#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 0.23 3.17 1.11 -1.26 -0.19 119.66 127.04 2k39 s GLN 2 Ca 0.00 0.45 0.11 0.00 0.01 0.00 0.00 55.36 55.93 2k39 s GLN 2 Cb 0.00 -3.45 -0.05 0.00 -1.01 0.00 0.00 33.01 28.50 2k39 s GLN 2 CO 0.00 0.12 -0.20 0.96 0.01 0.00 0.00 175.29 176.18 2k39 s ILE 3 N 0.75 2.54 -0.11 1.08 -4.36 -0.63 0.03 121.20 120.50 2k39 s ILE 3 Ca 0.26 -2.13 -0.14 0.00 -0.26 0.00 0.00 60.65 58.38 2k39 s ILE 3 Cb -0.15 -2.27 -0.05 0.00 1.25 0.00 0.00 42.46 41.24 2k39 s ILE 3 CO 0.10 -0.24 0.33 -0.36 0.24 0.00 0.00 174.94 175.01 2k39 s PHE 4 N -2.02 3.55 -0.15 1.37 0.08 -0.74 -0.67 117.98 119.40 2k39 s PHE 4 Ca 0.25 0.73 0.01 0.00 0.12 0.00 0.00 56.93 58.04 2k39 s PHE 4 Cb -0.07 -2.31 0.00 0.00 -0.57 0.00 0.00 43.02 40.08 2k39 s PHE 4 CO 0.13 0.40 -0.18 0.08 -0.10 0.00 0.00 175.22 175.55 2k39 s VAL 5 N -0.10 2.46 -0.21 -0.44 1.01 0.32 0.05 120.40 123.50 2k39 s VAL 5 Ca 0.19 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 2k39 s VAL 5 Cb -0.14 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2k39 s VAL 5 CO 0.07 0.53 0.09 -0.54 0.00 0.00 0.00 175.10 175.25 2k39 s LYS 6 N 0.79 3.95 0.16 2.72 1.02 0.20 -1.10 119.74 127.48 2k39 s LYS 6 Ca -0.06 -0.34 -0.15 0.00 0.02 0.00 0.00 55.97 55.44 2k39 s LYS 6 Cb -0.15 -3.32 -0.07 0.00 -0.52 0.00 0.00 37.83 33.76 2k39 s LYS 6 CO -0.00 0.14 0.57 0.95 -0.92 0.00 0.00 175.35 176.09 2k39 s THR 7 N 0.75 4.83 0.51 2.17 -4.23 -1.03 0.59 115.64 119.23 2k39 s THR 7 Ca 0.05 0.87 0.21 0.00 -1.18 0.00 0.00 61.69 61.64 2k39 s THR 7 Cb -0.13 -3.74 0.28 0.00 1.34 0.00 0.00 72.50 70.25 2k39 s THR 7 CO 0.02 0.23 2.14 0.25 -0.54 0.00 0.00 174.62 176.72 2k39 h LEU 8 N 3.51 0.00 0.00 4.79 5.85 -1.77 -2.31 115.31 125.39 2k39 h LEU 8 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2k39 h LEU 8 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2k39 h LEU 8 CO 0.66 0.05 0.00 0.35 -0.34 0.00 0.00 178.44 179.16 2k39 n THR 9 N -4.17 0.25 0.00 1.05 -2.24 -1.26 -4.96 114.28 102.95 2k39 n THR 9 Ca -0.03 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2k39 n THR 9 Cb 0.14 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 67.72 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 0.92 2.29 3.78 3.38 0.00 -0.87 -5.11 105.19 109.58 2k39 n GLY 10 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.06 3.46 -0.07 1.61 2.20 -1.26 -4.88 119.74 120.74 2k39 s LYS 11 Ca 0.00 1.60 -0.03 0.00 -0.36 0.00 0.00 55.97 57.18 2k39 s LYS 11 Cb 0.00 -2.06 -0.04 0.00 -1.51 0.00 0.00 37.83 34.22 2k39 s LYS 11 CO 0.00 -0.76 0.06 0.99 -0.36 0.00 0.00 175.35 175.28 2k39 s THR 12 N -1.77 4.77 -0.05 3.43 2.01 -1.26 -2.46 115.64 120.31 2k39 s THR 12 Ca 0.71 -0.18 0.05 0.00 0.31 0.00 0.00 61.69 62.58 2k39 s THR 12 Cb -0.24 -3.08 -0.00 0.00 0.01 0.00 0.00 72.50 69.19 2k39 s THR 12 CO 0.27 0.53 -0.18 0.27 -0.69 0.00 0.00 174.62 174.81 2k39 s ILE 13 N -1.02 1.53 0.21 1.82 -0.00 -0.26 -5.02 121.20 118.46 2k39 s ILE 13 Ca 0.17 -0.77 -0.30 0.00 -0.00 0.00 0.00 60.65 59.75 2k39 s ILE 13 Cb -0.12 -1.31 -0.08 0.00 -0.00 0.00 0.00 42.46 40.95 2k39 s ILE 13 CO 0.06 0.44 1.08 -0.89 -0.00 0.00 0.00 174.94 175.63 2k39 s THR 14 N 0.02 3.78 -0.05 8.37 2.01 -1.26 -0.52 115.64 127.99 2k39 s THR 14 Ca -0.04 1.63 -0.02 0.00 0.31 0.00 0.00 61.69 63.57 2k39 s THR 14 Cb -0.12 -4.04 0.03 0.00 0.01 0.00 0.00 72.50 68.38 2k39 s THR 14 CO 0.02 0.32 0.04 -0.22 -0.69 0.00 0.00 174.62 174.10 2k39 s LEU 15 N -0.77 0.31 0.14 4.42 2.96 0.15 -4.94 118.68 120.95 2k39 s LEU 15 Ca 0.47 0.02 -0.31 0.00 -0.22 0.00 0.00 54.13 54.10 2k39 s LEU 15 Cb -0.30 -0.25 -0.08 0.00 0.50 0.00 0.00 46.19 46.07 2k39 s LEU 15 CO 0.36 -0.23 1.32 -1.61 -1.32 0.00 0.00 176.35 174.87 2k39 s GLU 16 N 2.09 4.38 0.16 1.98 2.02 -1.26 -1.61 118.70 126.45 2k39 s GLU 16 Ca 0.05 2.00 -0.11 0.00 0.02 0.00 0.00 54.97 56.93 2k39 s GLU 16 Cb -0.12 -3.24 -0.00 0.00 0.10 0.00 0.00 34.13 30.86 2k39 s GLU 16 CO -0.04 -0.32 0.31 0.14 0.02 0.00 0.00 175.26 175.38 2k39 s VAL 17 N 0.66 0.07 0.19 2.63 -7.23 0.73 -4.95 120.40 112.50 2k39 s VAL 17 Ca 0.60 -1.24 0.09 0.00 -1.81 0.00 0.00 61.98 59.63 2k39 s VAL 17 Cb -0.35 -1.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 2k39 s VAL 17 CO 0.33 -0.31 -0.19 -1.61 -0.31 0.00 0.00 175.10 173.01 2k39 s GLU 18 N -3.93 1.38 0.37 4.82 0.41 -1.26 -0.36 118.70 120.12 2k39 s GLU 18 Ca 0.14 -1.49 0.15 0.00 -0.41 0.00 0.00 54.97 53.36 2k39 s GLU 18 Cb 0.03 -1.48 1.03 0.00 -1.78 0.00 0.00 34.13 31.93 2k39 s GLU 18 CO -0.02 0.30 1.75 -1.35 -0.49 0.00 0.00 175.26 175.45 2k39 h PRO 19 N 3.06 0.45 0.00 0.39 0.11 -1.93 0.12 132.00 134.19 2k39 h PRO 19 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2k39 h PRO 19 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2k39 h PRO 19 CO 0.52 0.29 -0.09 -1.13 -0.21 0.00 0.00 178.00 177.39 2k39 n SER 20 N -4.72 0.60 -4.75 -2.05 3.41 -1.26 -0.83 113.62 104.01 2k39 n SER 20 Ca 0.26 0.48 -0.33 0.00 -0.26 0.00 0.00 58.87 59.02 2k39 n SER 20 Cb 0.84 -0.58 0.08 0.00 -0.26 0.00 0.00 64.21 64.28 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 -4.07 4.60 -0.02 4.04 -1.08 0.40 -4.88 116.67 115.65 2k39 s ASP 21 Ca 0.11 2.09 0.07 0.00 -0.52 0.00 0.00 52.55 54.30 2k39 s ASP 21 Cb 0.14 -2.56 -0.02 0.00 -1.46 0.00 0.00 42.92 39.03 2k39 s ASP 21 CO 0.60 -1.98 -0.24 0.42 0.52 0.00 0.00 175.17 174.49 2k39 s THR 22 N -2.34 1.87 0.61 1.71 -4.23 -1.26 -2.36 115.64 109.63 2k39 s THR 22 Ca 0.68 -1.01 0.26 0.00 -1.18 0.00 0.00 61.69 60.44 2k39 s THR 22 Cb -0.23 -1.55 0.35 0.00 1.34 0.00 0.00 72.50 72.41 2k39 s THR 22 CO 0.46 0.53 1.57 0.40 -0.54 0.00 0.00 174.62 177.04 2k39 h ILE 23 N 4.57 0.14 0.25 2.99 1.08 -1.28 -1.25 117.51 124.00 2k39 h ILE 23 Ca -0.41 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.05 2k39 h ILE 23 Cb 1.13 0.31 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 2k39 h ILE 23 CO 0.47 0.00 -0.12 -0.33 -0.69 0.00 0.00 178.15 177.48 2k39 h GLU 24 N 0.00 -0.33 -0.64 2.37 4.39 -1.87 -3.35 114.58 115.16 2k39 h GLU 24 Ca 0.29 0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.99 2k39 h GLU 24 Cb 1.94 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 30.64 2k39 h GLU 24 CO -0.00 0.03 0.27 -0.97 -1.16 0.00 0.00 179.01 177.18 2k39 h ASN 25 N -0.78 0.83 -0.79 1.42 -0.73 -1.65 -2.88 115.58 111.01 2k39 h ASN 25 Ca -0.03 -0.10 0.16 0.00 1.87 0.00 0.00 56.30 58.19 2k39 h ASN 25 Cb 0.50 -0.21 -0.10 0.00 0.27 0.00 0.00 38.32 38.78 2k39 h ASN 25 CO 0.06 0.73 0.32 0.58 -0.37 0.00 0.00 177.43 178.75 2k39 h VAL 26 N 0.91 0.62 -0.80 2.57 2.07 -1.66 -1.72 116.25 118.24 2k39 h VAL 26 Ca 0.22 -0.15 0.16 0.00 0.82 0.00 0.00 66.70 67.75 2k39 h VAL 26 Cb 0.15 0.14 -0.10 0.00 -1.52 0.00 0.00 31.29 29.95 2k39 h VAL 26 CO -0.02 0.08 0.34 0.11 0.02 0.00 0.00 177.57 178.10 2k39 h LYS 27 N 0.44 0.45 0.08 1.57 1.57 -1.64 -3.00 116.57 116.05 2k39 h LYS 27 Ca 0.45 -0.03 -0.27 0.00 -1.87 0.00 0.00 60.65 58.93 2k39 h LYS 27 Cb 0.71 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 2k39 h LYS 27 CO -0.43 0.30 -1.32 0.00 -0.57 0.00 0.00 179.45 177.42 2k39 h ALA 28 N 1.59 0.27 -0.56 3.86 0.00 -1.44 -3.26 119.26 119.72 2k39 h ALA 28 Ca 0.45 -1.02 0.13 0.00 0.00 0.00 0.00 54.91 54.48 2k39 h ALA 28 Cb 0.72 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 2k39 h ALA 28 CO -0.43 1.15 0.39 0.87 0.00 0.00 0.00 179.25 181.23 2k39 h LYS 29 N 0.05 0.19 0.00 0.00 1.57 -1.25 0.17 116.57 117.31 2k39 h LYS 29 Ca -0.15 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 2k39 h LYS 29 Cb 1.94 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 34.21 2k39 h LYS 29 CO 0.16 0.13 -0.09 0.82 -0.57 0.00 0.00 179.45 179.90 2k39 h ILE 30 N 0.20 0.17 -0.23 1.86 2.04 -1.57 -3.14 117.51 116.85 2k39 h ILE 30 Ca 0.27 -0.99 -0.12 0.00 1.00 0.00 0.00 64.86 65.02 2k39 h ILE 30 Cb 0.79 1.86 -0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2k39 h ILE 30 CO -0.05 0.09 -0.31 -0.61 0.00 0.00 0.00 178.15 177.26 2k39 h GLN 31 N 0.00 0.61 -0.04 2.37 4.15 -0.67 0.56 115.11 122.08 2k39 h GLN 31 Ca -0.00 -0.36 0.01 0.00 0.77 0.00 0.00 58.65 59.08 2k39 h GLN 31 Cb 0.85 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.57 2k39 h GLN 31 CO 0.01 0.96 0.03 0.22 -1.93 0.00 0.00 178.83 178.13 2k39 h ASP 32 N 0.31 0.00 0.00 -0.69 3.58 -1.48 -2.71 116.42 115.43 2k39 h ASP 32 Ca 0.02 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.36 2k39 h ASP 32 Cb 0.89 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.93 2k39 h ASP 32 CO 0.07 0.00 -1.23 0.29 -2.88 0.00 0.00 179.24 175.49 2k39 n LYS 33 N -4.39 0.53 0.04 0.28 4.01 -1.14 -4.82 118.16 112.68 2k39 n LYS 33 Ca -0.02 0.31 0.06 0.00 -0.51 0.00 0.00 58.31 58.15 2k39 n LYS 33 Cb 0.13 -1.52 -0.07 0.00 -0.51 0.00 0.00 35.03 33.06 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2k39 n GLU 34 N -4.45 0.63 0.00 1.97 -0.58 0.17 -5.00 120.64 113.39 2k39 n GLU 34 Ca -0.22 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 2k39 n GLU 34 Cb 0.55 -1.74 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 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 1.31 2.41 3.68 0.62 0.00 -1.02 -5.00 105.19 107.18 2k39 n GLY 35 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.31 3.84 0.24 -0.61 1.01 -1.26 -4.80 121.20 117.31 2k39 s ILE 36 Ca 0.00 1.14 -0.30 0.00 0.00 0.00 0.00 60.65 61.50 2k39 s ILE 36 Cb 0.00 -3.73 -0.09 0.00 0.01 0.00 0.00 42.46 38.65 2k39 s ILE 36 CO 0.00 -0.04 1.16 -2.16 0.00 0.00 0.00 174.94 173.90 2k39 s PRO 37 N 2.96 4.55 0.32 2.79 0.04 -1.26 -3.42 135.00 140.98 2k39 s PRO 37 Ca 0.63 1.87 0.05 0.00 0.04 0.00 0.00 61.00 63.59 2k39 s PRO 37 Cb -0.29 -3.20 0.85 0.00 0.04 0.00 0.00 34.50 31.89 2k39 s PRO 37 CO 0.24 0.04 1.58 -1.35 0.04 0.00 0.00 177.00 177.56 2k39 h PRO 38 N 4.41 0.02 -0.59 0.56 0.11 -1.93 -1.12 132.00 133.46 2k39 h PRO 38 Ca -0.46 -0.00 0.22 0.00 0.11 0.00 0.00 66.00 65.87 2k39 h PRO 38 Cb 1.21 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.21 2k39 h PRO 38 CO 0.70 0.02 0.24 -3.47 -0.21 0.00 0.00 178.00 175.27 2k39 n ASP 39 N -5.43 0.13 0.02 -2.05 2.03 -1.26 -2.28 116.55 107.71 2k39 n ASP 39 Ca 0.25 0.98 0.11 0.00 0.52 0.00 0.00 54.79 56.66 2k39 n ASP 39 Cb 0.84 -0.45 -0.08 0.00 -0.72 0.00 0.00 41.12 40.71 2k39 n ASP 39 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k39 n GLN 40 N -4.44 0.43 -3.74 -0.67 6.02 -0.42 -4.91 117.38 109.65 2k39 n GLN 40 Ca 0.20 -0.07 -0.37 0.00 -0.01 0.00 0.00 57.00 56.76 2k39 n GLN 40 Cb 0.68 -1.58 -0.06 0.00 1.02 0.00 0.00 30.24 30.30 2k39 n GLN 40 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2k39 s GLN 41 N -3.32 3.61 -0.09 -1.09 -2.07 -0.97 -0.05 119.66 115.69 2k39 s GLN 41 Ca -0.01 0.05 0.02 0.00 -1.82 0.00 0.00 55.36 53.60 2k39 s GLN 41 Cb 0.14 -3.18 0.01 0.00 -1.09 0.00 0.00 33.01 28.89 2k39 s GLN 41 CO 0.85 0.73 -0.16 0.50 -1.32 0.00 0.00 175.29 175.89 2k39 s ARG 42 N -1.18 2.23 -0.09 9.60 3.52 0.38 -4.92 118.95 128.48 2k39 s ARG 42 Ca 0.20 -0.58 -0.04 0.00 -0.13 0.00 0.00 55.73 55.17 2k39 s ARG 42 Cb -0.14 -1.81 -0.04 0.00 -1.56 0.00 0.00 34.95 31.40 2k39 s ARG 42 CO 0.09 0.03 0.09 -0.51 -0.81 0.00 0.00 175.30 174.19 2k39 s LEU 43 N 0.71 4.07 -0.01 -0.88 1.43 -1.26 -0.77 118.68 121.96 2k39 s LEU 43 Ca -0.13 0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 53.27 2k39 s LEU 43 Cb -0.16 -2.03 -0.00 0.00 0.03 0.00 0.00 46.19 44.03 2k39 s LEU 43 CO 0.03 0.38 0.06 0.27 0.23 0.00 0.00 176.35 177.31 2k39 s ILE 44 N -1.01 0.04 -0.10 -0.59 -4.36 -1.12 -3.48 121.20 110.58 2k39 s ILE 44 Ca 0.16 -0.36 -0.05 0.00 -0.26 0.00 0.00 60.65 60.14 2k39 s ILE 44 Cb -0.12 -0.20 0.04 0.00 1.25 0.00 0.00 42.46 43.43 2k39 s ILE 44 CO 0.05 -0.20 0.23 0.12 0.24 0.00 0.00 174.94 175.39 2k39 s PHE 45 N -0.61 -0.31 -0.99 1.37 5.36 -0.98 -2.67 117.98 119.15 2k39 s PHE 45 Ca -0.07 0.74 0.00 0.00 -0.96 0.00 0.00 56.93 56.65 2k39 s PHE 45 Cb -0.04 0.03 0.00 0.00 -0.34 0.00 0.00 43.02 42.67 2k39 s PHE 45 CO 0.00 -0.22 0.00 0.00 -1.46 0.00 0.00 175.22 173.54 2k39 n ALA 46 N 4.19 -0.14 0.00 11.12 0.00 -1.26 -1.19 120.51 133.22 2k39 n ALA 46 Ca -0.25 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2k39 n ALA 46 Cb 0.53 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 -1.37 2.98 3.72 0.00 0.00 -1.26 -5.05 105.19 104.19 2k39 n GLY 47 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.21 4.30 -0.17 1.61 1.02 -0.33 -4.97 119.74 120.99 2k39 s LYS 48 Ca 0.00 2.13 -0.29 0.00 0.02 0.00 0.00 55.97 57.83 2k39 s LYS 48 Cb 0.00 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 2k39 s LYS 48 CO 0.00 -0.47 1.80 -0.65 -0.92 0.00 0.00 175.35 175.10 2k39 s GLN 49 N 1.14 3.74 -0.21 1.68 -0.21 -1.26 -2.33 119.66 122.21 2k39 s GLN 49 Ca 0.66 1.92 -0.24 0.00 0.02 0.00 0.00 55.36 57.72 2k39 s GLN 49 Cb -0.38 -4.12 -0.01 0.00 1.00 0.00 0.00 33.01 29.49 2k39 s GLN 49 CO 0.30 -1.38 0.77 -0.51 -2.12 0.00 0.00 175.29 172.36 2k39 s LEU 50 N 5.63 4.12 0.24 2.90 1.43 -1.23 -5.00 118.68 126.77 2k39 s LEU 50 Ca 0.80 1.02 -0.14 0.00 -1.03 0.00 0.00 54.13 54.78 2k39 s LEU 50 Cb -0.30 -3.12 -0.08 0.00 0.03 0.00 0.00 46.19 42.72 2k39 s LEU 50 CO 0.33 -0.42 0.63 -1.61 0.23 0.00 0.00 176.35 175.51 2k39 s GLU 51 N 2.39 3.96 -0.08 1.70 2.02 -1.26 -4.91 118.70 122.51 2k39 s GLU 51 Ca 0.34 0.52 -0.30 0.00 0.02 0.00 0.00 54.97 55.56 2k39 s GLU 51 Cb -0.16 -2.67 -0.03 0.00 0.10 0.00 0.00 34.13 31.37 2k39 s GLU 51 CO 0.10 0.31 1.24 -0.51 0.02 0.00 0.00 175.26 176.42 2k39 s ASP 52 N -2.10 7.00 0.00 -0.19 1.01 -1.26 -3.18 116.67 117.95 2k39 s ASP 52 Ca 0.47 1.81 0.00 0.00 0.71 0.00 0.00 52.55 55.54 2k39 s ASP 52 Cb -0.12 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.25 2k39 s ASP 52 CO 0.19 -0.65 0.00 0.61 0.21 0.00 0.00 175.17 175.54 2k39 n GLY 53 N 3.46 0.38 3.78 0.21 0.00 -1.26 -4.91 105.19 106.86 2k39 n GLY 53 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.92 4.60 0.50 1.61 1.81 -1.19 -4.78 118.95 120.57 2k39 s ARG 54 Ca 0.00 1.31 -0.19 0.00 -1.72 0.00 0.00 55.73 55.13 2k39 s ARG 54 Cb 0.00 -2.89 -0.08 0.00 -0.45 0.00 0.00 34.95 31.53 2k39 s ARG 54 CO 0.00 0.33 1.01 0.95 -0.68 0.00 0.00 175.30 176.91 2k39 s THR 55 N -1.53 4.08 0.59 0.02 -4.23 -1.26 -0.88 115.64 112.43 2k39 s THR 55 Ca 0.48 1.17 0.30 0.00 -1.18 0.00 0.00 61.69 62.46 2k39 s THR 55 Cb -0.20 -3.52 0.36 0.00 1.34 0.00 0.00 72.50 70.47 2k39 s THR 55 CO 0.25 -0.40 2.24 -0.07 -0.54 0.00 0.00 174.62 176.10 2k39 h LEU 56 N 1.29 0.00 -0.75 4.79 3.38 -1.38 -0.56 115.31 122.08 2k39 h LEU 56 Ca -0.48 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.44 2k39 h LEU 56 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2k39 h LEU 56 CO 0.60 0.00 -0.22 -1.28 0.09 0.00 0.00 178.44 177.63 2k39 h SER 57 N 0.00 0.00 0.89 -0.43 0.87 -1.26 -1.75 113.55 111.87 2k39 h SER 57 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2k39 h SER 57 Cb 0.04 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2k39 h SER 57 CO -0.00 0.22 -0.81 -0.78 -0.53 0.00 0.00 176.83 174.93 2k39 h ASP 58 N 0.00 0.00 0.04 6.23 3.58 -1.38 -3.07 116.42 121.82 2k39 h ASP 58 Ca -0.00 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.30 2k39 h ASP 58 Cb 0.89 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2k39 h ASP 58 CO 0.03 0.07 -0.29 -1.22 -2.88 0.00 0.00 179.24 174.95 2k39 n TYR 59 N -2.33 0.00 -3.23 0.28 4.01 -1.07 -5.00 117.16 109.82 2k39 n TYR 59 Ca 0.02 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.55 2k39 n TYR 59 Cb 0.48 -0.03 0.05 0.00 -0.31 0.00 0.00 39.34 39.54 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 0.11 -5.78 -4.70 7.72 5.15 -0.80 -5.01 115.26 111.94 2k39 n ASN 60 Ca 0.12 -0.38 -0.37 0.00 -0.60 0.00 0.00 54.58 53.34 2k39 n ASN 60 Cb 0.46 -4.49 -0.07 0.00 -0.53 0.00 0.00 39.78 35.14 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 -3.21 5.24 0.53 -1.44 1.01 -0.73 -5.03 121.20 117.58 2k39 s ILE 61 Ca 0.41 0.69 0.08 0.00 0.00 0.00 0.00 60.65 61.84 2k39 s ILE 61 Cb -0.18 -3.71 0.06 0.00 0.01 0.00 0.00 42.46 38.64 2k39 s ILE 61 CO 0.51 0.32 0.73 -1.10 0.00 0.00 0.00 174.94 175.39 2k39 s GLN 62 N 0.86 2.45 0.44 2.79 1.11 -1.26 -4.71 119.66 121.34 2k39 s GLN 62 Ca 0.19 -1.47 -0.25 0.00 0.01 0.00 0.00 55.36 53.85 2k39 s GLN 62 Cb -0.14 -2.67 -0.08 0.00 -1.01 0.00 0.00 33.01 29.12 2k39 s GLN 62 CO 0.07 -0.70 1.30 -1.59 0.01 0.00 0.00 175.29 174.38 2k39 s LYS 63 N -4.59 3.77 -0.68 2.91 0.00 -1.26 -3.57 119.74 116.32 2k39 s LYS 63 Ca 0.60 2.12 0.00 0.00 0.00 0.00 0.00 55.97 58.68 2k39 s LYS 63 Cb -0.07 -2.60 0.00 0.00 0.00 0.00 0.00 37.83 35.16 2k39 s LYS 63 CO 0.37 -0.65 0.00 -0.85 0.00 0.00 0.00 175.35 174.23 2k39 n GLU 64 N -0.21 -1.77 -2.13 1.78 0.28 0.10 -4.98 120.64 113.71 2k39 n GLU 64 Ca 0.06 0.72 -0.38 0.00 -0.16 0.00 0.00 57.16 57.39 2k39 n GLU 64 Cb 0.44 -5.14 -0.00 0.00 1.43 0.00 0.00 31.44 28.18 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2k39 s SER 65 N -2.25 6.15 -0.48 -1.84 0.01 -1.23 -4.57 113.70 109.48 2k39 s SER 65 Ca 0.00 2.49 -0.24 0.00 1.31 0.00 0.00 55.95 59.50 2k39 s SER 65 Cb 0.00 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.64 2k39 s SER 65 CO 0.00 -0.94 0.89 -0.89 0.41 0.00 0.00 173.24 172.71 2k39 s THR 66 N -1.40 4.49 0.37 1.44 2.01 -1.26 -1.79 115.64 119.51 2k39 s THR 66 Ca 0.61 0.53 -0.17 0.00 0.31 0.00 0.00 61.69 62.98 2k39 s THR 66 Cb -0.34 -4.44 -0.09 0.00 0.01 0.00 0.00 72.50 67.64 2k39 s THR 66 CO 0.42 -0.89 0.81 -0.76 -0.69 0.00 0.00 174.62 173.51 2k39 s LEU 67 N 3.69 4.00 -0.03 4.42 1.02 0.11 -4.95 118.68 126.94 2k39 s LEU 67 Ca 0.33 1.40 -0.01 0.00 0.02 0.00 0.00 54.13 55.87 2k39 s LEU 67 Cb -0.11 -4.23 -0.04 0.00 0.02 0.00 0.00 46.19 41.83 2k39 s LEU 67 CO 0.23 -0.28 0.08 -1.00 0.02 0.00 0.00 176.35 175.41 2k39 s HIS 68 N -2.09 3.32 -0.11 0.29 3.76 -1.09 0.59 115.29 119.95 2k39 s HIS 68 Ca 0.57 0.25 -0.00 0.00 -0.15 0.00 0.00 55.06 55.72 2k39 s HIS 68 Cb -0.10 -1.77 0.02 0.00 1.11 0.00 0.00 32.58 31.84 2k39 s HIS 68 CO 0.17 0.57 -0.09 -1.17 -0.85 0.00 0.00 174.74 173.37 2k39 s LEU 69 N -1.55 1.32 -0.17 0.89 0.20 0.20 -2.81 118.68 116.76 2k39 s LEU 69 Ca 0.21 -0.33 -0.08 0.00 0.69 0.00 0.00 54.13 54.61 2k39 s LEU 69 Cb -0.12 -0.90 -0.04 0.00 -0.43 0.00 0.00 46.19 44.70 2k39 s LEU 69 CO 0.11 -0.09 0.11 -0.69 -0.29 0.00 0.00 176.35 175.51 2k39 s VAL 70 N 1.57 5.28 0.40 1.68 1.01 0.05 -2.23 120.40 128.14 2k39 s VAL 70 Ca 0.03 0.13 -0.21 0.00 0.00 0.00 0.00 61.98 61.93 2k39 s VAL 70 Cb -0.13 -3.36 -0.11 0.00 0.00 0.00 0.00 36.38 32.78 2k39 s VAL 70 CO -0.07 0.50 0.93 -0.76 0.00 0.00 0.00 175.10 175.69 2k39 s LEU 71 N -0.10 4.03 0.21 3.92 1.43 -1.26 -0.47 118.68 126.44 2k39 s LEU 71 Ca 0.09 1.67 0.26 0.00 -1.03 0.00 0.00 54.13 55.12 2k39 s LEU 71 Cb -0.12 -4.39 0.68 0.00 0.03 0.00 0.00 46.19 42.40 2k39 s LEU 71 CO 0.00 -0.29 1.68 -0.09 0.23 0.00 0.00 176.35 177.88 2k39 h ARG 72 N 2.19 0.00 -3.85 1.70 2.43 -0.82 -3.47 114.38 112.56 2k39 h ARG 72 Ca -0.48 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.51 2k39 h ARG 72 Cb 1.18 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 30.51 2k39 h ARG 72 CO 0.62 0.00 -0.67 -0.48 -1.51 0.00 0.00 179.97 177.93 2k39 s LEU 73 N -4.63 2.07 0.10 3.80 -0.00 -1.26 -5.06 118.68 113.70 2k39 s LEU 73 Ca 0.09 -0.35 0.00 0.00 -0.00 0.00 0.00 54.13 53.88 2k39 s LEU 73 Cb 0.12 0.18 0.00 0.00 -0.00 0.00 0.00 46.19 46.49 2k39 s LEU 73 CO 0.63 -0.25 0.00 -1.14 -0.00 0.00 0.00 176.35 175.59 2k39 n ARG 74 N 1.88 0.00 0.00 1.48 0.63 -1.26 -5.14 116.66 114.24 2k39 n ARG 74 Ca -0.21 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.72 2k39 n ARG 74 Cb 0.56 -0.18 0.00 0.00 0.45 0.00 0.00 32.46 33.29 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 2.12 3.15 0.00 5.14 0.00 -1.26 -5.24 105.19 109.10 2k39 n GLY 75 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.55 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93