#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 3.68 0.40 2.12 -0.21 -1.26 -0.09 119.66 124.30 2k39 s GLN 2 Ca 0.00 0.11 0.04 0.00 0.02 0.00 0.00 55.36 55.53 2k39 s GLN 2 Cb 0.00 -3.14 -0.03 0.00 1.00 0.00 0.00 33.01 30.85 2k39 s GLN 2 CO 0.00 0.68 0.14 0.96 -2.12 0.00 0.00 175.29 174.94 2k39 s ILE 3 N -1.18 0.57 -0.03 1.08 -4.36 0.04 -1.63 121.20 115.69 2k39 s ILE 3 Ca 0.24 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 58.60 2k39 s ILE 3 Cb -0.14 -2.38 -0.04 0.00 1.25 0.00 0.00 42.46 41.15 2k39 s ILE 3 CO 0.13 0.00 0.16 -0.36 0.24 0.00 0.00 174.94 175.10 2k39 s PHE 4 N -3.25 3.52 0.13 1.37 0.08 0.16 -0.46 117.98 119.53 2k39 s PHE 4 Ca 0.26 0.37 0.09 0.00 0.12 0.00 0.00 56.93 57.77 2k39 s PHE 4 Cb 0.03 -1.84 -0.04 0.00 -0.57 0.00 0.00 43.02 40.60 2k39 s PHE 4 CO 0.15 0.65 -0.19 0.08 -0.10 0.00 0.00 175.22 175.82 2k39 s VAL 5 N -1.24 2.77 0.02 -0.44 1.01 -0.53 -3.19 120.40 118.80 2k39 s VAL 5 Ca 0.24 -1.57 0.01 0.00 0.00 0.00 0.00 61.98 60.66 2k39 s VAL 5 Cb -0.12 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 2k39 s VAL 5 CO 0.15 0.08 -0.04 -0.75 0.00 0.00 0.00 175.10 174.53 2k39 s LYS 6 N -2.20 0.34 0.32 2.72 2.20 -1.03 -1.93 119.74 120.16 2k39 s LYS 6 Ca 0.18 -0.45 0.07 0.00 -0.36 0.00 0.00 55.97 55.42 2k39 s LYS 6 Cb -0.10 -0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.03 2k39 s LYS 6 CO 0.10 0.03 0.25 0.95 -0.36 0.00 0.00 175.35 176.32 2k39 s THR 7 N -0.86 3.67 0.29 3.43 -4.23 -1.10 -1.00 115.64 115.85 2k39 s THR 7 Ca -0.07 -1.43 0.04 0.00 -1.18 0.00 0.00 61.69 59.06 2k39 s THR 7 Cb -0.06 -3.20 0.07 0.00 1.34 0.00 0.00 72.50 70.64 2k39 s THR 7 CO -0.00 -0.22 1.73 -0.07 -0.54 0.00 0.00 174.62 175.52 2k39 h LEU 8 N 1.35 0.39 -0.51 4.79 3.38 -1.94 -2.31 115.31 120.46 2k39 h LEU 8 Ca -0.45 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.38 2k39 h LEU 8 Cb 1.25 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2k39 h LEU 8 CO 0.59 0.68 0.00 0.71 0.09 0.00 0.00 178.44 180.51 2k39 h THR 9 N 0.34 0.00 -0.27 0.22 1.35 -1.96 -3.48 112.91 109.11 2k39 h THR 9 Ca 0.05 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 2k39 h THR 9 Cb 0.69 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 2k39 h THR 9 CO 0.05 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 2k39 n GLY 10 N 0.64 1.10 3.64 5.82 0.00 -0.87 -5.05 105.19 110.47 2k39 n GLY 10 Ca 0.03 -0.31 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.14 4.04 0.32 1.61 2.20 -1.26 -4.83 119.74 119.68 2k39 s LYS 11 Ca 0.00 1.26 -0.01 0.00 -0.36 0.00 0.00 55.97 56.85 2k39 s LYS 11 Cb 0.00 -3.79 -0.04 0.00 -1.51 0.00 0.00 37.83 32.49 2k39 s LYS 11 CO 0.00 -0.94 0.54 0.99 -0.36 0.00 0.00 175.35 175.57 2k39 s THR 12 N 3.89 5.09 0.01 3.43 2.01 -1.26 -2.71 115.64 126.11 2k39 s THR 12 Ca 0.51 -0.29 -0.21 0.00 0.31 0.00 0.00 61.69 62.01 2k39 s THR 12 Cb -0.16 -3.81 0.04 0.00 0.01 0.00 0.00 72.50 68.59 2k39 s THR 12 CO 0.18 -0.45 0.48 0.27 -0.69 0.00 0.00 174.62 174.40 2k39 s ILE 13 N -2.21 0.04 -0.00 1.82 -4.36 -0.81 -5.01 121.20 110.67 2k39 s ILE 13 Ca 0.41 -0.31 -0.27 0.00 -0.26 0.00 0.00 60.65 60.23 2k39 s ILE 13 Cb -0.10 -0.89 -0.04 0.00 1.25 0.00 0.00 42.46 42.68 2k39 s ILE 13 CO 0.34 -0.17 0.84 -0.89 0.24 0.00 0.00 174.94 175.30 2k39 s THR 14 N -1.94 4.86 -0.08 8.37 2.01 -1.26 -1.45 115.64 126.16 2k39 s THR 14 Ca -0.08 1.76 -0.01 0.00 0.31 0.00 0.00 61.69 63.67 2k39 s THR 14 Cb -0.02 -4.18 0.03 0.00 0.01 0.00 0.00 72.50 68.34 2k39 s THR 14 CO 0.02 0.25 -0.02 -0.22 -0.69 0.00 0.00 174.62 173.96 2k39 s LEU 15 N 0.60 0.85 -0.20 4.42 1.98 0.39 -4.90 118.68 121.81 2k39 s LEU 15 Ca 0.44 -0.14 -0.11 0.00 -2.89 0.00 0.00 54.13 51.42 2k39 s LEU 15 Cb -0.20 -0.54 -0.05 0.00 0.66 0.00 0.00 46.19 46.06 2k39 s LEU 15 CO 0.24 -0.15 0.17 -0.70 -1.89 0.00 0.00 176.35 174.01 2k39 s GLU 16 N 1.74 4.17 -0.02 1.98 2.12 -1.26 -0.78 118.70 126.65 2k39 s GLU 16 Ca 0.02 -0.18 -0.01 0.00 0.36 0.00 0.00 54.97 55.17 2k39 s GLU 16 Cb -0.13 -3.45 0.01 0.00 0.26 0.00 0.00 34.13 30.83 2k39 s GLU 16 CO -0.05 0.23 0.04 0.08 -0.54 0.00 0.00 175.26 175.02 2k39 s VAL 17 N 0.55 -0.02 0.03 3.70 1.01 0.87 -4.92 120.40 121.62 2k39 s VAL 17 Ca 0.09 0.06 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 2k39 s VAL 17 Cb -0.12 -0.07 -0.06 0.00 0.00 0.00 0.00 36.38 36.13 2k39 s VAL 17 CO 0.00 0.03 0.53 -1.61 0.00 0.00 0.00 175.10 174.05 2k39 s GLU 18 N 0.33 4.16 0.63 2.72 0.41 -1.26 -1.44 118.70 124.25 2k39 s GLU 18 Ca -0.03 0.64 0.21 0.00 -0.41 0.00 0.00 54.97 55.39 2k39 s GLU 18 Cb -0.04 -3.27 0.93 0.00 -1.78 0.00 0.00 34.13 29.98 2k39 s GLU 18 CO -0.01 0.57 1.46 -1.35 -0.49 0.00 0.00 175.26 175.45 2k39 h PRO 19 N 4.91 0.00 0.00 0.39 0.11 -2.01 0.12 132.00 135.52 2k39 h PRO 19 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2k39 h PRO 19 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2k39 h PRO 19 CO 0.65 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.87 2k39 n SER 20 N -3.09 0.63 -4.73 -2.05 7.64 -1.26 -4.72 113.62 106.04 2k39 n SER 20 Ca 0.10 0.58 -0.39 0.00 1.01 0.00 0.00 58.87 60.17 2k39 n SER 20 Cb 1.01 -0.74 -0.05 0.00 -1.01 0.00 0.00 64.21 63.41 2k39 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2k39 s ASP 21 N -4.18 6.92 1.13 6.43 1.01 0.43 -5.08 116.67 123.33 2k39 s ASP 21 Ca 0.10 1.10 -0.17 0.00 0.71 0.00 0.00 52.55 54.29 2k39 s ASP 21 Cb 0.13 -2.37 0.25 0.00 1.01 0.00 0.00 42.92 41.93 2k39 s ASP 21 CO 0.53 -0.05 1.10 0.42 0.21 0.00 0.00 175.17 177.38 2k39 s THR 22 N 0.58 1.76 0.16 -1.27 -4.23 -1.26 -4.18 115.64 107.19 2k39 s THR 22 Ca 0.34 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.70 2k39 s THR 22 Cb -0.17 -2.49 0.04 0.00 1.34 0.00 0.00 72.50 71.22 2k39 s THR 22 CO 0.16 0.00 1.77 0.40 -0.54 0.00 0.00 174.62 176.41 2k39 h ILE 23 N -2.34 1.16 -0.94 2.99 2.04 -1.72 -2.94 117.51 115.77 2k39 h ILE 23 Ca -0.49 -0.41 0.14 0.00 1.00 0.00 0.00 64.86 65.11 2k39 h ILE 23 Cb 1.31 0.56 -0.08 0.00 -0.74 0.00 0.00 36.82 37.87 2k39 h ILE 23 CO 0.43 0.17 0.60 -0.08 0.00 0.00 0.00 178.15 179.28 2k39 h GLU 24 N 0.64 0.76 -0.08 2.37 4.57 -1.94 -2.34 114.58 118.56 2k39 h GLU 24 Ca 0.17 -0.05 -0.18 0.00 -1.18 0.00 0.00 59.36 58.13 2k39 h GLU 24 Cb 0.04 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.45 2k39 h GLU 24 CO -0.03 0.51 -0.70 -0.91 -1.18 0.00 0.00 179.01 176.70 2k39 h ASN 25 N 0.79 0.44 -0.61 1.04 4.21 -1.89 0.39 115.58 119.96 2k39 h ASN 25 Ca 0.48 -0.28 -0.03 0.00 1.21 0.00 0.00 56.30 57.68 2k39 h ASN 25 Cb 0.69 -0.13 -0.03 0.00 -1.12 0.00 0.00 38.32 37.72 2k39 h ASN 25 CO -0.24 1.01 0.28 0.58 -1.29 0.00 0.00 177.43 177.77 2k39 h VAL 26 N 0.26 1.22 -0.59 2.81 2.07 -1.40 0.34 116.25 120.96 2k39 h VAL 26 Ca -0.02 -0.64 -0.09 0.00 0.82 0.00 0.00 66.70 66.77 2k39 h VAL 26 Cb 1.26 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 2k39 h VAL 26 CO 0.12 0.26 0.01 0.11 0.02 0.00 0.00 177.57 178.09 2k39 h LYS 27 N 0.91 1.03 -0.87 1.57 1.57 -1.09 0.49 116.57 120.17 2k39 h LYS 27 Ca 0.22 -0.32 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2k39 h LYS 27 Cb 0.13 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 2k39 h LYS 27 CO -0.02 1.01 0.57 0.00 -0.57 0.00 0.00 179.45 180.43 2k39 h ALA 28 N 0.98 1.14 -0.44 3.86 0.00 -0.35 0.84 119.26 125.30 2k39 h ALA 28 Ca 0.17 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 2k39 h ALA 28 Cb 0.54 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2k39 h ALA 28 CO 0.03 0.44 -0.15 0.87 0.00 0.00 0.00 179.25 180.44 2k39 h LYS 29 N 1.12 0.87 0.42 0.00 1.57 -0.11 0.61 116.57 121.05 2k39 h LYS 29 Ca 0.34 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2k39 h LYS 29 Cb -0.03 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 2k39 h LYS 29 CO -0.11 1.00 -0.42 0.82 -0.57 0.00 0.00 179.45 180.17 2k39 h ILE 30 N 0.70 0.15 -1.11 1.86 2.04 -0.74 -0.97 117.51 119.44 2k39 h ILE 30 Ca 0.11 0.00 0.34 0.00 1.00 0.00 0.00 64.86 66.30 2k39 h ILE 30 Cb 0.70 0.15 -0.12 0.00 -0.74 0.00 0.00 36.82 36.81 2k39 h ILE 30 CO 0.05 0.00 0.69 -0.61 0.00 0.00 0.00 178.15 178.28 2k39 h GLN 31 N -0.86 0.27 -0.02 2.37 5.75 -0.79 0.41 115.11 122.24 2k39 h GLN 31 Ca -0.04 -0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.32 2k39 h GLN 31 Cb 0.76 -0.06 0.01 0.00 1.07 0.00 0.00 27.48 29.26 2k39 h GLN 31 CO -0.07 0.18 -0.47 0.22 -2.65 0.00 0.00 178.83 176.04 2k39 h ASP 32 N 0.28 0.45 0.00 -0.69 3.58 -0.55 -3.28 116.42 116.22 2k39 h ASP 32 Ca 0.71 -0.73 -0.24 0.00 0.42 0.00 0.00 57.03 57.20 2k39 h ASP 32 Cb 1.89 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 42.76 2k39 h ASP 32 CO -0.45 1.12 -1.90 0.29 -2.88 0.00 0.00 179.24 175.43 2k39 n LYS 33 N -4.32 1.17 -0.01 0.28 4.76 -0.40 -4.54 118.16 115.10 2k39 n LYS 33 Ca -0.10 0.04 -0.09 0.00 -2.87 0.00 0.00 58.31 55.30 2k39 n LYS 33 Cb 0.60 -1.32 -0.14 0.00 -1.84 0.00 0.00 35.03 32.33 2k39 n LYS 33 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2k39 h GLU 34 N 0.00 0.02 -3.08 1.97 4.39 -1.11 -3.49 114.58 113.27 2k39 h GLU 34 Ca -0.35 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.24 2k39 h GLU 34 Cb 1.67 0.01 0.04 0.00 -0.10 0.00 0.00 28.75 30.37 2k39 h GLU 34 CO -0.02 0.57 -0.19 0.41 -1.16 0.00 0.00 179.01 178.62 2k39 n GLY 35 N 1.56 0.29 3.50 -3.84 0.00 -0.92 -5.00 105.19 100.78 2k39 n GLY 35 Ca -0.16 -0.26 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.09 3.05 0.03 -0.61 1.01 -1.26 -5.00 121.20 115.33 2k39 s ILE 36 Ca 0.03 -1.10 -0.30 0.00 0.00 0.00 0.00 60.65 59.28 2k39 s ILE 36 Cb -0.00 -2.31 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 2k39 s ILE 36 CO 0.18 0.33 1.22 -2.16 0.00 0.00 0.00 174.94 174.51 2k39 s PRO 37 N -1.52 4.39 -0.03 2.79 0.04 -1.26 -3.76 135.00 135.65 2k39 s PRO 37 Ca 0.16 1.77 -0.23 0.00 0.04 0.00 0.00 61.00 62.73 2k39 s PRO 37 Cb -0.11 -3.42 -0.23 0.00 0.04 0.00 0.00 34.50 30.78 2k39 s PRO 37 CO 0.07 -0.34 1.06 -1.00 0.04 0.00 0.00 177.00 176.83 2k39 h PRO 38 N 7.07 0.23 -1.16 0.56 0.13 -1.96 -3.36 132.00 133.51 2k39 h PRO 38 Ca -0.39 -0.23 0.37 0.00 -0.87 0.00 0.00 66.00 64.88 2k39 h PRO 38 Cb 1.20 0.06 -0.08 0.00 0.13 0.00 0.00 31.00 32.30 2k39 h PRO 38 CO 0.84 0.94 0.79 -3.47 -0.23 0.00 0.00 178.00 176.86 2k39 n ASP 39 N -4.46 0.09 0.12 1.44 2.03 -1.26 -0.57 116.55 113.94 2k39 n ASP 39 Ca -0.10 0.89 0.07 0.00 0.52 0.00 0.00 54.79 56.17 2k39 n ASP 39 Cb 0.52 -0.44 0.02 0.00 -0.72 0.00 0.00 41.12 40.51 2k39 n ASP 39 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2k39 h GLN 40 N 0.00 0.00 -5.86 -0.67 4.20 -1.85 -3.48 115.11 107.45 2k39 h GLN 40 Ca 0.65 0.00 -0.63 0.00 0.06 0.00 0.00 58.65 58.73 2k39 h GLN 40 Cb 2.30 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 30.03 2k39 h GLN 40 CO -0.21 0.16 -0.44 -0.65 -0.67 0.00 0.00 178.83 177.02 2k39 s GLN 41 N -3.15 3.50 0.19 1.46 -1.52 0.26 -4.27 119.66 116.14 2k39 s GLN 41 Ca 0.01 -0.22 0.11 0.00 -1.95 0.00 0.00 55.36 53.31 2k39 s GLN 41 Cb 0.08 -3.08 -0.04 0.00 -0.22 0.00 0.00 33.01 29.75 2k39 s GLN 41 CO 0.76 0.65 -0.19 1.03 -0.25 0.00 0.00 175.29 177.29 2k39 s ARG 42 N -1.91 1.70 -0.11 2.91 0.52 0.11 -5.02 118.95 117.14 2k39 s ARG 42 Ca 0.28 -1.45 -0.02 0.00 -0.52 0.00 0.00 55.73 54.02 2k39 s ARG 42 Cb -0.13 -1.95 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 2k39 s ARG 42 CO 0.18 0.41 -0.02 -0.51 0.02 0.00 0.00 175.30 175.38 2k39 s LEU 43 N -2.74 3.38 -0.09 2.53 1.02 -1.26 -0.34 118.68 121.17 2k39 s LEU 43 Ca 0.22 -0.00 0.03 0.00 0.02 0.00 0.00 54.13 54.41 2k39 s LEU 43 Cb -0.08 -1.79 0.00 0.00 0.02 0.00 0.00 46.19 44.35 2k39 s LEU 43 CO 0.12 0.28 -0.21 -0.63 0.02 0.00 0.00 176.35 175.93 2k39 s ILE 44 N -0.31 1.80 -0.02 -0.59 -1.09 0.31 -4.24 121.20 117.07 2k39 s ILE 44 Ca 0.06 -0.86 0.00 0.00 -2.23 0.00 0.00 60.65 57.61 2k39 s ILE 44 Cb -0.12 -1.58 0.02 0.00 -1.58 0.00 0.00 42.46 39.20 2k39 s ILE 44 CO 0.02 0.50 0.01 0.12 -1.23 0.00 0.00 174.94 174.36 2k39 s PHE 45 N 0.49 0.22 -1.63 3.97 5.36 -1.20 -2.08 117.98 123.11 2k39 s PHE 45 Ca -0.16 0.03 -0.02 0.00 -0.96 0.00 0.00 56.93 55.81 2k39 s PHE 45 Cb -0.17 -0.32 0.00 0.00 -0.34 0.00 0.00 43.02 42.19 2k39 s PHE 45 CO 0.06 -0.10 0.23 0.00 -1.46 0.00 0.00 175.22 173.95 2k39 n ALA 46 N 3.99 -0.77 -1.08 11.12 0.00 -1.26 -2.79 120.51 129.72 2k39 n ALA 46 Ca -0.25 0.20 -0.03 0.00 0.00 0.00 0.00 53.44 53.36 2k39 n ALA 46 Cb 0.51 -2.75 -0.01 0.00 0.00 0.00 0.00 19.45 17.21 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 -1.18 0.59 3.14 0.00 0.00 -1.26 -5.02 105.19 101.45 2k39 n GLY 47 Ca -0.19 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.49 0.66 -0.15 1.61 -2.85 -1.12 -5.10 119.74 111.29 2k39 s LYS 48 Ca 0.00 -0.84 -0.29 0.00 -1.00 0.00 0.00 55.97 53.83 2k39 s LYS 48 Cb 0.00 0.26 -0.02 0.00 -2.06 0.00 0.00 37.83 36.01 2k39 s LYS 48 CO 0.00 -0.18 1.28 -0.65 0.10 0.00 0.00 175.35 175.90 2k39 s GLN 49 N -3.05 4.24 0.45 1.78 1.11 -1.26 -3.24 119.66 119.69 2k39 s GLN 49 Ca -0.01 1.69 -0.09 0.00 0.01 0.00 0.00 55.36 56.96 2k39 s GLN 49 Cb 0.01 -3.76 -0.05 0.00 -1.01 0.00 0.00 33.01 28.20 2k39 s GLN 49 CO -0.07 -0.70 0.80 -0.51 0.01 0.00 0.00 175.29 174.82 2k39 s LEU 50 N 3.44 3.70 -0.07 2.90 1.43 -1.26 -5.04 118.68 123.78 2k39 s LEU 50 Ca 0.56 1.08 -0.18 0.00 -1.03 0.00 0.00 54.13 54.56 2k39 s LEU 50 Cb -0.22 -4.01 -0.05 0.00 0.03 0.00 0.00 46.19 41.94 2k39 s LEU 50 CO 0.16 -0.51 0.48 -0.70 0.23 0.00 0.00 176.35 176.01 2k39 s GLU 51 N -4.30 4.25 -0.31 1.70 2.12 -1.26 -5.00 118.70 115.90 2k39 s GLU 51 Ca 0.50 0.48 -0.29 0.00 0.36 0.00 0.00 54.97 56.02 2k39 s GLU 51 Cb -0.10 -3.37 0.00 0.00 0.26 0.00 0.00 34.13 30.92 2k39 s GLU 51 CO 0.38 0.31 1.30 -0.51 -0.54 0.00 0.00 175.26 176.20 2k39 s ASP 52 N 0.11 6.65 0.00 -1.70 1.01 -1.26 -2.90 116.67 118.59 2k39 s ASP 52 Ca 0.26 1.16 0.00 0.00 0.71 0.00 0.00 52.55 54.67 2k39 s ASP 52 Cb -0.16 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.23 2k39 s ASP 52 CO 0.12 -1.10 0.00 0.61 0.21 0.00 0.00 175.17 175.00 2k39 n GLY 53 N 4.37 1.28 3.87 0.21 0.00 -1.26 -5.02 105.19 108.63 2k39 n GLY 53 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 3.26 0.72 1.61 1.81 -1.14 -4.89 118.95 120.31 2k39 s ARG 54 Ca 0.00 0.69 -0.01 0.00 -1.72 0.00 0.00 55.73 54.69 2k39 s ARG 54 Cb 0.00 -2.05 0.12 0.00 -0.45 0.00 0.00 34.95 32.57 2k39 s ARG 54 CO 0.00 -0.80 0.99 0.95 -0.68 0.00 0.00 175.30 175.76 2k39 s THR 55 N -3.21 2.18 0.18 0.02 -4.23 -1.26 -2.07 115.64 107.24 2k39 s THR 55 Ca 0.56 -0.56 0.11 0.00 -1.18 0.00 0.00 61.69 60.63 2k39 s THR 55 Cb -0.11 -2.61 -0.04 0.00 1.34 0.00 0.00 72.50 71.07 2k39 s THR 55 CO 0.54 0.00 1.53 0.25 -0.54 0.00 0.00 174.62 176.39 2k39 h LEU 56 N -0.53 0.00 0.00 4.79 5.85 -1.85 -3.20 115.31 120.37 2k39 h LEU 56 Ca -0.37 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.27 2k39 h LEU 56 Cb 1.27 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 2k39 h LEU 56 CO 0.42 0.67 -0.39 0.28 -0.34 0.00 0.00 178.44 179.07 2k39 h SER 57 N 0.00 0.00 0.52 1.25 0.02 -1.89 -1.21 113.55 112.24 2k39 h SER 57 Ca -0.01 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2k39 h SER 57 Cb 1.27 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 2k39 h SER 57 CO 0.09 0.38 -0.23 0.44 -1.14 0.00 0.00 176.83 176.38 2k39 h ASP 58 N 0.00 0.00 0.29 3.07 3.32 -1.95 0.15 116.42 121.30 2k39 h ASP 58 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2k39 h ASP 58 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2k39 h ASP 58 CO 0.05 0.23 -0.63 -1.22 -1.72 0.00 0.00 179.24 175.94 2k39 n TYR 59 N -3.70 0.00 -3.80 4.55 4.01 -1.19 -5.01 117.16 112.02 2k39 n TYR 59 Ca -0.01 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.48 2k39 n TYR 59 Cb 0.34 -0.14 0.01 0.00 -0.31 0.00 0.00 39.34 39.24 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 -1.34 -1.51 -4.60 7.72 0.23 0.51 -4.96 115.26 111.32 2k39 n ASN 60 Ca 0.06 -0.93 -0.43 0.00 -0.53 0.00 0.00 54.58 52.75 2k39 n ASN 60 Cb 0.34 -3.54 -0.02 0.00 -2.08 0.00 0.00 39.78 34.47 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2k39 s ILE 61 N -3.76 3.69 0.57 1.53 1.01 -0.83 -4.96 121.20 118.45 2k39 s ILE 61 Ca 0.08 0.71 0.05 0.00 0.00 0.00 0.00 60.65 61.48 2k39 s ILE 61 Cb -0.03 -3.90 0.07 0.00 0.01 0.00 0.00 42.46 38.61 2k39 s ILE 61 CO 0.85 -0.55 0.79 -1.10 0.00 0.00 0.00 174.94 174.93 2k39 s GLN 62 N 5.24 2.32 0.14 2.79 -0.21 -1.26 -4.64 119.66 124.04 2k39 s GLN 62 Ca 0.71 -1.21 -0.27 0.00 0.02 0.00 0.00 55.36 54.61 2k39 s GLN 62 Cb -0.19 -2.55 -0.15 0.00 1.00 0.00 0.00 33.01 31.11 2k39 s GLN 62 CO 0.33 -0.84 0.55 1.17 -2.12 0.00 0.00 175.29 174.38 2k39 n LYS 63 N -2.33 0.00 -3.07 2.91 4.81 -1.26 -3.14 118.16 116.07 2k39 n LYS 63 Ca 0.12 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.34 2k39 n LYS 63 Cb 0.60 -0.96 0.02 0.00 0.02 0.00 0.00 35.03 34.72 2k39 n LYS 63 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2k39 n GLU 64 N 0.96 -4.44 -3.07 1.64 2.13 -0.64 -5.00 120.64 112.21 2k39 n GLU 64 Ca 0.16 0.81 -0.26 0.00 0.66 0.00 0.00 57.16 58.53 2k39 n GLU 64 Cb 0.19 -5.63 -0.01 0.00 0.27 0.00 0.00 31.44 26.26 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 -2.68 6.32 -0.26 4.31 0.01 -1.19 -4.76 113.70 115.45 2k39 s SER 65 Ca 0.31 0.70 -0.04 0.00 1.31 0.00 0.00 55.95 58.23 2k39 s SER 65 Cb -0.15 -2.14 0.02 0.00 0.21 0.00 0.00 66.02 63.96 2k39 s SER 65 CO 0.39 -0.39 -0.01 -0.89 0.41 0.00 0.00 173.24 172.75 2k39 s THR 66 N -2.44 3.32 0.09 1.44 2.01 -1.26 -0.66 115.64 118.15 2k39 s THR 66 Ca 0.44 -0.84 -0.18 0.00 0.31 0.00 0.00 61.69 61.41 2k39 s THR 66 Cb -0.10 -2.68 -0.07 0.00 0.01 0.00 0.00 72.50 69.66 2k39 s THR 66 CO 0.38 0.18 0.57 -0.22 -0.69 0.00 0.00 174.62 174.84 2k39 s LEU 67 N 1.41 4.48 -0.11 4.42 2.96 -1.19 -4.92 118.68 125.72 2k39 s LEU 67 Ca 0.02 1.22 -0.02 0.00 -0.22 0.00 0.00 54.13 55.13 2k39 s LEU 67 Cb -0.17 -3.00 -0.03 0.00 0.50 0.00 0.00 46.19 43.49 2k39 s LEU 67 CO -0.02 0.23 -0.02 -1.00 -1.32 0.00 0.00 176.35 174.22 2k39 s HIS 68 N -1.21 3.08 -0.49 5.38 3.76 -0.88 -2.47 115.29 122.46 2k39 s HIS 68 Ca 0.31 0.01 -0.01 0.00 -0.15 0.00 0.00 55.06 55.23 2k39 s HIS 68 Cb -0.18 -1.84 0.13 0.00 1.11 0.00 0.00 32.58 31.80 2k39 s HIS 68 CO 0.19 0.28 0.26 -1.17 -0.85 0.00 0.00 174.74 173.45 2k39 s LEU 69 N -0.44 5.01 -0.36 0.89 2.96 -0.17 -0.53 118.68 126.05 2k39 s LEU 69 Ca 0.08 -2.48 -0.29 0.00 -0.22 0.00 0.00 54.13 51.22 2k39 s LEU 69 Cb -0.12 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 2k39 s LEU 69 CO 0.02 -0.41 1.62 -0.69 -1.32 0.00 0.00 176.35 175.57 2k39 s VAL 70 N 0.48 3.67 0.28 1.68 1.01 0.54 -4.20 120.40 123.86 2k39 s VAL 70 Ca 0.13 0.69 -0.03 0.00 0.00 0.00 0.00 61.98 62.76 2k39 s VAL 70 Cb -0.22 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 2k39 s VAL 70 CO -0.04 -0.56 0.53 -0.76 0.00 0.00 0.00 175.10 174.27 2k39 s LEU 71 N 6.15 4.08 -0.17 3.92 2.01 -1.26 -0.71 118.68 132.70 2k39 s LEU 71 Ca 0.71 0.62 -0.04 0.00 0.01 0.00 0.00 54.13 55.44 2k39 s LEU 71 Cb -0.19 -3.44 0.08 0.00 0.01 0.00 0.00 46.19 42.66 2k39 s LEU 71 CO 0.33 -0.19 0.24 -0.13 1.01 0.00 0.00 176.35 177.61 2k39 s ARG 72 N -3.63 0.17 -0.11 1.70 0.52 -1.26 -4.93 118.95 111.41 2k39 s ARG 72 Ca 0.42 0.43 0.03 0.00 -0.52 0.00 0.00 55.73 56.10 2k39 s ARG 72 Cb -0.11 -0.69 0.01 0.00 0.52 0.00 0.00 34.95 34.68 2k39 s ARG 72 CO 0.31 -0.50 -0.20 -0.51 0.02 0.00 0.00 175.30 174.42 2k39 s LEU 73 N 2.37 1.95 -0.21 2.53 1.43 -1.26 -4.54 118.68 120.95 2k39 s LEU 73 Ca 0.05 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.52 2k39 s LEU 73 Cb -0.14 -1.27 -0.19 0.00 0.03 0.00 0.00 46.19 44.62 2k39 s LEU 73 CO -0.11 0.09 0.05 -1.14 0.23 0.00 0.00 176.35 175.47 2k39 n ARG 74 N 3.88 0.64 -2.85 1.70 0.63 -1.26 -4.98 116.66 114.42 2k39 n ARG 74 Ca -0.20 0.35 -0.19 0.00 -0.92 0.00 0.00 57.85 56.89 2k39 n ARG 74 Cb 0.52 -1.64 0.02 0.00 0.45 0.00 0.00 32.46 31.81 2k39 n ARG 74 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2k39 s GLY 75 N -5.48 1.89 0.00 5.14 0.00 -1.26 -5.29 107.32 102.32 2k39 s GLY 75 Ca -0.30 -1.55 0.00 0.00 0.00 0.00 0.00 44.72 42.87 2k39 s GLY 75 CO 0.62 -1.31 0.21 0.61 0.00 0.00 0.00 173.10 173.23