#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 0.63 0.02 3.17 -0.21 -1.26 -0.52 119.66 121.49 2k39 s GLN 2 Ca 0.00 -0.83 0.02 0.00 0.02 0.00 0.00 55.36 54.56 2k39 s GLN 2 Cb 0.00 -0.46 -0.01 0.00 1.00 0.00 0.00 33.01 33.53 2k39 s GLN 2 CO 0.00 0.09 -0.06 0.96 -2.12 0.00 0.00 175.29 174.16 2k39 s ILE 3 N -1.39 0.42 -0.22 1.08 -4.36 -0.54 -2.18 121.20 114.00 2k39 s ILE 3 Ca -0.07 -0.60 -0.20 0.00 -0.26 0.00 0.00 60.65 59.52 2k39 s ILE 3 Cb -0.10 -0.43 -0.02 0.00 1.25 0.00 0.00 42.46 43.16 2k39 s ILE 3 CO 0.01 -0.13 0.60 -0.36 0.24 0.00 0.00 174.94 175.30 2k39 s PHE 4 N -0.71 3.34 -0.13 1.37 0.08 -1.11 -0.90 117.98 119.92 2k39 s PHE 4 Ca -0.04 0.84 -0.27 0.00 0.12 0.00 0.00 56.93 57.58 2k39 s PHE 4 Cb -0.06 -2.78 -0.02 0.00 -0.57 0.00 0.00 43.02 39.60 2k39 s PHE 4 CO 0.00 -0.22 0.89 0.08 -0.10 0.00 0.00 175.22 175.87 2k39 s VAL 5 N 2.07 4.86 -0.45 -0.44 1.01 -0.82 -0.85 120.40 125.78 2k39 s VAL 5 Ca 0.26 1.78 -0.12 0.00 0.00 0.00 0.00 61.98 63.91 2k39 s VAL 5 Cb -0.16 -4.20 0.08 0.00 0.00 0.00 0.00 36.38 32.10 2k39 s VAL 5 CO 0.09 0.05 0.32 -0.75 0.00 0.00 0.00 175.10 174.82 2k39 s LYS 6 N 1.91 2.75 0.25 2.72 2.20 0.32 -0.57 119.74 129.31 2k39 s LYS 6 Ca 0.42 -1.44 -0.30 0.00 -0.36 0.00 0.00 55.97 54.30 2k39 s LYS 6 Cb -0.17 -3.94 -0.09 0.00 -1.51 0.00 0.00 37.83 32.12 2k39 s LYS 6 CO 0.16 -1.01 1.17 0.95 -0.36 0.00 0.00 175.35 176.26 2k39 s THR 7 N 1.51 3.40 0.32 3.43 -4.23 -0.56 -0.11 115.64 119.38 2k39 s THR 7 Ca 0.04 1.30 0.08 0.00 -1.18 0.00 0.00 61.69 61.93 2k39 s THR 7 Cb -0.24 -3.83 0.31 0.00 1.34 0.00 0.00 72.50 70.08 2k39 s THR 7 CO 0.04 0.27 1.77 0.25 -0.54 0.00 0.00 174.62 176.40 2k39 h LEU 8 N 4.35 0.72 -1.49 4.79 5.85 -1.64 0.82 115.31 128.72 2k39 h LEU 8 Ca -0.46 0.11 0.44 0.00 0.84 0.00 0.00 57.88 58.80 2k39 h LEU 8 Cb 1.21 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.16 2k39 h LEU 8 CO 0.70 0.21 1.06 1.07 -0.34 0.00 0.00 178.44 181.14 2k39 n THR 9 N -4.78 -0.02 0.00 1.05 5.66 -1.26 -4.81 114.28 110.11 2k39 n THR 9 Ca 0.24 1.19 0.00 0.00 -3.05 0.00 0.00 64.05 62.43 2k39 n THR 9 Cb 0.64 -1.98 0.00 0.00 -1.55 0.00 0.00 70.33 67.44 2k39 n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2k39 n GLY 10 N -1.68 1.95 3.76 1.09 0.00 0.28 -5.10 105.19 105.48 2k39 n GLY 10 Ca 0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.96 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 0.00 4.52 -0.26 1.61 2.20 -1.21 -4.78 119.74 121.82 2k39 s LYS 11 Ca 0.00 1.97 0.01 0.00 -0.36 0.00 0.00 55.97 57.59 2k39 s LYS 11 Cb 0.00 -3.15 0.05 0.00 -1.51 0.00 0.00 37.83 33.22 2k39 s LYS 11 CO 0.00 0.03 -0.09 0.99 -0.36 0.00 0.00 175.35 175.92 2k39 s THR 12 N -1.04 2.44 -0.17 3.43 2.01 -1.26 -1.50 115.64 119.55 2k39 s THR 12 Ca 0.47 -1.41 -0.06 0.00 0.31 0.00 0.00 61.69 61.00 2k39 s THR 12 Cb -0.35 -2.35 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 2k39 s THR 12 CO 0.45 0.05 0.04 -0.63 -0.69 0.00 0.00 174.62 173.85 2k39 s ILE 13 N 1.19 4.63 -0.22 1.82 -1.09 0.26 -4.95 121.20 122.84 2k39 s ILE 13 Ca -0.05 -0.10 -0.16 0.00 -2.23 0.00 0.00 60.65 58.11 2k39 s ILE 13 Cb -0.19 -3.06 -0.04 0.00 -1.58 0.00 0.00 42.46 37.60 2k39 s ILE 13 CO -0.05 0.49 0.42 -0.89 -1.23 0.00 0.00 174.94 173.68 2k39 s THR 14 N 0.18 5.17 -0.13 2.92 2.01 -1.26 -1.95 115.64 122.58 2k39 s THR 14 Ca 0.03 0.74 -0.01 0.00 0.31 0.00 0.00 61.69 62.75 2k39 s THR 14 Cb -0.12 -3.75 -0.02 0.00 0.01 0.00 0.00 72.50 68.61 2k39 s THR 14 CO 0.01 0.21 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.31 2k39 s LEU 15 N 1.61 3.04 0.01 4.42 1.02 -0.08 -4.97 118.68 123.73 2k39 s LEU 15 Ca 0.19 -0.17 -0.27 0.00 0.02 0.00 0.00 54.13 53.90 2k39 s LEU 15 Cb -0.15 -1.70 -0.04 0.00 0.02 0.00 0.00 46.19 44.32 2k39 s LEU 15 CO 0.09 0.21 0.85 -1.61 0.02 0.00 0.00 176.35 175.91 2k39 s GLU 16 N 0.09 4.53 0.15 1.70 8.01 -1.26 -1.47 118.70 130.44 2k39 s GLU 16 Ca -0.03 1.19 0.01 0.00 0.01 0.00 0.00 54.97 56.15 2k39 s GLU 16 Cb -0.14 -3.42 -0.00 0.00 -4.31 0.00 0.00 34.13 26.25 2k39 s GLU 16 CO 0.03 0.09 0.17 1.33 0.01 0.00 0.00 175.26 176.90 2k39 n VAL 17 N 3.46 0.00 -3.90 2.63 0.24 0.32 -4.96 118.33 116.12 2k39 n VAL 17 Ca 0.01 -0.92 -0.11 0.00 -2.04 0.00 0.00 64.34 61.29 2k39 n VAL 17 Cb 0.51 0.50 -0.13 0.00 -1.47 0.00 0.00 33.84 33.25 2k39 n VAL 17 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2k39 s GLU 18 N -2.47 0.12 0.28 7.34 2.56 -1.26 0.46 118.70 125.73 2k39 s GLU 18 Ca 0.15 -0.20 0.25 0.00 0.00 0.00 0.00 54.97 55.17 2k39 s GLU 18 Cb 0.00 0.05 0.93 0.00 2.00 0.00 0.00 34.13 37.11 2k39 s GLU 18 CO 0.11 -0.02 1.75 -1.00 -0.56 0.00 0.00 175.26 175.54 2k39 h PRO 19 N 5.59 0.00 0.00 4.30 0.13 -1.97 -1.77 132.00 138.28 2k39 h PRO 19 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2k39 h PRO 19 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2k39 h PRO 19 CO 0.47 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.11 2k39 n SER 20 N -2.36 0.00 -4.89 1.44 3.41 -1.26 -1.79 113.62 108.17 2k39 n SER 20 Ca 0.03 -0.90 -0.31 0.00 -0.26 0.00 0.00 58.87 57.43 2k39 n SER 20 Cb 0.31 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.22 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 -1.86 6.52 0.77 4.04 1.01 -0.67 -4.89 116.67 121.59 2k39 s ASP 21 Ca 0.30 0.70 -0.11 0.00 0.71 0.00 0.00 52.55 54.15 2k39 s ASP 21 Cb 0.14 -2.13 0.06 0.00 1.01 0.00 0.00 42.92 41.99 2k39 s ASP 21 CO 0.23 -0.02 1.08 0.42 0.21 0.00 0.00 175.17 177.10 2k39 s THR 22 N -1.77 3.39 0.29 -1.27 -4.23 -1.26 -2.35 115.64 108.43 2k39 s THR 22 Ca 0.43 0.45 0.03 0.00 -1.18 0.00 0.00 61.69 61.43 2k39 s THR 22 Cb -0.12 -3.01 0.28 0.00 1.34 0.00 0.00 72.50 70.99 2k39 s THR 22 CO 0.24 -0.59 1.73 0.40 -0.54 0.00 0.00 174.62 175.87 2k39 h ILE 23 N -1.09 0.59 -0.44 2.99 1.08 -1.91 -2.53 117.51 116.21 2k39 h ILE 23 Ca -0.45 -0.19 0.01 0.00 -0.39 0.00 0.00 64.86 63.85 2k39 h ILE 23 Cb 1.24 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.96 2k39 h ILE 23 CO 0.54 0.10 0.27 -0.08 -0.69 0.00 0.00 178.15 178.29 2k39 h GLU 24 N 0.54 0.54 0.00 2.37 4.81 -1.92 -1.74 114.58 119.18 2k39 h GLU 24 Ca 0.54 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.70 2k39 h GLU 24 Cb 0.94 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 2k39 h GLU 24 CO -0.45 0.36 -0.19 -0.91 -0.73 0.00 0.00 179.01 177.08 2k39 h ASN 25 N 0.55 0.00 -0.07 1.04 4.21 -1.88 0.59 115.58 120.02 2k39 h ASN 25 Ca 0.17 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.70 2k39 h ASN 25 Cb -0.02 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.13 2k39 h ASN 25 CO -0.06 0.19 -0.39 0.58 -1.29 0.00 0.00 177.43 176.46 2k39 h VAL 26 N 0.00 0.00 -0.38 2.81 2.07 -1.26 -3.13 116.25 116.37 2k39 h VAL 26 Ca -0.00 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 2k39 h VAL 26 Cb 0.74 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2k39 h VAL 26 CO 0.03 0.00 -0.29 0.11 0.02 0.00 0.00 177.57 177.43 2k39 h LYS 27 N -0.44 0.81 -0.87 1.57 1.57 0.27 -3.23 116.57 116.25 2k39 h LYS 27 Ca 0.02 -0.37 0.06 0.00 -1.87 0.00 0.00 60.65 58.49 2k39 h LYS 27 Cb 0.50 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.74 2k39 h LYS 27 CO -0.30 1.00 0.57 0.00 -0.57 0.00 0.00 179.45 180.14 2k39 h ALA 28 N 0.98 1.52 -1.00 3.86 0.00 -0.16 -1.98 119.26 122.49 2k39 h ALA 28 Ca 0.08 -0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.19 2k39 h ALA 28 Cb 0.84 -0.27 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 2k39 h ALA 28 CO 0.07 0.36 0.63 0.87 0.00 0.00 0.00 179.25 181.18 2k39 h LYS 29 N 1.01 0.52 0.00 0.00 1.57 -1.55 -2.70 116.57 115.42 2k39 h LYS 29 Ca 0.37 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 2k39 h LYS 29 Cb 0.16 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2k39 h LYS 29 CO -0.13 0.34 0.00 -0.89 -0.57 0.00 0.00 179.45 178.21 2k39 n ILE 30 N -4.68 0.90 -0.20 1.86 2.08 -0.74 -2.13 119.36 116.46 2k39 n ILE 30 Ca 0.24 0.24 -0.07 0.00 0.56 0.00 0.00 62.75 63.72 2k39 n ILE 30 Cb 0.73 -1.11 0.02 0.00 -0.75 0.00 0.00 39.64 38.54 2k39 n ILE 30 CO 0.00 0.00 0.00 -0.61 0.56 0.00 0.00 176.55 176.50 2k39 h GLN 31 N 0.00 0.82 0.06 0.38 5.75 -1.34 0.37 115.11 121.15 2k39 h GLN 31 Ca 0.00 -0.12 -0.27 0.00 -0.15 0.00 0.00 58.65 58.11 2k39 h GLN 31 Cb 0.32 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 2k39 h GLN 31 CO 0.00 0.67 -1.35 0.22 -2.65 0.00 0.00 178.83 175.72 2k39 h ASP 32 N 0.77 0.21 0.06 -0.69 3.58 -1.58 -2.72 116.42 116.04 2k39 h ASP 32 Ca 0.19 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.37 2k39 h ASP 32 Cb 0.13 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2k39 h ASP 32 CO -0.02 1.22 -0.03 0.11 -2.88 0.00 0.00 179.24 177.64 2k39 h LYS 33 N 0.04 -0.08 0.00 0.28 1.79 -1.52 -3.44 116.57 113.64 2k39 h LYS 33 Ca -0.16 0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.21 2k39 h LYS 33 Cb 1.93 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 32.58 2k39 h LYS 33 CO 0.14 -0.05 -1.94 0.39 -1.08 0.00 0.00 179.45 176.91 2k39 n GLU 34 N -2.73 0.81 -0.19 3.15 -0.58 0.12 -4.99 120.64 116.23 2k39 n GLU 34 Ca -0.01 -0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 2k39 n GLU 34 Cb 0.03 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 29.48 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 1.66 1.43 3.53 0.62 0.00 -0.72 -5.00 105.19 106.71 2k39 n GLY 35 Ca -0.12 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 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 4.12 0.90 -0.61 -1.09 -1.21 -4.93 121.20 116.38 2k39 s ILE 36 Ca 0.00 -0.27 -0.12 0.00 -2.23 0.00 0.00 60.65 58.03 2k39 s ILE 36 Cb 0.00 -2.83 0.13 0.00 -1.58 0.00 0.00 42.46 38.18 2k39 s ILE 36 CO 0.00 0.48 1.09 -2.16 -1.23 0.00 0.00 174.94 173.12 2k39 s PRO 37 N 0.43 1.24 0.17 2.79 0.04 -1.26 -2.88 135.00 135.52 2k39 s PRO 37 Ca -0.02 0.76 -0.07 0.00 0.04 0.00 0.00 61.00 61.71 2k39 s PRO 37 Cb -0.14 -1.81 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2k39 s PRO 37 CO 0.02 -2.24 1.49 -1.00 0.04 0.00 0.00 177.00 175.31 2k39 h PRO 38 N -1.54 0.73 -0.03 0.56 0.13 -1.94 -3.33 132.00 126.57 2k39 h PRO 38 Ca -0.50 -0.43 0.01 0.00 -0.87 0.00 0.00 66.00 64.21 2k39 h PRO 38 Cb 1.29 0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 2k39 h PRO 38 CO 0.55 1.05 0.16 -0.44 -0.23 0.00 0.00 178.00 179.10 2k39 h ASP 39 N 0.58 0.00 0.21 1.44 5.19 -1.94 -2.27 116.42 119.63 2k39 h ASP 39 Ca 0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 2k39 h ASP 39 Cb 1.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.57 2k39 h ASP 39 CO 0.10 0.00 -0.74 0.00 -3.12 0.00 0.00 179.24 175.48 2k39 n GLN 40 N -3.15 0.10 -3.56 3.56 6.02 -1.25 -4.35 117.38 114.74 2k39 n GLN 40 Ca -0.02 -0.07 -0.37 0.00 -0.01 0.00 0.00 57.00 56.53 2k39 n GLN 40 Cb 0.24 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.93 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2k39 s GLN 41 N -2.95 4.08 -0.31 -1.09 -0.21 -0.86 0.27 119.66 118.58 2k39 s GLN 41 Ca 0.10 0.15 0.03 0.00 0.02 0.00 0.00 55.36 55.66 2k39 s GLN 41 Cb 0.17 -3.35 0.08 0.00 1.00 0.00 0.00 33.01 30.91 2k39 s GLN 41 CO 0.77 0.40 -0.00 0.50 -2.12 0.00 0.00 175.29 174.84 2k39 s ARG 42 N -0.05 1.86 -0.29 2.91 3.52 -0.11 -4.94 118.95 121.86 2k39 s ARG 42 Ca 0.18 -1.64 -0.13 0.00 -0.13 0.00 0.00 55.73 54.02 2k39 s ARG 42 Cb -0.14 -3.12 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2k39 s ARG 42 CO 0.06 -0.79 0.27 -1.17 -0.81 0.00 0.00 175.30 172.86 2k39 s LEU 43 N 1.02 4.15 0.12 -0.88 0.20 -1.26 -2.69 118.68 119.33 2k39 s LEU 43 Ca 0.02 -0.01 0.10 0.00 0.69 0.00 0.00 54.13 54.93 2k39 s LEU 43 Cb -0.20 -2.24 -0.04 0.00 -0.43 0.00 0.00 46.19 43.28 2k39 s LEU 43 CO -0.06 -0.15 -0.21 -0.63 -0.29 0.00 0.00 176.35 175.01 2k39 s ILE 44 N 1.88 2.67 -0.29 6.68 1.01 -1.26 -1.67 121.20 130.23 2k39 s ILE 44 Ca 0.10 -1.57 -0.23 0.00 0.00 0.00 0.00 60.65 58.95 2k39 s ILE 44 Cb -0.16 -2.21 0.14 0.00 0.01 0.00 0.00 42.46 40.24 2k39 s ILE 44 CO 0.11 0.10 1.11 0.12 0.00 0.00 0.00 174.94 176.38 2k39 s PHE 45 N -1.12 -0.39 -1.35 3.97 5.36 -0.52 -4.73 117.98 119.19 2k39 s PHE 45 Ca 0.17 0.91 0.00 0.00 -0.96 0.00 0.00 56.93 57.05 2k39 s PHE 45 Cb -0.10 0.37 0.00 0.00 -0.34 0.00 0.00 43.02 42.95 2k39 s PHE 45 CO 0.09 -0.19 0.00 0.00 -1.46 0.00 0.00 175.22 173.66 2k39 n ALA 46 N 2.40 -0.43 -0.12 11.12 0.00 -1.26 -3.29 120.51 128.93 2k39 n ALA 46 Ca -0.13 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k39 n ALA 46 Cb 0.56 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.02 0.71 3.25 0.00 0.00 -1.26 -5.01 105.19 101.85 2k39 n GLY 47 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.74 1.20 0.23 1.61 1.02 -1.21 -5.15 119.74 116.69 2k39 s LYS 48 Ca 0.00 -1.01 -0.30 0.00 0.02 0.00 0.00 55.97 54.68 2k39 s LYS 48 Cb 0.00 -1.36 -0.09 0.00 -0.52 0.00 0.00 37.83 35.86 2k39 s LYS 48 CO 0.00 0.33 1.35 -1.14 -0.92 0.00 0.00 175.35 174.97 2k39 s GLN 49 N -1.50 4.35 -0.58 1.68 0.74 -1.26 -1.44 119.66 121.64 2k39 s GLN 49 Ca 0.06 2.15 -0.20 0.00 0.05 0.00 0.00 55.36 57.42 2k39 s GLN 49 Cb -0.09 -3.16 0.09 0.00 1.10 0.00 0.00 33.01 30.95 2k39 s GLN 49 CO 0.03 -0.30 0.73 -0.51 -0.55 0.00 0.00 175.29 174.69 2k39 s LEU 50 N -0.32 5.12 0.31 3.68 1.02 -0.67 -4.93 118.68 122.89 2k39 s LEU 50 Ca 0.57 -1.22 0.26 0.00 0.02 0.00 0.00 54.13 53.75 2k39 s LEU 50 Cb -0.38 -2.37 0.78 0.00 0.02 0.00 0.00 46.19 44.24 2k39 s LEU 50 CO 0.41 -1.11 1.75 -0.33 0.02 0.00 0.00 176.35 177.08 2k39 h GLU 51 N 9.20 0.00 0.00 1.70 4.39 -1.96 -3.44 114.58 124.47 2k39 h GLU 51 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 2k39 h GLU 51 Cb 1.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 2k39 h GLU 51 CO 1.08 0.00 0.00 -3.47 -1.16 0.00 0.00 179.01 175.46 2k39 n ASP 52 N -2.56 0.00 0.00 1.42 2.03 -1.26 -5.07 116.55 111.11 2k39 n ASP 52 Ca 0.04 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.35 2k39 n ASP 52 Cb 0.41 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.81 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k39 n GLY 53 N 1.52 0.20 3.13 0.27 0.00 -1.26 -5.13 105.19 103.93 2k39 n GLY 53 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 0.57 0.72 1.61 0.52 -1.26 -5.14 118.95 115.98 2k39 s ARG 54 Ca 0.00 -0.55 -0.09 0.00 -0.52 0.00 0.00 55.73 54.57 2k39 s ARG 54 Cb 0.00 0.24 0.05 0.00 0.52 0.00 0.00 34.95 35.76 2k39 s ARG 54 CO 0.00 -0.15 1.06 0.95 0.02 0.00 0.00 175.30 177.18 2k39 s THR 55 N -2.02 2.56 0.32 0.02 -4.23 -1.26 -4.24 115.64 106.78 2k39 s THR 55 Ca -0.10 -0.04 0.09 0.00 -1.18 0.00 0.00 61.69 60.46 2k39 s THR 55 Cb -0.04 -3.13 0.31 0.00 1.34 0.00 0.00 72.50 70.98 2k39 s THR 55 CO -0.01 -0.16 1.71 -0.07 -0.54 0.00 0.00 174.62 175.55 2k39 h LEU 56 N -0.69 0.55 0.62 4.79 3.38 -1.47 -2.48 115.31 120.01 2k39 h LEU 56 Ca -0.45 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 2k39 h LEU 56 Cb 1.30 0.08 0.01 0.00 0.09 0.00 0.00 40.66 42.14 2k39 h LEU 56 CO 0.63 0.03 -0.30 0.77 0.09 0.00 0.00 178.44 179.66 2k39 h SER 57 N 0.48 -0.70 -0.47 -0.43 4.64 -1.57 0.23 113.55 115.73 2k39 h SER 57 Ca 0.64 0.02 0.07 0.00 -0.47 0.00 0.00 61.79 62.06 2k39 h SER 57 Cb 1.28 0.18 -0.09 0.00 -0.31 0.00 0.00 62.40 63.46 2k39 h SER 57 CO -0.52 -0.50 -0.47 0.44 -0.87 0.00 0.00 176.83 174.91 2k39 h ASP 58 N -0.84 -1.57 1.24 4.97 3.32 -1.74 -2.45 116.42 119.34 2k39 h ASP 58 Ca -0.08 0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2k39 h ASP 58 Cb 0.64 0.68 0.00 0.00 0.22 0.00 0.00 39.33 40.87 2k39 h ASP 58 CO 0.14 -0.37 0.00 1.88 -1.72 0.00 0.00 179.24 179.17 2k39 h TYR 59 N -0.31 0.00 -1.45 4.55 0.05 -1.57 -3.49 116.97 114.75 2k39 h TYR 59 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.91 2k39 h TYR 59 Cb 0.58 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.32 2k39 h TYR 59 CO -0.68 0.00 0.00 -1.71 -1.05 0.00 0.00 178.16 174.72 2k39 n ASN 60 N -2.57 -0.97 -4.26 3.88 2.85 -0.69 -5.08 115.26 108.43 2k39 n ASN 60 Ca 0.03 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.18 2k39 n ASN 60 Cb 0.36 -0.35 -0.16 0.00 1.24 0.00 0.00 39.78 40.87 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2k39 s ILE 61 N -2.48 2.25 0.26 -1.44 1.01 0.74 -5.00 121.20 116.54 2k39 s ILE 61 Ca 0.00 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 59.74 2k39 s ILE 61 Cb 0.00 -1.87 -0.06 0.00 0.01 0.00 0.00 42.46 40.55 2k39 s ILE 61 CO 0.00 0.56 -0.03 -1.10 0.00 0.00 0.00 174.94 174.36 2k39 s GLN 62 N 0.24 1.46 0.58 2.79 -1.52 -1.26 -4.47 119.66 117.48 2k39 s GLN 62 Ca -0.15 -1.74 -0.21 0.00 -1.95 0.00 0.00 55.36 51.32 2k39 s GLN 62 Cb -0.17 -0.92 -0.04 0.00 -0.22 0.00 0.00 33.01 31.67 2k39 s GLN 62 CO 0.07 -0.02 1.34 -1.59 -0.25 0.00 0.00 175.29 174.84 2k39 s LYS 63 N -3.79 2.96 -2.14 2.91 -2.85 -1.26 -2.53 119.74 113.04 2k39 s LYS 63 Ca 0.29 2.17 0.00 0.00 -1.00 0.00 0.00 55.97 57.43 2k39 s LYS 63 Cb 0.05 -2.12 0.00 0.00 -2.06 0.00 0.00 37.83 33.69 2k39 s LYS 63 CO 0.10 -1.31 0.00 -1.91 0.10 0.00 0.00 175.35 172.33 2k39 n GLU 64 N -1.31 -1.48 -2.88 1.78 2.13 -0.93 -5.03 120.64 112.93 2k39 n GLU 64 Ca 0.12 1.21 -0.33 0.00 0.66 0.00 0.00 57.16 58.82 2k39 n GLU 64 Cb 0.46 -5.60 -0.07 0.00 0.27 0.00 0.00 31.44 26.50 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2k39 s SER 65 N -2.74 6.93 -0.11 4.31 0.01 -1.05 -4.85 113.70 116.20 2k39 s SER 65 Ca 0.00 1.62 -0.17 0.00 1.31 0.00 0.00 55.95 58.72 2k39 s SER 65 Cb 0.00 -2.51 -0.05 0.00 0.21 0.00 0.00 66.02 63.67 2k39 s SER 65 CO 0.00 -0.32 0.42 -0.89 0.41 0.00 0.00 173.24 172.87 2k39 s THR 66 N -2.11 5.19 -0.18 1.44 2.01 -1.26 -2.76 115.64 117.96 2k39 s THR 66 Ca 0.60 0.84 -0.08 0.00 0.31 0.00 0.00 61.69 63.36 2k39 s THR 66 Cb -0.10 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 2k39 s THR 66 CO 0.14 0.38 0.06 -0.76 -0.69 0.00 0.00 174.62 173.76 2k39 s LEU 67 N 0.29 3.84 0.04 4.42 1.43 -0.03 -4.99 118.68 123.67 2k39 s LEU 67 Ca 0.23 0.09 -0.18 0.00 -1.03 0.00 0.00 54.13 53.25 2k39 s LEU 67 Cb -0.15 -1.97 -0.06 0.00 0.03 0.00 0.00 46.19 44.04 2k39 s LEU 67 CO 0.09 0.18 0.52 -1.38 0.23 0.00 0.00 176.35 175.99 2k39 s HIS 68 N 0.35 3.77 -0.09 0.29 -3.43 -1.26 -0.52 115.29 114.40 2k39 s HIS 68 Ca 0.03 1.17 0.03 0.00 -0.80 0.00 0.00 55.06 55.50 2k39 s HIS 68 Cb -0.12 -2.44 0.00 0.00 -1.43 0.00 0.00 32.58 28.59 2k39 s HIS 68 CO -0.00 0.58 -0.21 -1.17 -2.00 0.00 0.00 174.74 171.94 2k39 s LEU 69 N -0.99 1.97 -0.05 5.38 2.96 0.84 -4.51 118.68 124.27 2k39 s LEU 69 Ca 0.27 -0.49 -0.12 0.00 -0.22 0.00 0.00 54.13 53.56 2k39 s LEU 69 Cb -0.18 -1.26 -0.05 0.00 0.50 0.00 0.00 46.19 45.20 2k39 s LEU 69 CO 0.17 0.12 0.32 -0.69 -1.32 0.00 0.00 176.35 174.95 2k39 s VAL 70 N 0.47 5.19 0.09 1.68 1.01 -1.09 -1.71 120.40 126.03 2k39 s VAL 70 Ca -0.17 0.64 0.08 0.00 0.00 0.00 0.00 61.98 62.53 2k39 s VAL 70 Cb -0.17 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2k39 s VAL 70 CO 0.07 0.58 -0.15 -0.76 0.00 0.00 0.00 175.10 174.83 2k39 s LEU 71 N -0.96 2.81 0.31 3.92 1.02 -1.26 -0.93 118.68 123.59 2k39 s LEU 71 Ca 0.21 -0.46 0.09 0.00 0.02 0.00 0.00 54.13 53.98 2k39 s LEU 71 Cb -0.15 -1.64 -0.04 0.00 0.02 0.00 0.00 46.19 44.38 2k39 s LEU 71 CO 0.10 0.20 0.09 -0.13 0.02 0.00 0.00 176.35 176.62 2k39 s ARG 72 N -1.99 2.34 -0.28 1.70 0.52 0.14 -4.93 118.95 116.46 2k39 s ARG 72 Ca 0.18 -1.51 0.12 0.00 -0.52 0.00 0.00 55.73 54.01 2k39 s ARG 72 Cb -0.11 -2.16 0.74 0.00 0.52 0.00 0.00 34.95 33.94 2k39 s ARG 72 CO 0.10 0.21 1.73 1.28 0.02 0.00 0.00 175.30 178.64 2k39 n LEU 73 N -1.05 5.63 -3.51 2.53 4.77 -1.26 -4.72 117.00 119.39 2k39 n LEU 73 Ca -0.04 -3.12 -0.13 0.00 -0.03 0.00 0.00 56.01 52.69 2k39 n LEU 73 Cb 0.60 -0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 40.96 2k39 n LEU 73 CO 0.42 0.75 0.57 -0.60 -1.33 0.00 0.00 177.39 177.20 2k39 s ARG 74 N -2.91 0.93 -0.39 3.23 6.06 -1.26 -5.11 118.95 119.50 2k39 s ARG 74 Ca 0.53 -0.03 0.01 0.00 -2.50 0.00 0.00 55.73 53.74 2k39 s ARG 74 Cb 0.42 0.43 0.12 0.00 0.06 0.00 0.00 34.95 35.98 2k39 s ARG 74 CO 0.13 -0.34 0.17 0.20 -2.50 0.00 0.00 175.30 172.96 2k39 s GLY 75 N -1.75 1.55 0.00 8.12 0.00 -1.26 -4.12 107.32 109.86 2k39 s GLY 75 Ca -0.03 -2.33 0.00 0.00 0.00 0.00 0.00 44.72 42.37 2k39 s GLY 75 CO -0.01 1.47 0.51 0.61 0.00 0.00 0.00 173.10 175.69