#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 3.70 0.33 2.12 0.74 -1.26 -1.00 119.66 124.29 2k39 s GLN 2 Ca 0.00 -0.46 0.03 0.00 0.05 0.00 0.00 55.36 54.98 2k39 s GLN 2 Cb 0.00 -3.26 -0.04 0.00 1.10 0.00 0.00 33.01 30.81 2k39 s GLN 2 CO 0.00 -0.08 0.13 0.96 -0.55 0.00 0.00 175.29 175.75 2k39 s ILE 3 N 1.30 0.57 -0.03 -2.34 -4.36 -0.89 0.11 121.20 115.57 2k39 s ILE 3 Ca 0.05 -2.00 -0.16 0.00 -0.26 0.00 0.00 60.65 58.28 2k39 s ILE 3 Cb -0.15 -2.53 0.03 0.00 1.25 0.00 0.00 42.46 41.06 2k39 s ILE 3 CO 0.03 0.00 0.35 0.72 0.24 0.00 0.00 174.94 176.28 2k39 s PHE 4 N -3.47 -0.25 0.12 1.37 -0.12 -1.01 -0.35 117.98 114.28 2k39 s PHE 4 Ca 0.33 0.41 0.08 0.00 -0.05 0.00 0.00 56.93 57.70 2k39 s PHE 4 Cb 0.05 0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 2k39 s PHE 4 CO 0.16 -0.39 -0.14 0.14 -0.05 0.00 0.00 175.22 174.94 2k39 s VAL 5 N -1.17 3.11 -0.21 -2.49 -7.23 -0.30 -0.84 120.40 111.27 2k39 s VAL 5 Ca -0.12 -1.42 -0.05 0.00 -1.81 0.00 0.00 61.98 58.59 2k39 s VAL 5 Cb -0.04 -2.45 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 2k39 s VAL 5 CO 0.04 0.08 -0.01 -0.75 -0.31 0.00 0.00 175.10 174.16 2k39 s LYS 6 N -2.24 3.56 1.11 4.82 2.47 -0.47 -1.98 119.74 127.01 2k39 s LYS 6 Ca 0.20 -0.55 -0.15 0.00 -1.56 0.00 0.00 55.97 53.91 2k39 s LYS 6 Cb -0.11 -3.07 0.24 0.00 -1.46 0.00 0.00 37.83 33.44 2k39 s LYS 6 CO 0.12 -0.04 1.08 0.95 0.16 0.00 0.00 175.35 177.62 2k39 s THR 7 N 1.14 1.83 0.32 3.43 -4.23 -1.08 -1.98 115.64 115.08 2k39 s THR 7 Ca 0.02 0.00 0.21 0.00 -1.18 0.00 0.00 61.69 60.74 2k39 s THR 7 Cb -0.14 -2.43 0.20 0.00 1.34 0.00 0.00 72.50 71.47 2k39 s THR 7 CO 0.01 0.00 1.91 -0.07 -0.54 0.00 0.00 174.62 175.93 2k39 h LEU 8 N -2.30 0.00 -0.49 4.79 -0.00 -1.92 -2.85 115.31 112.54 2k39 h LEU 8 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.36 2k39 h LEU 8 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.98 2k39 h LEU 8 CO 0.48 0.25 -0.19 0.35 -0.00 0.00 0.00 178.44 179.33 2k39 n THR 9 N -3.73 0.00 -0.00 0.22 -2.24 -1.26 -4.96 114.28 102.31 2k39 n THR 9 Ca -0.01 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2k39 n THR 9 Cb 0.36 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 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 1.30 0.29 3.79 3.38 0.00 -1.08 -5.07 105.19 107.81 2k39 n GLY 10 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 2k39 n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k39 s LYS 11 N -1.00 4.46 0.05 1.61 -2.85 -1.26 -4.79 119.74 115.96 2k39 s LYS 11 Ca 0.00 1.06 0.01 0.00 -1.00 0.00 0.00 55.97 56.05 2k39 s LYS 11 Cb 0.00 -3.13 -0.04 0.00 -2.06 0.00 0.00 37.83 32.60 2k39 s LYS 11 CO 0.00 0.51 0.10 0.99 0.10 0.00 0.00 175.35 177.05 2k39 s THR 12 N -1.28 4.75 -0.11 3.79 2.01 -1.26 -2.62 115.64 120.91 2k39 s THR 12 Ca 0.38 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.79 2k39 s THR 12 Cb -0.21 -3.26 0.02 0.00 0.01 0.00 0.00 72.50 69.07 2k39 s THR 12 CO 0.24 0.20 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.64 2k39 s ILE 13 N -1.35 1.14 -0.13 1.82 1.01 -0.84 -4.99 121.20 117.87 2k39 s ILE 13 Ca 0.28 -0.37 -0.17 0.00 0.00 0.00 0.00 60.65 60.39 2k39 s ILE 13 Cb -0.12 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 2k39 s ILE 13 CO 0.21 0.38 0.44 -0.89 0.00 0.00 0.00 174.94 175.08 2k39 s THR 14 N 1.55 5.21 -0.07 2.92 2.01 -1.26 -1.15 115.64 124.86 2k39 s THR 14 Ca 0.03 0.88 0.02 0.00 0.31 0.00 0.00 61.69 62.92 2k39 s THR 14 Cb -0.13 -3.78 -0.03 0.00 0.01 0.00 0.00 72.50 68.57 2k39 s THR 14 CO -0.07 0.33 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.33 2k39 s LEU 15 N 0.64 2.99 -0.19 4.42 2.01 0.53 -4.99 118.68 124.09 2k39 s LEU 15 Ca 0.24 -0.10 -0.14 0.00 0.01 0.00 0.00 54.13 54.14 2k39 s LEU 15 Cb -0.15 -1.64 -0.04 0.00 0.01 0.00 0.00 46.19 44.37 2k39 s LEU 15 CO 0.09 0.35 0.31 -0.70 1.01 0.00 0.00 176.35 177.40 2k39 s GLU 16 N -0.71 4.19 0.12 1.70 2.56 -1.26 -2.09 118.70 123.20 2k39 s GLU 16 Ca 0.11 0.06 0.01 0.00 0.00 0.00 0.00 54.97 55.15 2k39 s GLU 16 Cb -0.11 -3.49 -0.04 0.00 2.00 0.00 0.00 34.13 32.48 2k39 s GLU 16 CO 0.01 0.09 -0.03 0.14 -0.56 0.00 0.00 175.26 174.92 2k39 s VAL 17 N 0.92 0.55 -0.23 3.70 -7.23 -0.17 -4.91 120.40 113.03 2k39 s VAL 17 Ca 0.16 -1.93 -0.06 0.00 -1.81 0.00 0.00 61.98 58.34 2k39 s VAL 17 Cb -0.14 -1.82 -0.02 0.00 0.56 0.00 0.00 36.38 34.96 2k39 s VAL 17 CO 0.05 -0.74 0.03 -0.70 -0.31 0.00 0.00 175.10 173.44 2k39 s GLU 18 N -3.89 3.60 0.00 4.82 2.56 -1.26 0.98 118.70 125.51 2k39 s GLU 18 Ca 0.16 -0.51 0.08 0.00 0.00 0.00 0.00 54.97 54.70 2k39 s GLU 18 Cb 0.06 -3.19 0.45 0.00 2.00 0.00 0.00 34.13 33.45 2k39 s GLU 18 CO -0.02 -0.12 1.02 -0.35 -0.56 0.00 0.00 175.26 175.23 2k39 n PRO 19 N 4.67 0.19 -0.11 4.30 -0.04 -1.26 -2.26 135.00 140.49 2k39 n PRO 19 Ca -0.17 0.10 0.12 0.00 -0.04 0.00 0.00 63.50 63.50 2k39 n PRO 19 Cb 0.51 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.72 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 -1.13 2.81 -4.83 3.54 3.41 -1.26 -1.50 113.62 114.67 2k39 n SER 20 Ca 0.05 -1.90 -0.32 0.00 -0.26 0.00 0.00 58.87 56.45 2k39 n SER 20 Cb 0.04 -0.14 0.01 0.00 -0.26 0.00 0.00 64.21 63.86 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 -1.66 6.00 0.06 4.04 2.15 -0.96 -4.88 116.67 121.42 2k39 s ASP 21 Ca 0.35 1.62 0.00 0.00 0.43 0.00 0.00 52.55 54.95 2k39 s ASP 21 Cb 0.21 -2.50 -0.04 0.00 -0.30 0.00 0.00 42.92 40.28 2k39 s ASP 21 CO 0.30 -1.02 0.20 0.42 -0.17 0.00 0.00 175.17 174.90 2k39 s THR 22 N -2.80 5.31 0.49 1.71 -4.23 -1.26 -3.10 115.64 111.76 2k39 s THR 22 Ca 0.59 -0.42 0.25 0.00 -1.18 0.00 0.00 61.69 60.93 2k39 s THR 22 Cb -0.13 -3.59 0.43 0.00 1.34 0.00 0.00 72.50 70.56 2k39 s THR 22 CO 0.43 0.14 1.89 0.40 -0.54 0.00 0.00 174.62 176.95 2k39 h ILE 23 N 2.14 0.63 0.00 2.99 1.08 -1.90 -1.69 117.51 120.75 2k39 h ILE 23 Ca -0.45 -0.05 -0.04 0.00 -0.39 0.00 0.00 64.86 63.93 2k39 h ILE 23 Cb 1.16 0.46 -0.01 0.00 -3.07 0.00 0.00 36.82 35.37 2k39 h ILE 23 CO 0.75 0.03 -0.18 -0.08 -0.69 0.00 0.00 178.15 177.98 2k39 h GLU 24 N 0.15 0.00 0.00 2.37 4.57 -1.96 -2.10 114.58 117.62 2k39 h GLU 24 Ca 0.42 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.57 2k39 h GLU 24 Cb 1.40 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.99 2k39 h GLU 24 CO -0.07 0.18 -0.29 -0.97 -1.18 0.00 0.00 179.01 176.68 2k39 h ASN 25 N 0.00 0.00 0.11 1.04 -1.24 -1.71 -2.60 115.58 111.18 2k39 h ASN 25 Ca -0.00 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.00 2k39 h ASN 25 Cb 0.40 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.46 2k39 h ASN 25 CO 0.02 0.12 -0.05 0.58 -1.29 0.00 0.00 177.43 176.81 2k39 h VAL 26 N 0.00 1.09 -0.79 2.57 2.07 -1.56 -2.95 116.25 116.68 2k39 h VAL 26 Ca -0.01 -1.15 0.17 0.00 0.82 0.00 0.00 66.70 66.54 2k39 h VAL 26 Cb 1.10 1.77 -0.05 0.00 -1.52 0.00 0.00 31.29 32.59 2k39 h VAL 26 CO 0.02 0.26 0.53 0.11 0.02 0.00 0.00 177.57 178.51 2k39 h LYS 27 N -0.72 0.37 0.00 1.57 1.57 -1.42 -2.43 116.57 115.51 2k39 h LYS 27 Ca -0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2k39 h LYS 27 Cb 0.54 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2k39 h LYS 27 CO 0.02 0.25 -0.26 0.00 -0.57 0.00 0.00 179.45 178.89 2k39 h ALA 28 N 1.64 0.86 0.00 3.86 0.00 -1.49 -3.05 119.26 121.08 2k39 h ALA 28 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2k39 h ALA 28 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2k39 h ALA 28 CO -0.13 0.00 0.00 0.87 0.00 0.00 0.00 179.25 179.99 2k39 h LYS 29 N 0.00 0.00 0.11 0.00 1.57 -1.25 -3.33 116.57 113.67 2k39 h LYS 29 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 2k39 h LYS 29 Cb 0.94 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 2k39 h LYS 29 CO 0.00 0.00 -1.55 0.82 -0.57 0.00 0.00 179.45 178.15 2k39 h ILE 30 N 0.00 1.12 -0.80 1.86 1.08 -1.60 -3.41 117.51 115.76 2k39 h ILE 30 Ca 0.00 -2.78 0.14 0.00 -0.39 0.00 0.00 64.86 61.83 2k39 h ILE 30 Cb 0.43 2.73 -0.09 0.00 -3.07 0.00 0.00 36.82 36.82 2k39 h ILE 30 CO 0.00 0.81 0.37 -0.61 -0.69 0.00 0.00 178.15 178.03 2k39 h GLN 31 N 0.06 0.53 0.00 2.37 5.75 -1.66 0.19 115.11 122.36 2k39 h GLN 31 Ca -0.25 -0.03 -0.11 0.00 -0.15 0.00 0.00 58.65 58.11 2k39 h GLN 31 Cb 2.01 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 30.43 2k39 h GLN 31 CO 0.15 0.35 -0.50 0.22 -2.65 0.00 0.00 178.83 176.40 2k39 h ASP 32 N 0.55 0.00 0.17 -0.69 3.58 -1.83 -3.20 116.42 114.99 2k39 h ASP 32 Ca 0.43 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.87 2k39 h ASP 32 Cb 0.62 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.67 2k39 h ASP 32 CO -0.37 0.50 -0.08 0.11 -2.88 0.00 0.00 179.24 176.53 2k39 h LYS 33 N 0.00 -0.22 -4.43 0.28 1.79 -1.28 -3.47 116.57 109.24 2k39 h LYS 33 Ca -0.01 0.01 -0.37 0.00 -2.18 0.00 0.00 60.65 58.11 2k39 h LYS 33 Cb 0.93 0.05 -0.30 0.00 -1.58 0.00 0.00 32.23 31.33 2k39 h LYS 33 CO 0.07 0.10 -0.77 -1.21 -1.08 0.00 0.00 179.45 176.56 2k39 s GLU 34 N -2.80 0.66 -0.58 3.15 0.41 -0.32 -5.07 118.70 114.14 2k39 s GLU 34 Ca -0.09 -0.23 0.00 0.00 -0.41 0.00 0.00 54.97 54.25 2k39 s GLU 34 Cb 0.00 -0.64 0.45 0.00 -1.78 0.00 0.00 34.13 32.15 2k39 s GLU 34 CO 0.32 0.11 1.80 0.41 -0.49 0.00 0.00 175.26 177.41 2k39 n GLY 35 N 3.16 5.99 3.61 -1.39 0.00 -1.25 -3.19 105.19 112.13 2k39 n GLY 35 Ca -0.16 -2.42 -0.40 0.00 0.00 0.00 0.00 46.02 43.04 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 -4.81 5.05 0.25 -0.61 1.01 -1.26 -5.05 121.20 115.78 2k39 s ILE 36 Ca 0.60 0.89 -0.30 0.00 0.00 0.00 0.00 60.65 61.85 2k39 s ILE 36 Cb 0.48 -3.86 -0.09 0.00 0.01 0.00 0.00 42.46 39.00 2k39 s ILE 36 CO -0.03 0.05 1.09 -2.16 0.00 0.00 0.00 174.94 173.90 2k39 s PRO 37 N 2.36 4.64 0.58 2.79 0.04 -1.26 -4.66 135.00 139.49 2k39 s PRO 37 Ca 0.22 1.76 0.24 0.00 0.04 0.00 0.00 61.00 63.26 2k39 s PRO 37 Cb -0.16 -3.22 1.30 0.00 0.04 0.00 0.00 34.50 32.46 2k39 s PRO 37 CO 0.09 0.20 1.70 -1.35 0.04 0.00 0.00 177.00 177.69 2k39 h PRO 38 N 4.16 0.00 -0.43 0.56 0.11 -1.93 -0.28 132.00 134.20 2k39 h PRO 38 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2k39 h PRO 38 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2k39 h PRO 38 CO 0.68 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.22 2k39 n ASP 39 N -2.66 2.01 0.00 -2.05 9.92 -1.26 -3.71 116.55 118.80 2k39 n ASP 39 Ca -0.02 -2.09 0.00 0.00 -0.53 0.00 0.00 54.79 52.16 2k39 n ASP 39 Cb 0.41 -0.29 0.00 0.00 -0.64 0.00 0.00 41.12 40.59 2k39 n ASP 39 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 2k39 n GLN 40 N 0.41 2.38 -3.31 -1.24 7.27 -0.16 -1.10 117.38 121.63 2k39 n GLN 40 Ca 0.11 0.00 -0.27 0.00 0.07 0.00 0.00 57.00 56.91 2k39 n GLN 40 Cb 0.36 -0.77 -0.02 0.00 2.41 0.00 0.00 30.24 32.21 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 -1.22 3.58 -0.01 3.69 -0.21 -0.93 -0.87 119.66 123.68 2k39 s GLN 41 Ca 0.00 -0.09 -0.07 0.00 0.02 0.00 0.00 55.36 55.22 2k39 s GLN 41 Cb 0.00 -2.64 0.01 0.00 1.00 0.00 0.00 33.01 31.38 2k39 s GLN 41 CO 0.00 0.17 0.15 0.50 -2.12 0.00 0.00 175.29 173.99 2k39 s ARG 42 N -3.86 0.42 -0.06 2.91 3.52 -0.78 -4.62 118.95 116.48 2k39 s ARG 42 Ca 0.43 -0.25 0.05 0.00 -0.13 0.00 0.00 55.73 55.82 2k39 s ARG 42 Cb -0.10 0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.45 2k39 s ARG 42 CO 0.33 -0.10 -0.21 -0.51 -0.81 0.00 0.00 175.30 174.00 2k39 s LEU 43 N -1.05 2.32 0.03 -0.88 1.43 -1.26 -2.37 118.68 116.89 2k39 s LEU 43 Ca -0.11 -0.41 0.08 0.00 -1.03 0.00 0.00 54.13 52.66 2k39 s LEU 43 Cb -0.06 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 2k39 s LEU 43 CO 0.01 0.26 -0.24 -0.63 0.23 0.00 0.00 176.35 175.99 2k39 s ILE 44 N -0.26 1.89 -0.30 -0.59 1.01 -1.09 -1.58 121.20 120.28 2k39 s ILE 44 Ca 0.00 -1.21 0.02 0.00 0.00 0.00 0.00 60.65 59.46 2k39 s ILE 44 Cb -0.13 -1.61 0.07 0.00 0.01 0.00 0.00 42.46 40.80 2k39 s ILE 44 CO 0.03 0.36 -0.01 0.12 0.00 0.00 0.00 174.94 175.44 2k39 s PHE 45 N -0.72 3.43 0.00 3.97 5.36 -1.10 -0.87 117.98 128.04 2k39 s PHE 45 Ca 0.10 -2.40 0.00 0.00 -0.96 0.00 0.00 56.93 53.66 2k39 s PHE 45 Cb -0.09 -2.36 0.00 0.00 -0.34 0.00 0.00 43.02 40.23 2k39 s PHE 45 CO 0.01 -0.89 0.00 0.00 -1.46 0.00 0.00 175.22 172.88 2k39 n ALA 46 N 4.45 0.00 0.00 11.12 0.00 -1.26 -2.62 120.51 132.19 2k39 n ALA 46 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2k39 n ALA 46 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 -2.27 0.70 3.66 0.00 0.00 -1.26 -5.09 105.19 100.94 2k39 n GLY 47 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2k39 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k39 s LYS 48 N -0.82 4.18 -0.00 1.61 2.47 -1.08 -5.08 119.74 121.02 2k39 s LYS 48 Ca 0.00 0.37 -0.30 0.00 -1.56 0.00 0.00 55.97 54.48 2k39 s LYS 48 Cb 0.00 -3.56 -0.04 0.00 -1.46 0.00 0.00 37.83 32.77 2k39 s LYS 48 CO 0.00 -0.14 1.10 -0.65 0.16 0.00 0.00 175.35 175.82 2k39 s GLN 49 N 1.62 4.46 0.06 4.03 -0.21 -1.26 -2.73 119.66 125.63 2k39 s GLN 49 Ca 0.23 1.58 -0.31 0.00 0.02 0.00 0.00 55.36 56.88 2k39 s GLN 49 Cb -0.15 -3.45 -0.07 0.00 1.00 0.00 0.00 33.01 30.33 2k39 s GLN 49 CO 0.09 -0.23 1.48 -0.51 -2.12 0.00 0.00 175.29 174.01 2k39 s LEU 50 N 1.40 4.35 -0.11 2.90 1.43 -0.62 -4.99 118.68 123.04 2k39 s LEU 50 Ca 0.54 2.30 -0.09 0.00 -1.03 0.00 0.00 54.13 55.86 2k39 s LEU 50 Cb -0.24 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.37 2k39 s LEU 50 CO 0.26 -0.76 0.19 -0.70 0.23 0.00 0.00 176.35 175.57 2k39 s GLU 51 N 2.10 3.59 0.44 1.70 2.56 -1.26 -4.71 118.70 123.11 2k39 s GLU 51 Ca 0.67 -0.04 -0.25 0.00 0.00 0.00 0.00 54.97 55.35 2k39 s GLU 51 Cb -0.36 -3.22 -0.08 0.00 2.00 0.00 0.00 34.13 32.47 2k39 s GLU 51 CO 0.29 0.72 1.38 -0.51 -0.56 0.00 0.00 175.26 176.59 2k39 s ASP 52 N -0.91 6.02 0.00 -1.70 1.01 -1.26 -3.11 116.67 116.72 2k39 s ASP 52 Ca 0.16 2.82 0.00 0.00 0.71 0.00 0.00 52.55 56.24 2k39 s ASP 52 Cb -0.13 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.15 2k39 s ASP 52 CO 0.05 -1.07 0.00 0.61 0.21 0.00 0.00 175.17 174.97 2k39 n GLY 53 N 0.61 3.14 3.87 0.21 0.00 -1.26 -5.05 105.19 106.70 2k39 n GLY 53 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.83 3.71 0.50 1.61 1.81 -1.18 -5.01 118.95 119.56 2k39 s ARG 54 Ca 0.00 0.74 -0.01 0.00 -1.72 0.00 0.00 55.73 54.75 2k39 s ARG 54 Cb 0.00 -2.14 0.01 0.00 -0.45 0.00 0.00 34.95 32.36 2k39 s ARG 54 CO 0.00 -0.41 0.74 0.95 -0.68 0.00 0.00 175.30 175.90 2k39 s THR 55 N -2.92 3.59 0.22 0.02 -4.23 -1.26 -3.59 115.64 107.47 2k39 s THR 55 Ca 0.55 -0.46 -0.08 0.00 -1.18 0.00 0.00 61.69 60.53 2k39 s THR 55 Cb -0.11 -3.35 0.18 0.00 1.34 0.00 0.00 72.50 70.57 2k39 s THR 55 CO 0.45 -0.27 1.72 -0.07 -0.54 0.00 0.00 174.62 175.91 2k39 h LEU 56 N 0.21 0.12 -2.00 4.79 3.38 -1.62 -2.78 115.31 117.41 2k39 h LEU 56 Ca -0.45 0.11 0.17 0.00 0.09 0.00 0.00 57.88 57.80 2k39 h LEU 56 Cb 1.26 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 2k39 h LEU 56 CO 0.57 0.05 0.45 -1.28 0.09 0.00 0.00 178.44 178.32 2k39 h SER 57 N 0.34 0.00 1.47 -0.43 0.87 -1.49 -0.83 113.55 113.48 2k39 h SER 57 Ca 0.36 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.85 2k39 h SER 57 Cb 0.53 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.48 2k39 h SER 57 CO -0.40 0.00 -0.33 -0.78 -0.53 0.00 0.00 176.83 174.79 2k39 h ASP 58 N 0.00 0.00 0.09 6.23 1.82 -1.80 -3.13 116.42 119.62 2k39 h ASP 58 Ca 0.27 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.91 2k39 h ASP 58 Cb 1.18 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.19 2k39 h ASP 58 CO -0.00 0.33 -0.81 -1.22 -1.61 0.00 0.00 179.24 175.92 2k39 n TYR 59 N -3.23 0.00 -2.64 0.28 4.01 -1.14 -5.02 117.16 109.42 2k39 n TYR 59 Ca 0.02 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.69 2k39 n TYR 59 Cb 0.62 -0.05 0.03 0.00 -0.31 0.00 0.00 39.34 39.64 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 -1.25 -2.47 -4.54 7.72 5.15 -0.97 -5.02 115.26 113.87 2k39 n ASN 60 Ca 0.05 -0.22 -0.42 0.00 -0.60 0.00 0.00 54.58 53.39 2k39 n ASN 60 Cb 0.35 -2.22 -0.03 0.00 -0.53 0.00 0.00 39.78 37.35 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 -3.13 4.06 0.40 -1.44 1.01 -0.35 -5.00 121.20 116.75 2k39 s ILE 61 Ca 0.06 0.46 -0.02 0.00 0.00 0.00 0.00 60.65 61.15 2k39 s ILE 61 Cb -0.03 -4.73 0.08 0.00 0.01 0.00 0.00 42.46 37.80 2k39 s ILE 61 CO 0.27 -1.44 0.55 0.00 0.00 0.00 0.00 174.94 174.32 2k39 n GLN 62 N 8.37 0.07 -1.68 2.79 1.13 -1.26 -4.49 117.38 122.31 2k39 n GLN 62 Ca 0.04 -1.35 -0.43 0.00 -1.94 0.00 0.00 57.00 53.31 2k39 n GLN 62 Cb 0.48 -0.41 -0.01 0.00 0.11 0.00 0.00 30.24 30.40 2k39 n GLN 62 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 2k39 n LYS 63 N -2.06 2.01 -0.80 -1.09 -0.00 -1.26 -3.81 118.16 111.15 2k39 n LYS 63 Ca 0.09 0.71 0.00 0.00 -0.00 0.00 0.00 58.31 59.10 2k39 n LYS 63 Cb 0.31 -2.28 0.00 0.00 -0.00 0.00 0.00 35.03 33.05 2k39 n LYS 63 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2k39 n GLU 64 N 0.97 0.00 -2.62 -1.58 2.13 0.30 -4.99 120.64 114.85 2k39 n GLU 64 Ca 0.07 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.48 2k39 n GLU 64 Cb 0.34 -2.10 -0.04 0.00 0.27 0.00 0.00 31.44 29.91 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 -2.78 7.36 -0.34 4.31 0.01 -1.25 -4.82 113.70 116.20 2k39 s SER 65 Ca 0.00 1.90 -0.25 0.00 1.31 0.00 0.00 55.95 58.92 2k39 s SER 65 Cb 0.00 -2.59 0.01 0.00 0.21 0.00 0.00 66.02 63.65 2k39 s SER 65 CO 0.00 -0.18 0.86 -0.89 0.41 0.00 0.00 173.24 173.45 2k39 s THR 66 N 0.12 4.68 0.54 1.44 2.01 -1.26 -2.39 115.64 120.78 2k39 s THR 66 Ca 0.49 1.18 0.03 0.00 0.31 0.00 0.00 61.69 63.71 2k39 s THR 66 Cb -0.26 -4.25 0.04 0.00 0.01 0.00 0.00 72.50 68.04 2k39 s THR 66 CO 0.31 -0.41 0.75 -0.76 -0.69 0.00 0.00 174.62 173.83 2k39 s LEU 67 N 3.24 3.32 -0.01 4.42 1.43 -0.02 -4.71 118.68 126.34 2k39 s LEU 67 Ca 0.35 -0.16 0.03 0.00 -1.03 0.00 0.00 54.13 53.32 2k39 s LEU 67 Cb -0.13 -2.69 -0.01 0.00 0.03 0.00 0.00 46.19 43.39 2k39 s LEU 67 CO 0.16 -1.14 -0.12 -2.28 0.23 0.00 0.00 176.35 173.21 2k39 s HIS 68 N -2.71 1.06 -0.26 0.29 2.46 -0.05 -1.37 115.29 114.72 2k39 s HIS 68 Ca 0.58 -0.22 -0.10 0.00 0.47 0.00 0.00 55.06 55.79 2k39 s HIS 68 Cb -0.10 -0.70 -0.04 0.00 -0.13 0.00 0.00 32.58 31.61 2k39 s HIS 68 CO 0.38 -0.04 0.15 -1.17 -2.47 0.00 0.00 174.74 171.59 2k39 s LEU 69 N -0.19 3.85 0.27 8.88 2.96 -0.84 -2.66 118.68 130.95 2k39 s LEU 69 Ca 0.03 -0.05 0.02 0.00 -0.22 0.00 0.00 54.13 53.91 2k39 s LEU 69 Cb -0.05 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 2k39 s LEU 69 CO -0.00 -0.03 0.15 0.68 -1.32 0.00 0.00 176.35 175.84 2k39 s VAL 70 N 1.60 0.22 0.01 1.68 -7.23 -1.00 -4.29 120.40 111.40 2k39 s VAL 70 Ca 0.07 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.29 2k39 s VAL 70 Cb -0.15 -2.53 -0.02 0.00 0.56 0.00 0.00 36.38 34.24 2k39 s VAL 70 CO 0.08 0.00 -0.15 -0.76 -0.31 0.00 0.00 175.10 173.96 2k39 s LEU 71 N -3.30 2.10 -0.30 1.32 1.02 -1.26 -1.86 118.68 116.40 2k39 s LEU 71 Ca 0.38 -0.36 -0.06 0.00 0.02 0.00 0.00 54.13 54.11 2k39 s LEU 71 Cb 0.06 -0.71 0.17 0.00 0.02 0.00 0.00 46.19 45.73 2k39 s LEU 71 CO 0.16 0.12 0.66 -0.60 0.02 0.00 0.00 176.35 176.71 2k39 s ARG 72 N -0.74 0.54 0.02 1.70 3.52 -0.05 -4.86 118.95 119.08 2k39 s ARG 72 Ca 0.04 1.13 -0.36 0.00 -0.13 0.00 0.00 55.73 56.41 2k39 s ARG 72 Cb -0.07 0.65 -0.15 0.00 -1.56 0.00 0.00 34.95 33.83 2k39 s ARG 72 CO 0.00 -0.42 1.58 1.28 -0.81 0.00 0.00 175.30 176.94 2k39 n LEU 73 N 5.42 2.59 -4.74 -0.88 4.77 -1.26 -3.88 117.00 119.02 2k39 n LEU 73 Ca -0.06 1.07 -0.41 0.00 -0.03 0.00 0.00 56.01 56.58 2k39 n LEU 73 Cb 0.50 -1.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.27 2k39 n LEU 73 CO -0.01 -0.51 1.09 -0.60 -1.33 0.00 0.00 177.39 176.04 2k39 s ARG 74 N 1.78 4.29 -0.17 3.23 3.52 -0.26 -4.97 118.95 126.36 2k39 s ARG 74 Ca 0.86 2.25 0.16 0.00 -0.13 0.00 0.00 55.73 58.88 2k39 s ARG 74 Cb -0.83 -3.14 0.40 0.00 -1.56 0.00 0.00 34.95 29.83 2k39 s ARG 74 CO 0.48 -0.41 1.28 0.41 -0.81 0.00 0.00 175.30 176.25 2k39 n GLY 75 N 2.44 4.65 0.00 8.12 0.00 -1.26 -5.06 105.19 114.08 2k39 n GLY 75 Ca 0.08 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93