#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 4.69 0.36 3.17 0.74 -1.26 -1.51 119.66 125.84 2k39 s GLN 2 Ca 0.00 1.51 0.04 0.00 0.05 0.00 0.00 55.36 56.95 2k39 s GLN 2 Cb 0.00 -3.35 -0.05 0.00 1.10 0.00 0.00 33.01 30.71 2k39 s GLN 2 CO 0.00 0.21 0.08 0.96 -0.55 0.00 0.00 175.29 175.99 2k39 s ILE 3 N -0.13 1.00 0.17 -2.34 -4.36 0.71 -4.18 121.20 112.06 2k39 s ILE 3 Ca 0.47 -2.00 0.10 0.00 -0.26 0.00 0.00 60.65 58.96 2k39 s ILE 3 Cb -0.25 -2.63 -0.04 0.00 1.25 0.00 0.00 42.46 40.79 2k39 s ILE 3 CO 0.31 0.00 -0.16 -0.36 0.24 0.00 0.00 174.94 174.96 2k39 s PHE 4 N -3.27 2.49 -0.03 1.37 0.40 -0.95 -1.02 117.98 116.98 2k39 s PHE 4 Ca 0.31 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.38 2k39 s PHE 4 Cb 0.07 -1.25 0.01 0.00 0.51 0.00 0.00 43.02 42.36 2k39 s PHE 4 CO 0.15 0.48 -0.07 0.54 0.70 0.00 0.00 175.22 177.02 2k39 s VAL 5 N -1.57 0.66 -0.27 -0.44 0.11 0.11 -0.88 120.40 118.12 2k39 s VAL 5 Ca 0.22 -0.26 -0.22 0.00 -2.93 0.00 0.00 61.98 58.79 2k39 s VAL 5 Cb -0.09 -0.62 -0.01 0.00 -1.53 0.00 0.00 36.38 34.14 2k39 s VAL 5 CO 0.12 0.23 0.71 -0.54 -3.33 0.00 0.00 175.10 172.29 2k39 s LYS 6 N 0.43 4.05 0.92 1.54 1.02 -0.01 -1.41 119.74 126.29 2k39 s LYS 6 Ca -0.06 0.60 -0.11 0.00 0.02 0.00 0.00 55.97 56.42 2k39 s LYS 6 Cb -0.10 -3.68 0.14 0.00 -0.52 0.00 0.00 37.83 33.67 2k39 s LYS 6 CO 0.00 -0.53 1.10 0.95 -0.92 0.00 0.00 175.35 175.96 2k39 s THR 7 N 2.71 2.48 -0.90 2.17 -4.23 -0.59 -3.59 115.64 113.69 2k39 s THR 7 Ca 0.29 0.16 0.27 0.00 -1.18 0.00 0.00 61.69 61.23 2k39 s THR 7 Cb -0.15 -2.39 0.25 0.00 1.34 0.00 0.00 72.50 71.54 2k39 s THR 7 CO 0.10 -0.21 1.85 0.18 -0.54 0.00 0.00 174.62 176.00 2k39 n LEU 8 N -4.10 0.26 0.04 4.79 4.77 -1.26 -1.76 117.00 119.74 2k39 n LEU 8 Ca 0.09 0.53 0.12 0.00 -0.03 0.00 0.00 56.01 56.71 2k39 n LEU 8 Cb 0.53 -0.45 0.08 0.00 -2.33 0.00 0.00 43.42 41.25 2k39 n LEU 8 CO 0.53 -0.09 0.13 0.35 -1.33 0.00 0.00 177.39 176.98 2k39 n THR 9 N -1.75 0.23 0.00 -5.08 -2.24 -1.26 -4.97 114.28 99.21 2k39 n THR 9 Ca 0.06 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2k39 n THR 9 Cb 0.35 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 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 1.36 1.06 3.76 3.38 0.00 -0.72 -5.10 105.19 108.92 2k39 n GLY 10 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.07 4.35 0.54 1.61 2.20 -1.26 -4.78 119.74 122.32 2k39 s LYS 11 Ca 0.00 0.78 -0.22 0.00 -0.36 0.00 0.00 55.97 56.17 2k39 s LYS 11 Cb 0.00 -3.36 -0.05 0.00 -1.51 0.00 0.00 37.83 32.91 2k39 s LYS 11 CO 0.00 0.33 1.30 0.99 -0.36 0.00 0.00 175.35 177.61 2k39 s THR 12 N -0.07 2.35 -0.07 3.43 2.01 -1.26 -1.54 115.64 120.49 2k39 s THR 12 Ca 0.32 0.26 0.03 0.00 0.31 0.00 0.00 61.69 62.61 2k39 s THR 12 Cb -0.18 -3.13 0.01 0.00 0.01 0.00 0.00 72.50 69.21 2k39 s THR 12 CO 0.18 -0.01 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.30 2k39 s ILE 13 N -1.39 1.44 -0.03 1.82 1.01 -0.50 -4.93 121.20 118.64 2k39 s ILE 13 Ca 0.71 -0.67 -0.26 0.00 0.00 0.00 0.00 60.65 60.43 2k39 s ILE 13 Cb -0.37 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 2k39 s ILE 13 CO 0.43 0.42 0.82 -0.89 0.00 0.00 0.00 174.94 175.72 2k39 s THR 14 N 0.48 4.93 0.01 2.92 2.01 -1.26 -0.71 115.64 124.02 2k39 s THR 14 Ca -0.14 1.71 0.02 0.00 0.31 0.00 0.00 61.69 63.59 2k39 s THR 14 Cb -0.16 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.18 2k39 s THR 14 CO 0.05 0.23 -0.06 -0.22 -0.69 0.00 0.00 174.62 173.93 2k39 s LEU 15 N 0.77 2.07 -0.16 4.42 2.96 -0.19 -4.97 118.68 123.58 2k39 s LEU 15 Ca 0.43 -0.21 -0.16 0.00 -0.22 0.00 0.00 54.13 53.98 2k39 s LEU 15 Cb -0.19 -0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.19 2k39 s LEU 15 CO 0.23 0.01 0.38 -0.70 -1.32 0.00 0.00 176.35 174.95 2k39 s GLU 16 N -0.47 4.25 0.01 1.98 2.56 -1.26 -0.21 118.70 125.56 2k39 s GLU 16 Ca -0.01 0.23 0.00 0.00 0.00 0.00 0.00 54.97 55.20 2k39 s GLU 16 Cb -0.04 -3.47 -0.01 0.00 2.00 0.00 0.00 34.13 32.61 2k39 s GLU 16 CO -0.00 0.11 -0.02 0.14 -0.56 0.00 0.00 175.26 174.93 2k39 s VAL 17 N 0.83 0.10 0.44 3.70 -7.23 -0.57 -4.95 120.40 112.72 2k39 s VAL 17 Ca 0.20 -0.41 -0.22 0.00 -1.81 0.00 0.00 61.98 59.75 2k39 s VAL 17 Cb -0.14 -0.16 -0.09 0.00 0.56 0.00 0.00 36.38 36.55 2k39 s VAL 17 CO 0.07 -0.20 1.01 -1.61 -0.31 0.00 0.00 175.10 174.07 2k39 s GLU 18 N -0.63 4.04 0.17 4.82 8.01 -1.26 -0.04 118.70 133.81 2k39 s GLU 18 Ca -0.06 1.33 -0.11 0.00 0.01 0.00 0.00 54.97 56.14 2k39 s GLU 18 Cb -0.04 -2.26 0.07 0.00 -4.31 0.00 0.00 34.13 27.58 2k39 s GLU 18 CO -0.00 -0.22 1.68 -1.00 0.01 0.00 0.00 175.26 175.73 2k39 h PRO 19 N 1.96 0.94 0.00 0.39 0.13 -1.95 -3.08 132.00 130.40 2k39 h PRO 19 Ca -0.49 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.42 2k39 h PRO 19 Cb 1.21 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2k39 h PRO 19 CO 0.61 0.87 0.00 -1.13 -0.23 0.00 0.00 178.00 178.11 2k39 n SER 20 N -4.37 0.00 -4.84 1.44 3.41 -1.26 -2.06 113.62 105.95 2k39 n SER 20 Ca 0.03 0.16 -0.35 0.00 -0.26 0.00 0.00 58.87 58.45 2k39 n SER 20 Cb 0.24 -0.30 -0.06 0.00 -0.26 0.00 0.00 64.21 63.83 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 -2.59 6.86 0.00 4.04 -1.08 -1.16 -4.86 116.67 117.88 2k39 s ASP 21 Ca 0.09 1.17 -0.05 0.00 -0.52 0.00 0.00 52.55 53.25 2k39 s ASP 21 Cb 0.07 -2.33 -0.04 0.00 -1.46 0.00 0.00 42.92 39.16 2k39 s ASP 21 CO 0.15 0.03 0.23 0.42 0.52 0.00 0.00 175.17 176.52 2k39 s THR 22 N -1.58 5.36 0.26 1.71 -4.23 -1.26 -1.88 115.64 114.03 2k39 s THR 22 Ca 0.42 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 60.84 2k39 s THR 22 Cb -0.14 -3.55 0.40 0.00 1.34 0.00 0.00 72.50 70.54 2k39 s THR 22 CO 0.20 0.33 1.58 0.40 -0.54 0.00 0.00 174.62 176.59 2k39 h ILE 23 N 2.89 0.10 -0.00 2.99 1.08 -1.65 0.71 117.51 123.64 2k39 h ILE 23 Ca -0.49 -0.00 -0.18 0.00 -0.39 0.00 0.00 64.86 63.80 2k39 h ILE 23 Cb 1.19 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 35.02 2k39 h ILE 23 CO 0.68 0.00 -0.83 -0.08 -0.69 0.00 0.00 178.15 177.23 2k39 h GLU 24 N 0.00 0.10 -0.08 2.37 4.57 -1.89 -0.51 114.58 119.14 2k39 h GLU 24 Ca 0.44 -0.10 -0.19 0.00 -1.18 0.00 0.00 59.36 58.33 2k39 h GLU 24 Cb 0.69 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.31 2k39 h GLU 24 CO -0.92 0.87 -0.75 -0.97 -1.18 0.00 0.00 179.01 176.05 2k39 h ASN 25 N 0.05 0.51 0.10 1.04 -1.24 -1.80 -1.67 115.58 112.57 2k39 h ASN 25 Ca -0.02 -0.34 -0.17 0.00 0.71 0.00 0.00 56.30 56.47 2k39 h ASN 25 Cb 1.44 -0.15 -0.00 0.00 0.73 0.00 0.00 38.32 40.34 2k39 h ASN 25 CO 0.12 1.09 -0.63 0.58 -1.29 0.00 0.00 177.43 177.29 2k39 h VAL 26 N 0.29 1.34 0.00 2.57 2.07 -0.75 -2.54 116.25 119.22 2k39 h VAL 26 Ca -0.04 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.54 2k39 h VAL 26 Cb 1.33 1.91 -0.00 0.00 -1.52 0.00 0.00 31.29 33.01 2k39 h VAL 26 CO 0.13 0.59 -0.07 0.11 0.02 0.00 0.00 177.57 178.36 2k39 h LYS 27 N 0.38 0.00 -0.06 1.57 1.57 -1.11 -2.32 116.57 116.61 2k39 h LYS 27 Ca -0.01 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 2k39 h LYS 27 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 2k39 h LYS 27 CO 0.12 0.07 -0.41 0.00 -0.57 0.00 0.00 179.45 178.65 2k39 h ALA 28 N 1.93 1.21 0.00 3.86 0.00 -0.94 -2.10 119.26 123.22 2k39 h ALA 28 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2k39 h ALA 28 Cb 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2k39 h ALA 28 CO 0.01 0.56 0.00 0.87 0.00 0.00 0.00 179.25 180.68 2k39 h LYS 29 N 0.10 0.00 0.00 0.00 1.57 -1.02 -1.90 116.57 115.33 2k39 h LYS 29 Ca 0.01 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.65 2k39 h LYS 29 Cb 0.77 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 2k39 h LYS 29 CO 0.06 0.00 -0.66 0.82 -0.57 0.00 0.00 179.45 179.10 2k39 h ILE 30 N 0.00 1.26 -0.63 1.86 1.08 -1.52 -3.37 117.51 116.20 2k39 h ILE 30 Ca 0.00 -2.44 -0.04 0.00 -0.39 0.00 0.00 64.86 61.99 2k39 h ILE 30 Cb 0.69 2.40 -0.03 0.00 -3.07 0.00 0.00 36.82 36.81 2k39 h ILE 30 CO 0.00 0.65 0.21 -0.61 -0.69 0.00 0.00 178.15 177.71 2k39 h GLN 31 N 0.00 0.94 -0.91 2.37 4.15 -0.64 0.30 115.11 121.32 2k39 h GLN 31 Ca -0.01 -0.17 0.15 0.00 0.77 0.00 0.00 58.65 59.39 2k39 h GLN 31 Cb 1.34 -0.15 -0.15 0.00 0.21 0.00 0.00 27.48 28.73 2k39 h GLN 31 CO 0.09 0.80 -0.37 0.22 -1.93 0.00 0.00 178.83 177.63 2k39 h ASP 32 N 0.91 -1.35 0.04 -0.69 3.58 -1.70 -0.43 116.42 116.79 2k39 h ASP 32 Ca 0.21 0.29 -0.30 0.00 0.42 0.00 0.00 57.03 57.65 2k39 h ASP 32 Cb 0.24 0.71 -0.03 0.00 1.72 0.00 0.00 39.33 41.97 2k39 h ASP 32 CO -0.01 -0.29 -1.64 0.29 -2.88 0.00 0.00 179.24 174.70 2k39 n LYS 33 N -5.47 0.64 -0.07 0.28 5.02 -0.40 -4.52 118.16 113.63 2k39 n LYS 33 Ca 0.09 0.44 -0.12 0.00 -2.02 0.00 0.00 58.31 56.70 2k39 n LYS 33 Cb 0.39 -1.71 -0.15 0.00 -0.02 0.00 0.00 35.03 33.55 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2k39 n GLU 34 N -4.06 0.67 0.00 1.97 -0.58 0.91 -4.99 120.64 114.56 2k39 n GLU 34 Ca -0.34 0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.53 2k39 n GLU 34 Cb 0.83 -1.62 0.00 0.00 -0.57 0.00 0.00 31.44 30.08 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 1.80 2.44 3.61 0.62 0.00 -0.17 -5.05 105.19 108.44 2k39 n GLY 35 Ca -0.30 -0.13 -0.56 0.00 0.00 0.00 0.00 46.02 45.03 2k39 n GLY 35 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2k39 n ILE 36 N 0.00 0.25 -1.71 -0.61 2.08 -1.26 -4.94 119.36 113.17 2k39 n ILE 36 Ca 0.00 -0.10 -0.35 0.00 0.56 0.00 0.00 62.75 62.86 2k39 n ILE 36 Cb 0.00 -1.26 0.06 0.00 -0.75 0.00 0.00 39.64 37.69 2k39 n ILE 36 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2k39 s PRO 37 N 4.42 2.55 0.38 0.38 0.04 -1.26 -4.40 135.00 137.11 2k39 s PRO 37 Ca 1.03 1.79 0.12 0.00 0.04 0.00 0.00 61.00 63.99 2k39 s PRO 37 Cb -1.06 -1.88 0.93 0.00 0.04 0.00 0.00 34.50 32.53 2k39 s PRO 37 CO 0.62 -1.53 1.85 -1.35 0.04 0.00 0.00 177.00 176.63 2k39 h PRO 38 N 0.26 0.56 0.00 0.56 0.11 -1.91 -0.86 132.00 130.73 2k39 h PRO 38 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2k39 h PRO 38 Cb 1.30 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2k39 h PRO 38 CO 0.52 0.37 0.00 -0.44 -0.21 0.00 0.00 178.00 178.24 2k39 h ASP 39 N 0.57 0.00 0.41 -2.05 3.32 -1.96 -2.13 116.42 114.57 2k39 h ASP 39 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 2k39 h ASP 39 Cb 0.95 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 2k39 h ASP 39 CO -0.22 0.00 -0.57 0.00 -1.72 0.00 0.00 179.24 176.73 2k39 n GLN 40 N -2.71 0.05 -4.39 3.56 1.13 -0.35 -4.71 117.38 109.96 2k39 n GLN 40 Ca 0.04 -0.03 -0.34 0.00 -1.94 0.00 0.00 57.00 54.73 2k39 n GLN 40 Cb 0.42 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 29.15 2k39 n GLN 40 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 2k39 s GLN 41 N -2.97 3.68 0.33 -1.09 2.00 -0.80 -0.76 119.66 120.04 2k39 s GLN 41 Ca 0.11 -0.51 0.01 0.00 -2.00 0.00 0.00 55.36 52.97 2k39 s GLN 41 Cb 0.17 -2.92 0.01 0.00 0.80 0.00 0.00 33.01 31.07 2k39 s GLN 41 CO 0.72 0.25 0.05 0.54 -0.50 0.00 0.00 175.29 176.35 2k39 n ARG 42 N 3.50 1.17 -3.63 1.67 1.74 0.58 -4.84 116.66 116.84 2k39 n ARG 42 Ca -0.17 -2.35 -0.03 0.00 -0.77 0.00 0.00 57.85 54.53 2k39 n ARG 42 Cb 0.52 0.57 -0.05 0.00 -1.02 0.00 0.00 32.46 32.48 2k39 n ARG 42 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2k39 s LEU 43 N 0.00 -1.03 -0.22 0.55 1.02 -1.26 -1.74 118.68 116.00 2k39 s LEU 43 Ca 0.03 1.49 -0.05 0.00 0.02 0.00 0.00 54.13 55.62 2k39 s LEU 43 Cb -0.00 2.28 -0.02 0.00 0.02 0.00 0.00 46.19 48.47 2k39 s LEU 43 CO 0.02 -0.22 0.00 -0.63 0.02 0.00 0.00 176.35 175.55 2k39 s ILE 44 N 2.41 3.88 -0.19 -0.59 -1.09 -1.26 -4.10 121.20 120.26 2k39 s ILE 44 Ca -0.07 -0.33 -0.04 0.00 -2.23 0.00 0.00 60.65 57.98 2k39 s ILE 44 Cb -0.09 -2.77 0.07 0.00 -1.58 0.00 0.00 42.46 38.08 2k39 s ILE 44 CO -0.19 0.41 0.08 0.12 -1.23 0.00 0.00 174.94 174.13 2k39 s PHE 45 N 1.26 0.42 -1.15 3.97 5.36 -0.55 -4.75 117.98 122.55 2k39 s PHE 45 Ca 0.04 -0.54 0.00 0.00 -0.96 0.00 0.00 56.93 55.47 2k39 s PHE 45 Cb -0.15 -0.82 0.00 0.00 -0.34 0.00 0.00 43.02 41.72 2k39 s PHE 45 CO 0.01 -0.58 0.00 0.00 -1.46 0.00 0.00 175.22 173.19 2k39 n ALA 46 N 5.22 -0.32 0.00 11.12 0.00 -1.26 -3.19 120.51 132.08 2k39 n ALA 46 Ca -0.07 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2k39 n ALA 46 Cb 0.47 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 -1.13 1.10 3.27 0.00 0.00 -1.26 -5.07 105.19 102.09 2k39 n GLY 47 Ca -0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 2k39 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k39 s LYS 48 N -0.25 0.95 0.40 1.61 -2.85 -1.19 -5.18 119.74 113.23 2k39 s LYS 48 Ca 0.00 -0.78 -0.23 0.00 -1.00 0.00 0.00 55.97 53.96 2k39 s LYS 48 Cb 0.00 0.41 -0.10 0.00 -2.06 0.00 0.00 37.83 36.07 2k39 s LYS 48 CO 0.00 -0.34 0.96 -0.65 0.10 0.00 0.00 175.35 175.41 2k39 s GLN 49 N -3.69 4.31 -0.30 1.78 -0.21 -1.26 -1.48 119.66 118.81 2k39 s GLN 49 Ca 0.03 1.21 -0.11 0.00 0.02 0.00 0.00 55.36 56.50 2k39 s GLN 49 Cb 0.03 -2.37 -0.04 0.00 1.00 0.00 0.00 33.01 31.63 2k39 s GLN 49 CO -0.11 0.04 0.20 -0.51 -2.12 0.00 0.00 175.29 172.80 2k39 s LEU 50 N -2.84 4.17 0.43 2.90 1.43 -1.26 -4.97 118.68 118.53 2k39 s LEU 50 Ca 0.59 -0.16 -0.07 0.00 -1.03 0.00 0.00 54.13 53.46 2k39 s LEU 50 Cb -0.13 -2.12 -0.05 0.00 0.03 0.00 0.00 46.19 43.93 2k39 s LEU 50 CO 0.17 -0.11 0.76 -0.70 0.23 0.00 0.00 176.35 176.69 2k39 s GLU 51 N 1.74 3.66 0.62 1.70 2.56 -1.26 -4.97 118.70 122.75 2k39 s GLU 51 Ca 0.07 0.30 -0.15 0.00 0.00 0.00 0.00 54.97 55.19 2k39 s GLU 51 Cb -0.16 -2.41 -0.02 0.00 2.00 0.00 0.00 34.13 33.53 2k39 s GLU 51 CO 0.11 -0.09 1.07 0.16 -0.56 0.00 0.00 175.26 175.95 2k39 s ASP 52 N -3.59 5.55 0.00 -1.70 1.47 -1.26 -3.89 116.67 113.25 2k39 s ASP 52 Ca 0.49 1.85 0.00 0.00 1.18 0.00 0.00 52.55 56.06 2k39 s ASP 52 Cb -0.10 -2.53 0.00 0.00 -0.34 0.00 0.00 42.92 39.94 2k39 s ASP 52 CO 0.37 -1.32 0.00 0.61 0.68 0.00 0.00 175.17 175.51 2k39 n GLY 53 N -0.95 2.48 3.87 2.12 0.00 -1.26 -5.00 105.19 106.45 2k39 n GLY 53 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.36 3.83 0.91 1.61 1.81 -1.25 -4.94 118.95 120.56 2k39 s ARG 54 Ca 0.00 0.31 -0.14 0.00 -1.72 0.00 0.00 55.73 54.18 2k39 s ARG 54 Cb 0.00 -2.68 0.15 0.00 -0.45 0.00 0.00 34.95 31.98 2k39 s ARG 54 CO 0.00 0.33 1.24 0.95 -0.68 0.00 0.00 175.30 177.15 2k39 s THR 55 N -1.78 1.98 -0.12 0.02 -4.23 -1.26 -1.86 115.64 108.39 2k39 s THR 55 Ca 0.46 0.00 0.21 0.00 -1.18 0.00 0.00 61.69 61.19 2k39 s THR 55 Cb -0.12 -2.96 0.22 0.00 1.34 0.00 0.00 72.50 70.98 2k39 s THR 55 CO 0.21 0.00 1.65 -0.07 -0.54 0.00 0.00 174.62 175.87 2k39 h LEU 56 N -1.45 0.00 -1.02 4.79 4.07 -0.96 -3.09 115.31 117.66 2k39 h LEU 56 Ca -0.45 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.41 2k39 h LEU 56 Cb 1.28 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.01 2k39 h LEU 56 CO 0.51 0.24 -0.47 -1.28 -1.08 0.00 0.00 178.44 176.36 2k39 h SER 57 N 0.00 0.00 0.06 -0.43 0.87 -1.69 -1.78 113.55 110.57 2k39 h SER 57 Ca -0.00 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.49 2k39 h SER 57 Cb 1.01 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.96 2k39 h SER 57 CO 0.03 0.47 -0.19 0.44 -0.53 0.00 0.00 176.83 177.05 2k39 h ASP 58 N 0.00 0.25 -0.22 6.23 3.32 -1.84 -2.58 116.42 121.58 2k39 h ASP 58 Ca -0.00 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2k39 h ASP 58 Cb 0.87 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.36 2k39 h ASP 58 CO 0.06 0.46 0.00 -1.22 -1.72 0.00 0.00 179.24 176.82 2k39 n TYR 59 N -4.21 0.28 -3.71 4.55 4.01 -1.13 -4.99 117.16 111.96 2k39 n TYR 59 Ca -0.01 -0.31 -0.26 0.00 -0.16 0.00 0.00 57.90 57.17 2k39 n TYR 59 Cb 0.32 -0.02 0.06 0.00 -0.31 0.00 0.00 39.34 39.39 2k39 n TYR 59 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2k39 n ASN 60 N 0.54 -5.17 -4.65 7.72 6.94 -0.73 -4.95 115.26 114.96 2k39 n ASN 60 Ca 0.10 -0.65 -0.40 0.00 -0.02 0.00 0.00 54.58 53.61 2k39 n ASN 60 Cb 0.37 -4.57 -0.06 0.00 -2.36 0.00 0.00 39.78 33.15 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2k39 s ILE 61 N -3.34 5.05 0.36 1.53 1.01 -0.83 -5.04 121.20 119.94 2k39 s ILE 61 Ca 0.53 1.05 0.02 0.00 0.00 0.00 0.00 60.65 62.25 2k39 s ILE 61 Cb -0.25 -3.89 0.02 0.00 0.01 0.00 0.00 42.46 38.34 2k39 s ILE 61 CO 0.77 0.11 0.13 0.00 0.00 0.00 0.00 174.94 175.95 2k39 n GLN 62 N 5.19 1.05 -0.79 2.79 1.13 -1.26 -4.69 117.38 120.81 2k39 n GLN 62 Ca -0.03 -2.45 -0.33 0.00 -1.94 0.00 0.00 57.00 52.25 2k39 n GLN 62 Cb 0.50 0.48 0.12 0.00 0.11 0.00 0.00 30.24 31.45 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 -1.11 -0.51 -0.74 -1.09 2.85 -1.26 -4.15 118.16 112.15 2k39 n LYS 63 Ca -0.08 -0.12 0.00 0.00 -1.05 0.00 0.00 58.31 57.06 2k39 n LYS 63 Cb 0.43 -1.76 0.00 0.00 -0.65 0.00 0.00 35.03 33.05 2k39 n LYS 63 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2k39 n GLU 64 N -1.45 0.00 -2.67 -1.58 4.07 -1.26 -4.99 120.64 112.75 2k39 n GLU 64 Ca 0.05 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 56.72 2k39 n GLU 64 Cb 0.56 -1.91 -0.03 0.00 -0.06 0.00 0.00 31.44 30.00 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 2k39 s SER 65 N -2.86 6.47 -0.45 4.31 0.01 -1.26 -4.95 113.70 114.97 2k39 s SER 65 Ca 0.00 0.09 -0.26 0.00 1.31 0.00 0.00 55.95 57.09 2k39 s SER 65 Cb 0.00 -2.51 0.03 0.00 0.21 0.00 0.00 66.02 63.74 2k39 s SER 65 CO 0.00 -1.32 0.95 -0.89 0.41 0.00 0.00 173.24 172.39 2k39 s THR 66 N 4.47 4.46 0.73 1.44 2.01 -1.26 -2.23 115.64 125.26 2k39 s THR 66 Ca 0.41 0.86 -0.11 0.00 0.31 0.00 0.00 61.69 63.16 2k39 s THR 66 Cb -0.09 -4.44 0.03 0.00 0.01 0.00 0.00 72.50 68.01 2k39 s THR 66 CO 0.26 -0.81 1.08 -0.76 -0.69 0.00 0.00 174.62 173.69 2k39 s LEU 67 N 3.80 2.89 0.09 4.42 1.43 -0.06 -4.95 118.68 126.30 2k39 s LEU 67 Ca 0.38 1.39 0.10 0.00 -1.03 0.00 0.00 54.13 54.97 2k39 s LEU 67 Cb -0.10 -4.17 -0.04 0.00 0.03 0.00 0.00 46.19 41.92 2k39 s LEU 67 CO 0.26 -1.57 -0.27 -1.38 0.23 0.00 0.00 176.35 173.63 2k39 s HIS 68 N -3.16 2.32 0.11 0.29 -3.43 -1.26 -0.83 115.29 109.33 2k39 s HIS 68 Ca 0.59 -0.39 -0.04 0.00 -0.80 0.00 0.00 55.06 54.42 2k39 s HIS 68 Cb -0.13 -1.31 -0.05 0.00 -1.43 0.00 0.00 32.58 29.65 2k39 s HIS 68 CO 0.54 0.25 0.33 -0.51 -2.00 0.00 0.00 174.74 173.35 2k39 s LEU 69 N -1.71 4.30 0.09 5.38 1.43 -1.24 -4.23 118.68 122.71 2k39 s LEU 69 Ca 0.13 0.52 0.03 0.00 -1.03 0.00 0.00 54.13 53.78 2k39 s LEU 69 Cb -0.10 -3.17 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 2k39 s LEU 69 CO 0.04 0.10 -0.09 0.68 0.23 0.00 0.00 176.35 177.31 2k39 s VAL 70 N -1.59 0.87 -0.08 -1.59 -7.23 -0.71 -4.95 120.40 105.12 2k39 s VAL 70 Ca 0.38 -1.67 -0.07 0.00 -1.81 0.00 0.00 61.98 58.82 2k39 s VAL 70 Cb -0.12 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 2k39 s VAL 70 CO 0.25 -0.61 0.18 -0.76 -0.31 0.00 0.00 175.10 173.85 2k39 s LEU 71 N -2.52 4.39 0.41 1.32 1.43 -1.26 -0.31 118.68 122.15 2k39 s LEU 71 Ca 0.06 0.50 -0.13 0.00 -1.03 0.00 0.00 54.13 53.53 2k39 s LEU 71 Cb -0.02 -2.26 -0.07 0.00 0.03 0.00 0.00 46.19 43.87 2k39 s LEU 71 CO -0.01 0.36 0.81 -0.13 0.23 0.00 0.00 176.35 177.61 2k39 s ARG 72 N -1.26 3.85 -0.10 1.70 0.52 0.06 -4.82 118.95 118.91 2k39 s ARG 72 Ca 0.19 0.61 -0.18 0.00 -0.52 0.00 0.00 55.73 55.82 2k39 s ARG 72 Cb -0.13 -2.34 -0.28 0.00 0.52 0.00 0.00 34.95 32.72 2k39 s ARG 72 CO 0.08 -0.05 0.64 1.25 0.02 0.00 0.00 175.30 177.24 2k39 h LEU 73 N 1.36 0.37 -9.89 2.53 5.85 -1.94 -3.46 115.31 110.13 2k39 h LEU 73 Ca -0.47 -0.87 -0.48 0.00 0.84 0.00 0.00 57.88 56.90 2k39 h LEU 73 Cb 1.18 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 2k39 h LEU 73 CO 0.64 1.53 0.38 -0.13 -0.34 0.00 0.00 178.44 180.51 2k39 s ARG 74 N -2.45 4.48 0.00 1.25 1.81 -1.26 -5.06 118.95 117.72 2k39 s ARG 74 Ca -0.19 1.45 0.00 0.00 -1.72 0.00 0.00 55.73 55.27 2k39 s ARG 74 Cb 0.03 -2.79 0.00 0.00 -0.45 0.00 0.00 34.95 31.74 2k39 s ARG 74 CO 0.77 0.15 0.00 0.41 -0.68 0.00 0.00 175.30 175.95 2k39 n GLY 75 N 0.61 1.68 0.00 -3.53 0.00 -1.26 -4.68 105.19 98.02 2k39 n GLY 75 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93