.00 0.00 60.65 61.28 2k39 s ILE 13 Cb -0.14 -3.48 -0.00 0.00 1.25 0.00 0.00 42.46 40.09 2k39 s ILE 13 CO -0.08 -0.82 -0.14 0.28 0.24 0.00 0.00 174.94 174.41 2k39 s THR 14 N -3.15 1.17 0.01 8.37 -1.32 -1.26 -1.59 115.64 117.86 2k39 s THR 14 Ca 0.58 -0.59 -0.02 0.00 -1.21 0.00 0.00 61.69 60.46 2k39 s THR 14 Cb -0.13 -1.01 -0.01 0.00 -1.51 0.00 0.00 72.50 69.84 2k39 s THR 14 CO 0.54 0.34 0.02 -1.48 -2.21 0.00 0.00 174.62 171.83 2k39 s LEU 15 N 0.01 2.02 -0.26 9.08 2.34 -1.17 -5.01 118.68 125.68 2k39 s LEU 15 Ca -0.02 -0.27 -0.18 0.00 0.06 0.00 0.00 54.13 53.72 2k39 s LEU 15 Cb -0.09 0.20 -0.03 0.00 -0.56 0.00 0.00 46.19 45.70 2k39 s LEU 15 CO 0.01 -0.22 0.50 -1.61 -1.06 0.00 0.00 176.35 173.97 2k39 s GLU 16 N -0.98 4.07 0.23 1.48 8.01 -1.26 -1.41 118.70 128.83 2k39 s GLU 16 Ca -0.11 0.30 0.06 0.00 0.01 0.00 0.00 54.97 55.24 2k39 s GLU 16 Cb -0.07 -3.65 -0.05 0.00 -4.31 0.00 0.00 34.13 26.05 2k39 s GLU 16 CO -0.00 -0.34 -0.08 0.14 0.01 0.00 0.00 175.26 174.98 2k39 s VAL 17 N 2.29 1.54 0.15 2.63 -7.23 -0.19 -4.96 120.40 114.62 2k39 s VAL 17 Ca 0.21 -2.13 0.04 0.00 -1.81 0.00 0.00 61.98 58.29 2k39 s VAL 17 Cb -0.16 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.50 2k39 s VAL 17 CO 0.09 -0.44 -0.10 -1.61 -0.31 0.00 0.00 175.10 172.73 2k39 s GLU 18 N -3.72 1.06 0.20 4.82 8.01 -1.26 0.24 118.70 128.04 2k39 s GLU 18 Ca 0.26 -1.45 -0.12 0.00 0.01 0.00 0.00 54.97 53.67 2k39 s GLU 18 Cb 0.02 -0.62 0.23 0.00 -4.31 0.00 0.00 34.13 29.45 2k39 s GLU 18 CO 0.09 0.07 1.72 -1.35 0.01 0.00 0.00 175.26 175.81 2k39 h PRO 19 N 2.79 0.28 0.00 0.39 0.11 -1.97 -2.99 132.00 130.61 2k39 h PRO 19 Ca -0.37 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2k39 h PRO 19 Cb 1.19 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2k39 h PRO 19 CO 0.63 0.19 0.00 0.43 -0.21 0.00 0.00 178.00 179.04 2k39 n SER 20 N -5.08 0.00 -4.76 -2.05 7.64 -1.26 -2.33 113.62 105.78 2k39 n SER 20 Ca 0.07 -1.48 -0.40 0.00 1.01 0.00 0.00 58.87 58.07 2k39 n SER 20 Cb 0.26 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.41 2k39 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2k39 s ASP 21 N -1.47 7.44 0.26 6.43 1.01 -1.13 -4.91 116.67 124.30 2k39 s ASP 21 Ca 0.20 2.07 -0.18 0.00 0.71 0.00 0.00 52.55 55.35 2k39 s ASP 21 Cb 0.09 -2.61 -0.08 0.00 1.01 0.00 0.00 42.92 41.33 2k39 s ASP 21 CO 0.16 -0.00 0.72 0.42 0.21 0.00 0.00 175.17 176.67 2k39 s THR 22 N -1.23 4.63 0.58 -1.27 -4.23 -1.26 -2.63 115.64 110.23 2k39 s THR 22 Ca 0.44 1.13 0.33 0.00 -1.18 0.00 0.00 61.69 62.41 2k39 s THR 22 Cb -0.27 -3.76 0.37 0.00 1.34 0.00 0.00 72.50 70.18 2k39 s THR 22 CO 0.35 0.06 2.26 0.40 -0.54 0.00 0.00 174.62 177.15 2k39 h ILE 23 N 2.45 0.40 -0.79 2.99 1.08 -1.90 0.32 117.51 122.06 2k39 h ILE 23 Ca -0.48 -0.07 -0.02 0.00 -0.39 0.00 0.00 64.86 63.89 2k39 h ILE 23 Cb 1.19 1.05 -0.04 0.00 -3.07 0.00 0.00 36.82 35.95 2k39 h ILE 23 CO 0.65 0.01 0.41 -0.08 -0.69 0.00 0.00 178.15 178.46 2k39 h GLU 24 N 0.00 1.11 -0.28 2.37 4.57 -1.94 0.48 114.58 120.90 2k39 h GLU 24 Ca -0.00 -0.14 -0.11 0.00 -1.18 0.00 0.00 59.36 57.93 2k39 h GLU 24 Cb 0.05 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.41 2k39 h GLU 24 CO 0.00 0.83 -0.30 -0.97 -1.18 0.00 0.00 179.01 177.40 2k39 h ASN 25 N 1.11 0.58 0.37 1.04 -0.73 -1.32 -1.66 115.58 114.97 2k39 h ASN 25 Ca 0.28 -0.22 -0.32 0.00 1.87 0.00 0.00 56.30 57.91 2k39 h ASN 25 Cb 0.07 -0.16 0.01 0.00 0.27 0.00 0.00 38.32 38.51 2k39 h ASN 25 CO -0.04 0.85 -1.52 0.58 -0.37 0.00 0.00 177.43 176.93 2k39 h VAL 26 N 0.49 1.19 -0.55 2.57 2.07 -1.21 -2.92 116.25 117.90 2k39 h VAL 26 Ca 0.06 -2.75 0.11 0.00 0.82 0.00 0.00 66.70 64.94 2k39 h VAL 26 Cb 0.76 2.87 -0.11 0.00 -1.52 0.00 0.00 31.29 33.29 2k39 h VAL 26 CO 0.06 0.84 -0.15 0.11 0.02 0.00 0.00 177.57 178.45 2k39 h LYS 27 N 0.10 -0.02 0.00 1.57 1.57 0.02 -2.37 116.57 117.44 2k39 h LYS 27 Ca -0.25 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.40 2k39 h LYS 27 Cb 2.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.37 2k39 h LYS 27 CO 0.20 -0.01 -0.60 0.00 -0.57 0.00 0.00 179.45 178.47 2k39 h ALA 28 N 1.51 0.74 -0.38 3.86 0.00 -1.37 -1.39 119.26 122.23 2k39 h ALA 28 Ca 0.26 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 2k39 h ALA 28 Cb 0.42 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2k39 h ALA 28 CO -0.58 0.75 0.14 0.87 0.00 0.00 0.00 179.25 180.43 2k39 h LYS 29 N 0.00 0.57 -0.97 0.00 1.57 -1.25 -2.47 116.57 114.03 2k39 h LYS 29 Ca -0.01 -0.11 0.10 0.00 -1.87 0.00 0.00 60.65 58.76 2k39 h LYS 29 Cb 1.28 -0.09 -0.08 0.00 0.08 0.00 0.00 32.23 33.43 2k39 h LYS 29 CO 0.08 0.56 0.60 0.82 -0.57 0.00 0.00 179.45 180.95 2k39 h ILE 30 N 0.46 0.97 -0.72 1.86 2.04 -1.22 -1.26 117.51 119.63 2k39 h ILE 30 Ca 0.12 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 2k39 h ILE 30 Cb 0.22 -0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.14 2k39 h ILE 30 CO -0.01 0.18 0.40 -0.61 0.00 0.00 0.00 178.15 178.12 2k39 h GLN 31 N 1.01 1.00 -0.23 2.37 4.15 -1.15 -0.23 115.11 122.03 2k39 h GLN 31 Ca 0.46 -0.11 0.07 0.00 0.77 0.00 0.00 58.65 59.83 2k39 h GLN 31 Cb 0.37 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 2k39 h GLN 31 CO -0.23 0.74 0.20 0.22 -1.93 0.00 0.00 178.83 177.82 2k39 h ASP 32 N 0.99 0.00 0.00 -0.69 3.58 -0.76 -2.17 116.42 117.36 2k39 h ASP 32 Ca 0.25 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.56 2k39 h ASP 32 Cb 0.03 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 2k39 h ASP 32 CO -0.04 0.00 -1.22 1.17 -2.88 0.00 0.00 179.24 176.27 2k39 n LYS 33 N -4.14 0.53 -0.00 0.28 3.00 -0.92 -4.84 118.16 112.06 2k39 n LYS 33 Ca 0.03 0.41 0.01 0.00 -0.00 0.00 0.00 58.31 58.75 2k39 n LYS 33 Cb 0.34 -1.60 -0.02 0.00 0.00 0.00 0.00 35.03 33.75 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2k39 n GLU 34 N -4.46 0.55 -0.07 1.64 -0.58 -0.13 -5.04 120.64 112.55 2k39 n GLU 34 Ca -0.24 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.47 2k39 n GLU 34 Cb 0.55 -1.07 0.00 0.00 -0.57 0.00 0.00 31.44 30.35 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 2.40 0.96 3.73 0.62 0.00 -0.82 -5.01 105.19 107.07 2k39 n GLY 35 Ca -0.01 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 4.80 -0.05 -0.61 1.01 -1.26 -4.98 121.20 118.11 2k39 s ILE 36 Ca 0.00 1.79 -0.30 0.00 0.00 0.00 0.00 60.65 62.14 2k39 s ILE 36 Cb 0.00 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.23 2k39 s ILE 36 CO 0.00 0.27 1.52 -2.16 0.00 0.00 0.00 174.94 174.57 2k39 s PRO 37 N 0.45 4.22 0.46 2.79 0.04 -1.26 -3.76 135.00 137.94 2k39 s PRO 37 Ca 0.44 2.05 0.34 0.00 0.04 0.00 0.00 61.00 63.87 2k39 s PRO 37 Cb -0.21 -3.80 1.51 0.00 0.04 0.00 0.00 34.50 32.04 2k39 s PRO 37 CO 0.25 -0.74 1.59 -1.35 0.04 0.00 0.00 177.00 176.79 2k39 h PRO 38 N 8.75 0.03 -0.26 0.56 0.11 -1.92 -2.75 132.00 136.52 2k39 h PRO 38 Ca -0.37 -0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.64 2k39 h PRO 38 Cb 1.17 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2k39 h PRO 38 CO 0.94 0.02 -0.27 0.22 -0.21 0.00 0.00 178.00 178.69 2k39 h ASP 39 N 0.03 0.53 0.09 -2.05 3.58 -1.99 -2.94 116.42 113.67 2k39 h ASP 39 Ca 0.87 -0.19 -0.24 0.00 0.42 0.00 0.00 57.03 57.89 2k39 h ASP 39 Cb 2.88 -0.15 0.02 0.00 1.72 0.00 0.00 39.33 43.81 2k39 h ASP 39 CO -0.39 0.79 -0.97 1.56 -2.88 0.00 0.00 179.24 177.34 2k39 h GLN 40 N 0.46 0.51 -7.04 0.28 1.08 -1.97 -3.48 115.11 104.94 2k39 h GLN 40 Ca 0.06 -0.66 -0.53 0.00 -1.45 0.00 0.00 58.65 56.07 2k39 h GLN 40 Cb 0.72 0.22 0.11 0.00 -0.05 0.00 0.00 27.48 28.47 2k39 h GLN 40 CO 0.05 1.28 0.55 -1.14 -0.95 0.00 0.00 178.83 178.62 2k39 s GLN 41 N -2.95 3.31 0.03 1.46 0.74 -1.04 -0.93 119.66 120.28 2k39 s GLN 41 Ca -0.11 2.02 -0.03 0.00 0.05 0.00 0.00 55.36 57.29 2k39 s GLN 41 Cb 0.04 -2.25 -0.02 0.00 1.10 0.00 0.00 33.01 31.88 2k39 s GLN 41 CO 0.88 -0.99 0.04 0.50 -0.55 0.00 0.00 175.29 175.17 2k39 s ARG 42 N -2.91 0.51 0.16 1.67 3.52 -0.00 -4.80 118.95 117.10 2k39 s ARG 42 Ca 0.70 -0.79 0.05 0.00 -0.13 0.00 0.00 55.73 55.56 2k39 s ARG 42 Cb -0.35 0.19 -0.04 0.00 -1.56 0.00 0.00 34.95 33.19 2k39 s ARG 42 CO 0.41 -0.11 -0.12 -0.51 -0.81 0.00 0.00 175.30 174.17 2k39 s LEU 43 N -2.07 2.53 -0.03 -0.88 1.43 -1.26 -1.76 118.68 116.64 2k39 s LEU 43 Ca -0.06 -1.00 0.04 0.00 -1.03 0.00 0.00 54.13 52.08 2k39 s LEU 43 Cb -0.02 -0.45 -0.00 0.00 0.03 0.00 0.00 46.19 45.75 2k39 s LEU 43 CO -0.04 -0.27 -0.13 -0.63 0.23 0.00 0.00 176.35 175.50 2k39 s ILE 44 N -3.15 1.12 0.01 -0.59 1.01 -0.95 -2.60 121.20 116.05 2k39 s ILE 44 Ca 0.18 -0.56 -0.00 0.00 0.00 0.00 0.00 60.65 60.27 2k39 s ILE 44 Cb 0.01 -0.96 -0.01 0.00 0.01 0.00 0.00 42.46 41.51 2k39 s ILE 44 CO 0.02 0.33 -0.01 0.12 0.00 0.00 0.00 174.94 175.40 2k39 s PHE 45 N 0.02 0.14 -1.41 3.97 5.36 -0.76 -2.42 117.98 122.87 2k39 s PHE 45 Ca -0.01 -0.28 -0.04 0.00 -0.96 0.00 0.00 56.93 55.64 2k39 s PHE 45 Cb -0.09 -0.10 0.02 0.00 -0.34 0.00 0.00 43.02 42.51 2k39 s PHE 45 CO 0.01 -0.11 0.32 0.00 -1.46 0.00 0.00 175.22 173.98 2k39 n ALA 46 N 2.25 -0.89 0.00 11.12 0.00 -1.26 -1.21 120.51 130.52 2k39 n ALA 46 Ca -0.19 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2k39 n ALA 46 Cb 0.57 -2.73 0.00 0.00 0.00 0.00 0.00 19.45 17.29 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 -1.17 3.00 3.81 0.00 0.00 -1.26 -5.02 105.19 104.54 2k39 n GLY 47 Ca -0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 2k39 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k39 s LYS 48 N -0.24 4.26 -0.18 1.61 1.02 -0.35 -4.55 119.74 121.32 2k39 s LYS 48 Ca 0.00 0.83 -0.28 0.00 0.02 0.00 0.00 55.97 56.54 2k39 s LYS 48 Cb 0.00 -3.12 -0.00 0.00 -0.52 0.00 0.00 37.83 34.19 2k39 s LYS 48 CO 0.00 0.55 0.96 -1.14 -0.92 0.00 0.00 175.35 174.79 2k39 s GLN 49 N -1.44 4.31 0.22 1.68 0.74 -1.26 -1.84 119.66 122.08 2k39 s GLN 49 Ca 0.35 1.24 -0.30 0.00 0.05 0.00 0.00 55.36 56.70 2k39 s GLN 49 Cb -0.19 -3.59 -0.08 0.00 1.10 0.00 0.00 33.01 30.24 2k39 s GLN 49 CO 0.21 -0.44 1.09 -0.51 -0.55 0.00 0.00 175.29 175.09 2k39 s LEU 50 N 2.51 4.53 0.44 3.68 1.43 -1.07 -5.00 118.68 125.19 2k39 s LEU 50 Ca 0.43 2.14 -0.04 0.00 -1.03 0.00 0.00 54.13 55.64 2k39 s LEU 50 Cb -0.16 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 2k39 s LEU 50 CO 0.12 -0.16 0.71 -1.61 0.23 0.00 0.00 176.35 175.64 2k39 s GLU 51 N -0.84 3.53 -0.21 1.70 8.01 -1.26 -4.77 118.70 124.85 2k39 s GLU 51 Ca 0.47 0.05 -0.23 0.00 0.01 0.00 0.00 54.97 55.27 2k39 s GLU 51 Cb -0.30 -2.46 -0.02 0.00 -4.31 0.00 0.00 34.13 27.04 2k39 s GLU 51 CO 0.37 -0.09 0.73 -0.51 0.01 0.00 0.00 175.26 175.77 2k39 s ASP 52 N -4.05 6.76 0.00 -0.19 1.11 -1.26 -3.93 116.67 115.12 2k39 s ASP 52 Ca 0.45 0.94 0.00 0.00 0.18 0.00 0.00 52.55 54.12 2k39 s ASP 52 Cb -0.10 -2.39 0.00 0.00 1.07 0.00 0.00 42.92 41.50 2k39 s ASP 52 CO 0.42 -0.38 0.00 0.61 1.18 0.00 0.00 175.17 176.99 2k39 n GLY 53 N 3.78 1.88 3.91 0.21 0.00 -1.26 -5.11 105.19 108.60 2k39 n GLY 53 Ca 0.02 -0.32 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 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 0.00 2.39 0.38 1.61 0.52 -1.25 -5.00 118.95 117.59 2k39 s ARG 54 Ca 0.00 0.07 0.08 0.00 -0.52 0.00 0.00 55.73 55.36 2k39 s ARG 54 Cb 0.00 -2.08 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 2k39 s ARG 54 CO 0.00 -1.22 0.25 0.95 0.02 0.00 0.00 175.30 175.30 2k39 s THR 55 N -3.34 2.83 0.14 0.02 -4.23 -1.26 -3.68 115.64 106.12 2k39 s THR 55 Ca 0.59 -1.53 -0.18 0.00 -1.18 0.00 0.00 61.69 59.40 2k39 s THR 55 Cb -0.11 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.71 2k39 s THR 55 CO 0.48 -0.08 1.72 -0.07 -0.54 0.00 0.00 174.62 176.13 2k39 h LEU 56 N 1.30 -0.06 -0.87 4.79 3.38 -1.48 -1.91 115.31 120.46 2k39 h LEU 56 Ca -0.43 0.06 0.23 0.00 0.09 0.00 0.00 57.88 57.82 2k39 h LEU 56 Cb 1.26 0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.96 2k39 h LEU 56 CO 0.62 0.00 0.28 -1.28 0.09 0.00 0.00 178.44 178.16 2k39 h SER 57 N 0.11 0.10 0.14 -0.43 0.87 -1.74 -0.69 113.55 111.91 2k39 h SER 57 Ca 0.13 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 2k39 h SER 57 Cb 0.16 0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 2k39 h SER 57 CO -0.20 -0.11 0.00 0.44 -0.53 0.00 0.00 176.83 176.43 2k39 h ASP 58 N 0.27 0.00 -0.06 6.23 3.32 -1.66 -2.31 116.42 122.20 2k39 h ASP 58 Ca 0.55 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.60 2k39 h ASP 58 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2k39 h ASP 58 CO -0.61 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 175.69 2k39 n TYR 59 N -2.51 0.08 -1.10 4.55 4.01 -0.30 -5.00 117.16 116.89 2k39 n TYR 59 Ca -0.01 -0.13 -0.03 0.00 -0.16 0.00 0.00 57.90 57.56 2k39 n TYR 59 Cb 0.08 -0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 39.09 2k39 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2k39 n ASN 60 N 0.33 -3.70 -4.70 7.72 3.02 -0.87 -4.94 115.26 112.12 2k39 n ASN 60 Ca 0.05 0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.26 2k39 n ASN 60 Cb 0.22 -1.50 -0.03 0.00 -0.61 0.00 0.00 39.78 37.87 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2k39 s ILE 61 N -2.03 3.30 0.00 2.41 1.01 -1.11 -5.00 121.20 119.78 2k39 s ILE 61 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 60.65 61.51 2k39 s ILE 61 Cb 0.00 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.92 2k39 s ILE 61 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 174.94 174.98 2k39 n GLN 62 N 4.55 2.75 -1.68 2.79 6.02 -1.26 -4.70 117.38 125.85 2k39 n GLN 62 Ca 0.13 0.00 -0.54 0.00 -0.01 0.00 0.00 57.00 56.58 2k39 n GLN 62 Cb 0.42 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.62 2k39 n GLN 62 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2k39 n LYS 63 N 0.00 1.52 -1.29 -1.09 4.81 -1.26 -3.15 118.16 117.71 2k39 n LYS 63 Ca 0.00 0.55 -0.05 0.00 -0.87 0.00 0.00 58.31 57.94 2k39 n LYS 63 Cb 0.00 -2.33 -0.02 0.00 0.02 0.00 0.00 35.03 32.70 2k39 n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k39 n GLU 64 N 6.09 -0.38 -1.66 1.64 1.02 0.40 -4.96 120.64 122.79 2k39 n GLU 64 Ca 0.26 0.63 -0.48 0.00 -0.02 0.00 0.00 57.16 57.55 2k39 n GLU 64 Cb 0.20 -4.36 -0.05 0.00 -0.02 0.00 0.00 31.44 27.21 2k39 n GLU 64 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2k39 n SER 65 N 1.12 2.94 -4.51 1.62 7.64 -1.19 -4.63 113.62 116.62 2k39 n SER 65 Ca -0.05 1.05 -0.42 0.00 1.01 0.00 0.00 58.87 60.46 2k39 n SER 65 Cb 0.23 -1.35 -0.09 0.00 -1.01 0.00 0.00 64.21 61.98 2k39 n SER 65 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2k39 s THR 66 N 2.00 5.15 0.41 0.44 2.01 -1.25 -0.79 115.64 123.60 2k39 s THR 66 Ca 0.85 -0.22 0.05 0.00 0.31 0.00 0.00 61.69 62.69 2k39 s THR 66 Cb -0.75 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 67.84 2k39 s THR 66 CO 0.45 -0.26 0.58 -0.76 -0.69 0.00 0.00 174.62 173.94 2k39 s LEU 67 N 2.02 3.72 -0.16 4.42 1.02 -0.50 -4.88 118.68 124.32 2k39 s LEU 67 Ca 0.11 -0.15 0.00 0.00 0.02 0.00 0.00 54.13 54.11 2k39 s LEU 67 Cb -0.17 -2.81 0.00 0.00 0.02 0.00 0.00 46.19 43.23 2k39 s LEU 67 CO 0.12 -0.69 -0.15 -1.00 0.02 0.00 0.00 176.35 174.66 2k39 s HIS 68 N -2.38 2.79 -0.16 0.29 3.76 -1.02 -0.71 115.29 117.87 2k39 s HIS 68 Ca 0.50 -1.13 -0.12 0.00 -0.15 0.00 0.00 55.06 54.17 2k39 s HIS 68 Cb -0.10 -1.91 -0.05 0.00 1.11 0.00 0.00 32.58 31.63 2k39 s HIS 68 CO 0.34 -0.53 0.23 -1.17 -0.85 0.00 0.00 174.74 172.75 2k39 s LEU 69 N 0.94 4.27 0.23 0.89 2.96 -0.91 -2.25 118.68 124.80 2k39 s LEU 69 Ca -0.03 0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 54.30 2k39 s LEU 69 Cb -0.15 -2.25 -0.03 0.00 0.50 0.00 0.00 46.19 44.26 2k39 s LEU 69 CO -0.02 0.19 0.22 0.68 -1.32 0.00 0.00 176.35 176.09 2k39 s VAL 70 N 0.11 0.00 -0.12 1.68 -7.23 -0.72 -4.66 120.40 109.46 2k39 s VAL 70 Ca 0.14 -1.88 -0.10 0.00 -1.81 0.00 0.00 61.98 58.32 2k39 s VAL 70 Cb -0.12 -2.46 0.03 0.00 0.56 0.00 0.00 36.38 34.39 2k39 s VAL 70 CO 0.03 0.00 0.31 -1.48 -0.31 0.00 0.00 175.10 173.65 2k39 s LEU 71 N -3.16 0.73 0.00 1.32 2.34 -1.26 -0.82 118.68 117.82 2k39 s LEU 71 Ca 0.36 0.63 0.00 0.00 0.06 0.00 0.00 54.13 55.18 2k39 s LEU 71 Cb 0.05 1.06 0.00 0.00 -0.56 0.00 0.00 46.19 46.74 2k39 s LEU 71 CO 0.13 -0.12 0.00 -1.14 -1.06 0.00 0.00 176.35 174.17 2k39 n ARG 72 N 3.09 0.00 -3.67 1.48 0.63 -0.11 -4.89 116.66 113.19 2k39 n ARG 72 Ca -0.14 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.44 2k39 n ARG 72 Cb 0.57 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.43 2k39 n ARG 72 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2k39 s LEU 73 N 0.00 4.36 0.17 6.15 1.43 -1.26 -5.05 118.68 124.48 2k39 s LEU 73 Ca 0.00 0.67 -0.30 0.00 -1.03 0.00 0.00 54.13 53.47 2k39 s LEU 73 Cb 0.00 -2.80 -0.07 0.00 0.03 0.00 0.00 46.19 43.35 2k39 s LEU 73 CO 0.00 0.22 1.07 -0.60 0.23 0.00 0.00 176.35 177.28 2k39 s ARG 74 N -1.80 4.62 0.34 1.70 3.00 -1.26 -5.00 118.95 120.55 2k39 s ARG 74 Ca 0.30 1.67 0.05 0.00 -1.00 0.00 0.00 55.73 56.75 2k39 s ARG 74 Cb -0.14 -3.29 -0.07 0.00 0.00 0.00 0.00 34.95 31.46 2k39 s ARG 74 CO 0.17 0.11 0.03 0.20 0.00 0.00 0.00 175.30 175.82 2k39 s GLY 75 N -0.15 2.13 0.00 8.12 0.00 -1.26 -5.18 107.32 110.98 2k39 s GLY 75 Ca 0.49 -2.09 0.00 0.00 0.00 0.00 0.00 44.72 43.11 2k39 s GLY 75 CO 0.34 -1.88 0.00 0.61 0.00 0.00 0.00 173.10 172.17