#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 2.84 0.15 2.12 0.74 -1.26 -1.29 119.66 122.96 2k39 s GLN 2 Ca 0.00 -1.21 -0.07 0.00 0.05 0.00 0.00 55.36 54.14 2k39 s GLN 2 Cb 0.00 -2.57 -0.02 0.00 1.10 0.00 0.00 33.01 31.52 2k39 s GLN 2 CO 0.00 0.10 0.22 0.96 -0.55 0.00 0.00 175.29 176.02 2k39 s ILE 3 N -2.26 0.08 0.07 -2.34 -4.36 -1.04 -0.07 121.20 111.28 2k39 s ILE 3 Ca 0.41 -1.51 0.08 0.00 -0.26 0.00 0.00 60.65 59.37 2k39 s ILE 3 Cb -0.07 -1.86 -0.04 0.00 1.25 0.00 0.00 42.46 41.75 2k39 s ILE 3 CO 0.28 -0.37 -0.18 -0.36 0.24 0.00 0.00 174.94 174.55 2k39 s PHE 4 N -3.98 2.55 -0.18 1.37 0.08 -0.73 -3.37 117.98 113.73 2k39 s PHE 4 Ca 0.18 -0.26 -0.01 0.00 0.12 0.00 0.00 56.93 56.96 2k39 s PHE 4 Cb 0.04 -1.42 0.05 0.00 -0.57 0.00 0.00 43.02 41.13 2k39 s PHE 4 CO -0.00 0.31 -0.04 0.08 -0.10 0.00 0.00 175.22 175.47 2k39 s VAL 5 N -1.01 1.05 0.17 -0.44 1.01 -0.86 -2.19 120.40 118.13 2k39 s VAL 5 Ca 0.16 -0.69 -0.18 0.00 0.00 0.00 0.00 61.98 61.27 2k39 s VAL 5 Cb -0.11 -1.30 -0.08 0.00 0.00 0.00 0.00 36.38 34.90 2k39 s VAL 5 CO 0.07 0.04 0.64 -0.75 0.00 0.00 0.00 175.10 175.10 2k39 s LYS 6 N 1.64 4.17 0.25 2.72 2.20 0.30 -1.01 119.74 130.01 2k39 s LYS 6 Ca -0.01 0.73 0.11 0.00 -0.36 0.00 0.00 55.97 56.45 2k39 s LYS 6 Cb -0.16 -2.97 -0.05 0.00 -1.51 0.00 0.00 37.83 33.14 2k39 s LYS 6 CO -0.07 0.47 -0.13 0.95 -0.36 0.00 0.00 175.35 176.21 2k39 s THR 7 N -1.42 2.86 0.18 3.43 -4.23 -0.80 0.23 115.64 115.90 2k39 s THR 7 Ca 0.39 -2.12 -0.16 0.00 -1.18 0.00 0.00 61.69 58.61 2k39 s THR 7 Cb -0.17 -2.49 0.13 0.00 1.34 0.00 0.00 72.50 71.31 2k39 s THR 7 CO 0.20 -0.33 1.65 -0.07 -0.54 0.00 0.00 174.62 175.54 2k39 h LEU 8 N 2.32 -0.48 -3.94 4.79 3.38 -1.90 -3.22 115.31 116.26 2k39 h LEU 8 Ca -0.43 0.14 -0.21 0.00 0.09 0.00 0.00 57.88 57.48 2k39 h LEU 8 Cb 1.24 0.31 -0.37 0.00 0.09 0.00 0.00 40.66 41.93 2k39 h LEU 8 CO 0.58 -0.17 -1.03 0.35 0.09 0.00 0.00 178.44 178.26 2k39 n THR 9 N -5.35 0.70 0.00 0.22 -2.24 -1.26 -5.04 114.28 101.31 2k39 n THR 9 Ca 0.04 -1.97 0.00 0.00 -2.27 0.00 0.00 64.05 59.85 2k39 n THR 9 Cb 0.26 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 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 -0.05 3.41 0.00 3.38 0.00 -1.21 -5.20 105.19 105.52 2k39 n GLY 10 Ca 0.09 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2k39 n GLY 10 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2k39 n LYS 11 N 0.00 0.19 -3.11 1.61 2.85 -1.26 -4.90 118.16 113.53 2k39 n LYS 11 Ca 0.00 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.85 2k39 n LYS 11 Cb 0.00 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.32 2k39 n LYS 11 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2k39 s THR 12 N -1.69 4.99 0.30 0.58 -4.23 -1.26 -1.90 115.64 112.42 2k39 s THR 12 Ca 0.00 1.12 -0.26 0.00 -1.18 0.00 0.00 61.69 61.37 2k39 s THR 12 Cb 0.00 -3.93 -0.10 0.00 1.34 0.00 0.00 72.50 69.81 2k39 s THR 12 CO 0.00 0.03 0.92 -0.63 -0.54 0.00 0.00 174.62 174.40 2k39 s ILE 13 N 2.50 4.22 -0.19 2.99 1.01 -0.18 -4.90 121.20 126.64 2k39 s ILE 13 Ca 0.26 1.83 -0.02 0.00 0.00 0.00 0.00 60.65 62.72 2k39 s ILE 13 Cb -0.15 -4.06 -0.00 0.00 0.01 0.00 0.00 42.46 38.25 2k39 s ILE 13 CO 0.08 0.22 -0.11 0.42 0.00 0.00 0.00 174.94 175.56 2k39 s THR 14 N -1.52 2.93 -0.04 2.92 -4.23 -1.26 -2.03 115.64 112.41 2k39 s THR 14 Ca 0.48 -0.66 0.03 0.00 -1.18 0.00 0.00 61.69 60.36 2k39 s THR 14 Cb -0.20 -2.29 0.00 0.00 1.34 0.00 0.00 72.50 71.36 2k39 s THR 14 CO 0.25 0.48 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.92 2k39 s LEU 15 N 1.17 1.81 -0.27 4.79 2.01 -1.22 -5.04 118.68 121.93 2k39 s LEU 15 Ca 0.02 -0.29 -0.09 0.00 0.01 0.00 0.00 54.13 53.78 2k39 s LEU 15 Cb -0.14 -0.80 -0.03 0.00 0.01 0.00 0.00 46.19 45.23 2k39 s LEU 15 CO -0.04 0.10 0.13 -0.70 1.01 0.00 0.00 176.35 176.85 2k39 s GLU 16 N 0.24 3.66 0.06 1.70 2.12 -1.26 -2.51 118.70 122.72 2k39 s GLU 16 Ca -0.06 -0.49 0.05 0.00 0.36 0.00 0.00 54.97 54.82 2k39 s GLU 16 Cb -0.12 -3.48 -0.03 0.00 0.26 0.00 0.00 34.13 30.76 2k39 s GLU 16 CO 0.02 -0.24 -0.13 0.14 -0.54 0.00 0.00 175.26 174.50 2k39 s VAL 17 N 1.66 1.02 0.22 3.70 -7.23 -0.41 -5.00 120.40 114.35 2k39 s VAL 17 Ca 0.06 -1.24 -0.30 0.00 -1.81 0.00 0.00 61.98 58.69 2k39 s VAL 17 Cb -0.16 -0.99 -0.08 0.00 0.56 0.00 0.00 36.38 35.70 2k39 s VAL 17 CO 0.06 -0.23 1.13 -0.70 -0.31 0.00 0.00 175.10 175.06 2k39 s GLU 18 N -1.66 4.58 0.00 4.82 2.56 -1.26 -4.19 118.70 123.54 2k39 s GLU 18 Ca -0.03 1.80 0.04 0.00 0.00 0.00 0.00 54.97 56.78 2k39 s GLU 18 Cb -0.10 -3.23 0.20 0.00 2.00 0.00 0.00 34.13 33.00 2k39 s GLU 18 CO 0.02 0.07 0.94 -0.35 -0.56 0.00 0.00 175.26 175.38 2k39 n PRO 19 N 2.00 0.06 -0.44 4.30 -0.04 -1.26 -1.96 135.00 137.66 2k39 n PRO 19 Ca 0.02 0.24 0.06 0.00 -0.04 0.00 0.00 63.50 63.77 2k39 n PRO 19 Cb 0.45 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.62 2k39 n PRO 19 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2k39 n SER 20 N -1.27 2.84 -4.88 3.54 3.41 -1.26 -4.70 113.62 111.30 2k39 n SER 20 Ca 0.02 -3.32 -0.30 0.00 -0.26 0.00 0.00 58.87 55.00 2k39 n SER 20 Cb 0.03 -0.53 0.01 0.00 -0.26 0.00 0.00 64.21 63.46 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 -2.51 6.08 -0.09 4.04 2.15 -0.83 -4.92 116.67 120.59 2k39 s ASP 21 Ca 0.39 1.27 -0.05 0.00 0.43 0.00 0.00 52.55 54.60 2k39 s ASP 21 Cb 0.34 -2.32 -0.04 0.00 -0.30 0.00 0.00 42.92 40.61 2k39 s ASP 21 CO 0.03 -0.91 0.10 0.42 -0.17 0.00 0.00 175.17 174.64 2k39 s THR 22 N -3.13 5.11 0.24 1.71 -4.23 -1.26 -3.05 115.64 111.02 2k39 s THR 22 Ca 0.54 0.01 -0.07 0.00 -1.18 0.00 0.00 61.69 61.00 2k39 s THR 22 Cb -0.11 -3.23 0.25 0.00 1.34 0.00 0.00 72.50 70.75 2k39 s THR 22 CO 0.52 0.58 1.66 0.40 -0.54 0.00 0.00 174.62 177.23 2k39 h ILE 23 N 3.90 0.43 -0.55 2.99 2.04 -1.69 -2.19 117.51 122.44 2k39 h ILE 23 Ca -0.53 -0.05 -0.09 0.00 1.00 0.00 0.00 64.86 65.19 2k39 h ILE 23 Cb 1.21 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2k39 h ILE 23 CO 0.58 0.03 0.00 -0.08 0.00 0.00 0.00 178.15 178.68 2k39 h GLU 24 N 0.16 0.95 0.00 2.37 4.81 -1.95 -2.22 114.58 118.70 2k39 h GLU 24 Ca 0.40 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2k39 h GLU 24 Cb 0.69 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.97 2k39 h GLU 24 CO -0.58 0.94 0.00 -1.71 -0.73 0.00 0.00 179.01 176.92 2k39 n ASN 25 N -4.19 0.41 -0.07 1.04 5.15 -0.84 -1.75 115.26 115.01 2k39 n ASN 25 Ca 0.03 0.58 -0.04 0.00 -0.60 0.00 0.00 54.58 54.55 2k39 n ASN 25 Cb 0.33 -0.68 -0.16 0.00 -0.53 0.00 0.00 39.78 38.74 2k39 n ASN 25 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2k39 n VAL 26 N -1.94 1.05 -0.27 3.44 0.31 -0.88 -3.28 118.33 116.76 2k39 n VAL 26 Ca 0.04 -0.76 -0.00 0.00 -0.01 0.00 0.00 64.34 63.60 2k39 n VAL 26 Cb 0.25 -0.37 0.12 0.00 -0.91 0.00 0.00 33.84 32.93 2k39 n VAL 26 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2k39 h LYS 27 N 0.00 0.78 -0.81 5.55 1.57 -0.85 -0.61 116.57 122.19 2k39 h LYS 27 Ca -0.39 -0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.41 2k39 h LYS 27 Cb 1.91 -0.18 -0.07 0.00 0.08 0.00 0.00 32.23 33.98 2k39 h LYS 27 CO 0.02 0.52 0.48 0.00 -0.57 0.00 0.00 179.45 179.90 2k39 h ALA 28 N 1.38 1.13 -0.40 3.86 0.00 -1.60 -1.60 119.26 122.04 2k39 h ALA 28 Ca 0.34 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.21 2k39 h ALA 28 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2k39 h ALA 28 CO -0.19 0.16 0.01 0.87 0.00 0.00 0.00 179.25 180.10 2k39 h LYS 29 N 0.84 0.62 0.00 0.00 1.57 -1.32 0.01 116.57 118.29 2k39 h LYS 29 Ca 0.37 -0.14 -0.11 0.00 -1.87 0.00 0.00 60.65 58.90 2k39 h LYS 29 Cb 0.26 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2k39 h LYS 29 CO -0.21 0.64 -0.52 0.82 -0.57 0.00 0.00 179.45 179.61 2k39 h ILE 30 N 0.60 1.18 0.15 1.86 2.04 -0.87 -2.87 117.51 119.60 2k39 h ILE 30 Ca 0.13 -1.91 -0.01 0.00 1.00 0.00 0.00 64.86 64.07 2k39 h ILE 30 Cb 0.36 2.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 2k39 h ILE 30 CO 0.01 0.51 -0.07 -0.61 0.00 0.00 0.00 178.15 177.99 2k39 h GLN 31 N 0.00 -0.20 -0.32 2.37 -0.00 -0.79 -2.85 115.11 113.32 2k39 h GLN 31 Ca -0.01 0.01 0.09 0.00 -0.00 0.00 0.00 58.65 58.75 2k39 h GLN 31 Cb 1.05 0.05 -0.01 0.00 0.00 0.00 0.00 27.48 28.56 2k39 h GLN 31 CO 0.07 0.17 0.23 0.22 0.00 0.00 0.00 178.83 179.51 2k39 h ASP 32 N -0.60 0.02 0.00 -0.69 3.58 -1.04 0.98 116.42 118.67 2k39 h ASP 32 Ca -0.02 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.08 2k39 h ASP 32 Cb 0.46 -0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.44 2k39 h ASP 32 CO 0.03 0.01 -2.33 1.17 -2.88 0.00 0.00 179.24 175.25 2k39 n LYS 33 N -4.45 0.81 0.00 0.28 4.81 -1.09 -4.73 118.16 113.80 2k39 n LYS 33 Ca 0.05 0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 2k39 n LYS 33 Cb 0.39 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.95 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k39 n GLU 34 N -2.86 1.89 0.00 1.64 -0.58 -1.09 -5.08 120.64 114.57 2k39 n GLU 34 Ca -0.35 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.39 2k39 n GLU 34 Cb 1.07 -0.82 0.00 0.00 -0.57 0.00 0.00 31.44 31.11 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 1.74 0.69 3.66 0.62 0.00 0.34 -5.00 105.19 107.24 2k39 n GLY 35 Ca 0.00 0.00 -0.43 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 4.49 0.82 -0.61 1.01 -1.25 -4.92 121.20 118.73 2k39 s ILE 36 Ca 0.00 1.79 -0.11 0.00 0.00 0.00 0.00 60.65 62.33 2k39 s ILE 36 Cb 0.00 -4.16 0.09 0.00 0.01 0.00 0.00 42.46 38.40 2k39 s ILE 36 CO 0.00 -0.14 1.12 -2.16 0.00 0.00 0.00 174.94 173.77 2k39 s PRO 37 N 3.19 1.80 0.45 2.79 0.04 -1.26 -3.37 135.00 138.64 2k39 s PRO 37 Ca 0.50 1.39 0.25 0.00 0.04 0.00 0.00 61.00 63.17 2k39 s PRO 37 Cb -0.19 -1.83 0.51 0.00 0.04 0.00 0.00 34.50 33.04 2k39 s PRO 37 CO 0.11 -2.02 1.67 -1.00 0.04 0.00 0.00 177.00 175.81 2k39 h PRO 38 N -1.26 0.00 0.00 0.56 0.13 -1.95 -3.05 132.00 126.43 2k39 h PRO 38 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2k39 h PRO 38 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2k39 h PRO 38 CO 0.47 0.00 -0.15 -0.40 -0.23 0.00 0.00 178.00 177.70 2k39 n ASP 39 N -3.07 0.42 0.03 1.44 5.75 -1.26 -2.85 116.55 117.00 2k39 n ASP 39 Ca 0.04 0.38 -0.19 0.00 -0.01 0.00 0.00 54.79 55.00 2k39 n ASP 39 Cb 0.49 -0.41 -0.11 0.00 -1.03 0.00 0.00 41.12 40.05 2k39 n ASP 39 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 2k39 h GLN 40 N 0.00 0.49 -6.50 0.11 4.20 -1.80 -3.46 115.11 108.16 2k39 h GLN 40 Ca 0.00 -0.56 -0.57 0.00 0.06 0.00 0.00 58.65 57.58 2k39 h GLN 40 Cb 0.61 0.17 -0.05 0.00 0.30 0.00 0.00 27.48 28.51 2k39 h GLN 40 CO 0.00 1.20 1.07 -0.65 -0.67 0.00 0.00 178.83 179.78 2k39 s GLN 41 N -3.15 3.61 -0.32 1.46 -0.21 -1.13 -1.03 119.66 118.88 2k39 s GLN 41 Ca -0.12 1.00 -0.07 0.00 0.02 0.00 0.00 55.36 56.19 2k39 s GLN 41 Cb 0.04 -4.01 0.03 0.00 1.00 0.00 0.00 33.01 30.06 2k39 s GLN 41 CO 0.86 -1.52 0.10 1.03 -2.12 0.00 0.00 175.29 173.64 2k39 s ARG 42 N 4.87 2.84 -0.24 2.91 0.52 -0.89 -5.00 118.95 123.96 2k39 s ARG 42 Ca 0.61 -1.03 -0.11 0.00 -0.52 0.00 0.00 55.73 54.68 2k39 s ARG 42 Cb -0.14 -3.45 -0.05 0.00 0.52 0.00 0.00 34.95 31.83 2k39 s ARG 42 CO 0.32 -0.57 0.19 -0.51 0.02 0.00 0.00 175.30 174.74 2k39 s LEU 43 N 1.46 4.11 -0.03 2.53 1.43 -1.26 -1.83 118.68 125.09 2k39 s LEU 43 Ca 0.01 0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.29 2k39 s LEU 43 Cb -0.18 -2.15 -0.01 0.00 0.03 0.00 0.00 46.19 43.88 2k39 s LEU 43 CO 0.03 0.03 -0.16 -0.51 0.23 0.00 0.00 176.35 175.97 2k39 s ILE 44 N 1.19 1.30 -0.24 -0.59 -1.16 0.29 -2.33 121.20 119.65 2k39 s ILE 44 Ca 0.09 -0.67 -0.02 0.00 -0.51 0.00 0.00 60.65 59.53 2k39 s ILE 44 Cb -0.14 -1.10 0.13 0.00 0.61 0.00 0.00 42.46 41.95 2k39 s ILE 44 CO 0.06 0.37 0.34 0.12 -2.81 0.00 0.00 174.94 173.02 2k39 s PHE 45 N -0.12 -0.68 -1.11 3.50 5.36 0.09 -0.74 117.98 124.28 2k39 s PHE 45 Ca 0.01 0.55 0.00 0.00 -0.96 0.00 0.00 56.93 56.53 2k39 s PHE 45 Cb -0.09 -0.13 0.00 0.00 -0.34 0.00 0.00 43.02 42.46 2k39 s PHE 45 CO 0.01 -0.74 0.00 0.00 -1.46 0.00 0.00 175.22 173.03 2k39 n ALA 46 N 5.35 -0.22 0.00 11.12 0.00 -1.26 -1.78 120.51 133.71 2k39 n ALA 46 Ca -0.03 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2k39 n ALA 46 Cb 0.50 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.41 2.61 3.66 0.00 0.00 -1.26 -5.04 105.19 103.74 2k39 n GLY 47 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.80 4.25 0.11 1.61 1.02 -0.74 -5.07 119.74 120.13 2k39 s LYS 48 Ca 0.00 1.31 -0.30 0.00 0.02 0.00 0.00 55.97 56.99 2k39 s LYS 48 Cb 0.00 -3.64 -0.07 0.00 -0.52 0.00 0.00 37.83 33.60 2k39 s LYS 48 CO 0.00 -0.62 1.22 -0.65 -0.92 0.00 0.00 175.35 174.39 2k39 s GLN 49 N 3.16 4.44 -0.13 1.68 -1.52 -1.26 -0.73 119.66 125.29 2k39 s GLN 49 Ca 0.43 1.84 -0.02 0.00 -1.95 0.00 0.00 55.36 55.66 2k39 s GLN 49 Cb -0.15 -3.30 -0.03 0.00 -0.22 0.00 0.00 33.01 29.31 2k39 s GLN 49 CO 0.06 -0.23 -0.06 -0.51 -0.25 0.00 0.00 175.29 174.30 2k39 s LEU 50 N 0.66 3.12 -0.21 2.90 1.43 -0.99 -5.00 118.68 120.59 2k39 s LEU 50 Ca 0.58 -0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 53.47 2k39 s LEU 50 Cb -0.31 -1.72 -0.03 0.00 0.03 0.00 0.00 46.19 44.15 2k39 s LEU 50 CO 0.32 0.22 0.06 -0.70 0.23 0.00 0.00 176.35 176.47 2k39 s GLU 51 N 0.04 3.78 0.37 1.70 2.12 -1.26 -4.72 118.70 120.73 2k39 s GLU 51 Ca -0.01 -0.43 -0.28 0.00 0.36 0.00 0.00 54.97 54.61 2k39 s GLU 51 Cb -0.14 -3.24 -0.11 0.00 0.26 0.00 0.00 34.13 30.90 2k39 s GLU 51 CO 0.03 0.04 1.46 0.16 -0.54 0.00 0.00 175.26 176.41 2k39 s ASP 52 N 1.00 6.41 0.00 -1.70 1.47 -1.26 -3.95 116.67 118.64 2k39 s ASP 52 Ca 0.04 3.00 0.00 0.00 1.18 0.00 0.00 52.55 56.76 2k39 s ASP 52 Cb -0.14 -2.66 0.00 0.00 -0.34 0.00 0.00 42.92 39.77 2k39 s ASP 52 CO 0.03 -0.83 0.00 0.61 0.68 0.00 0.00 175.17 175.66 2k39 n GLY 53 N 0.55 3.29 3.36 2.12 0.00 -1.26 -5.03 105.19 108.22 2k39 n GLY 53 Ca 0.01 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 45.03 2k39 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k39 n ARG 54 N 0.00 0.16 -3.61 1.61 1.74 -1.25 -4.86 116.66 110.44 2k39 n ARG 54 Ca 0.00 -2.44 -0.20 0.00 -0.77 0.00 0.00 57.85 54.45 2k39 n ARG 54 Cb 0.00 -0.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.92 2k39 n ARG 54 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2k39 n THR 55 N -2.51 0.00 -0.22 0.55 -2.24 -1.26 -1.86 114.28 106.74 2k39 n THR 55 Ca 0.14 -1.46 -0.08 0.00 -2.27 0.00 0.00 64.05 60.39 2k39 n THR 55 Cb 0.51 0.28 0.03 0.00 -2.10 0.00 0.00 70.33 69.05 2k39 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2k39 h LEU 56 N 0.00 0.89 -0.65 3.22 3.38 -1.84 -3.23 115.31 117.09 2k39 h LEU 56 Ca -0.26 -0.22 -0.15 0.00 0.09 0.00 0.00 57.88 57.35 2k39 h LEU 56 Cb 0.78 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2k39 h LEU 56 CO 0.42 0.87 -0.60 -1.28 0.09 0.00 0.00 178.44 177.94 2k39 h SER 57 N 0.87 0.29 0.77 -0.43 0.87 -1.84 -0.43 113.55 113.64 2k39 h SER 57 Ca 0.19 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2k39 h SER 57 Cb 0.31 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 2k39 h SER 57 CO -0.00 0.82 0.00 0.47 -0.53 0.00 0.00 176.83 177.59 2k39 n ASP 58 N -3.88 0.50 0.00 6.23 8.00 -1.22 -0.80 116.55 125.39 2k39 n ASP 58 Ca -0.02 0.61 0.00 0.00 0.71 0.00 0.00 54.79 56.09 2k39 n ASP 58 Cb 0.62 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 2k39 n ASP 58 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2k39 n TYR 59 N -2.03 0.00 -3.47 1.24 4.01 -1.17 -5.05 117.16 110.68 2k39 n TYR 59 Ca 0.03 -0.03 -0.19 0.00 -0.16 0.00 0.00 57.90 57.55 2k39 n TYR 59 Cb 0.24 -0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.33 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 -0.03 -3.47 -4.54 7.72 5.15 0.02 -4.96 115.26 115.15 2k39 n ASN 60 Ca 0.00 -0.74 -0.42 0.00 -0.60 0.00 0.00 54.58 52.82 2k39 n ASN 60 Cb 0.14 -4.70 -0.07 0.00 -0.53 0.00 0.00 39.78 34.61 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 -3.46 4.91 0.31 -1.44 1.01 -0.35 -4.99 121.20 117.20 2k39 s ILE 61 Ca 0.18 0.26 0.03 0.00 0.00 0.00 0.00 60.65 61.12 2k39 s ILE 61 Cb -0.03 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.29 2k39 s ILE 61 CO 0.77 -0.41 0.09 -1.10 0.00 0.00 0.00 174.94 174.29 2k39 s GLN 62 N 2.62 1.61 -0.32 2.79 -1.52 -1.26 -4.35 119.66 119.23 2k39 s GLN 62 Ca 0.21 -1.90 -0.37 0.00 -1.95 0.00 0.00 55.36 51.35 2k39 s GLN 62 Cb -0.15 -0.59 -0.13 0.00 -0.22 0.00 0.00 33.01 31.92 2k39 s GLN 62 CO 0.16 -0.28 2.03 0.36 -0.25 0.00 0.00 175.29 177.31 2k39 n LYS 63 N -0.64 1.13 -1.82 2.91 2.85 -1.26 -0.82 118.16 120.51 2k39 n LYS 63 Ca -0.02 0.36 -0.13 0.00 -1.05 0.00 0.00 58.31 57.47 2k39 n LYS 63 Cb 0.66 -2.31 -0.03 0.00 -0.65 0.00 0.00 35.03 32.70 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 7.22 -0.95 -1.96 -1.58 1.02 0.90 -4.98 120.64 120.29 2k39 n GLU 64 Ca 0.36 0.78 -0.41 0.00 -0.02 0.00 0.00 57.16 57.87 2k39 n GLU 64 Cb 0.19 -4.90 -0.02 0.00 -0.02 0.00 0.00 31.44 26.68 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 -2.64 6.59 -0.16 1.62 0.01 0.00 -4.83 113.70 114.30 2k39 s SER 65 Ca 0.00 2.73 -0.03 0.00 1.31 0.00 0.00 55.95 59.96 2k39 s SER 65 Cb 0.00 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.58 2k39 s SER 65 CO 0.00 -0.74 -0.05 -0.89 0.41 0.00 0.00 173.24 171.96 2k39 s THR 66 N -0.04 3.64 0.40 1.44 2.01 -1.26 -1.77 115.64 120.05 2k39 s THR 66 Ca 0.60 -0.44 0.08 0.00 0.31 0.00 0.00 61.69 62.24 2k39 s THR 66 Cb -0.43 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 2k39 s THR 66 CO 0.45 0.48 0.27 -0.76 -0.69 0.00 0.00 174.62 174.37 2k39 s LEU 67 N 0.58 3.31 -0.07 4.42 1.02 -0.93 -4.96 118.68 122.05 2k39 s LEU 67 Ca -0.04 -0.83 0.02 0.00 0.02 0.00 0.00 54.13 53.30 2k39 s LEU 67 Cb -0.15 -1.83 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 2k39 s LEU 67 CO 0.03 -0.54 -0.11 -2.28 0.02 0.00 0.00 176.35 173.48 2k39 s HIS 68 N -2.49 2.83 -0.18 0.29 2.46 0.08 -0.54 115.29 117.74 2k39 s HIS 68 Ca 0.44 -0.14 0.00 0.00 0.47 0.00 0.00 55.06 55.82 2k39 s HIS 68 Cb -0.01 -1.70 0.04 0.00 -0.13 0.00 0.00 32.58 30.78 2k39 s HIS 68 CO 0.25 0.19 -0.08 -1.17 -2.47 0.00 0.00 174.74 171.47 2k39 s LEU 69 N -0.59 1.95 -0.05 8.88 2.96 0.14 -0.55 118.68 131.42 2k39 s LEU 69 Ca 0.09 -0.78 -0.01 0.00 -0.22 0.00 0.00 54.13 53.20 2k39 s LEU 69 Cb -0.12 -1.07 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 2k39 s LEU 69 CO 0.02 -0.17 0.03 0.68 -1.32 0.00 0.00 176.35 175.59 2k39 s VAL 70 N 1.52 4.45 0.08 1.68 -7.23 -0.76 -3.38 120.40 116.76 2k39 s VAL 70 Ca -0.00 -0.35 0.01 0.00 -1.81 0.00 0.00 61.98 59.83 2k39 s VAL 70 Cb -0.16 -2.95 -0.04 0.00 0.56 0.00 0.00 36.38 33.80 2k39 s VAL 70 CO -0.08 0.48 0.19 -0.76 -0.31 0.00 0.00 175.10 174.63 2k39 s LEU 71 N -1.28 4.24 -0.48 1.32 1.43 -1.26 -2.08 118.68 120.57 2k39 s LEU 71 Ca 0.17 0.19 -0.12 0.00 -1.03 0.00 0.00 54.13 53.34 2k39 s LEU 71 Cb -0.12 -2.85 0.11 0.00 0.03 0.00 0.00 46.19 43.36 2k39 s LEU 71 CO 0.07 0.15 0.38 -0.60 0.23 0.00 0.00 176.35 176.58 2k39 s ARG 72 N -2.62 2.72 -0.01 1.70 3.52 -0.20 -4.91 118.95 119.17 2k39 s ARG 72 Ca 0.34 -1.61 0.02 0.00 -0.13 0.00 0.00 55.73 54.34 2k39 s ARG 72 Cb -0.12 -4.03 -0.03 0.00 -1.56 0.00 0.00 34.95 29.21 2k39 s ARG 72 CO 0.27 -1.15 0.03 1.28 -0.81 0.00 0.00 175.30 174.92 2k39 n LEU 73 N 5.05 0.00 -0.45 -0.88 4.77 -1.26 -4.64 117.00 119.59 2k39 n LEU 73 Ca -0.11 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.92 2k39 n LEU 73 Cb 0.42 0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.60 2k39 n LEU 73 CO 0.46 0.01 0.50 -1.14 -1.33 0.00 0.00 177.39 175.89 2k39 n ARG 74 N -1.72 1.58 0.00 3.23 0.00 -1.26 -4.95 116.66 113.54 2k39 n ARG 74 Ca -0.01 -1.50 0.00 0.00 -0.00 0.00 0.00 57.85 56.34 2k39 n ARG 74 Cb 0.21 -1.20 0.00 0.00 0.00 0.00 0.00 32.46 31.47 2k39 n ARG 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k39 n GLY 75 N 0.43 2.88 0.00 5.14 0.00 -1.26 -5.34 105.19 107.04 2k39 n GLY 75 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93