#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 3.29 0.15 2.12 -1.52 -1.26 -1.46 119.66 120.98 2k39 s GLN 2 Ca 0.00 -0.74 0.03 0.00 -1.95 0.00 0.00 55.36 52.70 2k39 s GLN 2 Cb 0.00 -2.56 -0.04 0.00 -0.22 0.00 0.00 33.01 30.20 2k39 s GLN 2 CO 0.00 0.18 0.28 0.96 -0.25 0.00 0.00 175.29 176.46 2k39 s ILE 3 N 0.41 5.26 -0.25 1.08 -4.36 0.83 -4.74 121.20 119.44 2k39 s ILE 3 Ca -0.12 -0.73 -0.09 0.00 -0.26 0.00 0.00 60.65 59.46 2k39 s ILE 3 Cb -0.16 -3.72 -0.04 0.00 1.25 0.00 0.00 42.46 39.79 2k39 s ILE 3 CO 0.06 -0.10 0.11 -0.36 0.24 0.00 0.00 174.94 174.88 2k39 s PHE 4 N -1.75 3.16 -0.18 1.37 0.08 -0.39 -0.74 117.98 119.53 2k39 s PHE 4 Ca 0.34 -0.16 -0.01 0.00 0.12 0.00 0.00 56.93 57.22 2k39 s PHE 4 Cb -0.11 -2.26 -0.00 0.00 -0.57 0.00 0.00 43.02 40.08 2k39 s PHE 4 CO 0.28 -0.21 -0.12 0.08 -0.10 0.00 0.00 175.22 175.15 2k39 s VAL 5 N 1.45 2.85 -0.35 -0.44 1.01 0.39 -0.92 120.40 124.39 2k39 s VAL 5 Ca 0.06 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.38 2k39 s VAL 5 Cb -0.15 -2.23 0.10 0.00 0.00 0.00 0.00 36.38 34.10 2k39 s VAL 5 CO 0.05 0.49 0.07 -0.75 0.00 0.00 0.00 175.10 174.96 2k39 s LYS 6 N 1.02 1.53 0.55 2.72 2.20 -1.12 0.66 119.74 127.31 2k39 s LYS 6 Ca -0.01 -1.90 -0.07 0.00 -0.36 0.00 0.00 55.97 53.63 2k39 s LYS 6 Cb -0.15 -3.24 -0.02 0.00 -1.51 0.00 0.00 37.83 32.91 2k39 s LYS 6 CO -0.02 -0.95 0.88 0.95 -0.36 0.00 0.00 175.35 175.85 2k39 s THR 7 N 0.87 4.49 0.00 3.43 -4.23 -0.66 -3.44 115.64 116.11 2k39 s THR 7 Ca 0.11 0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.94 2k39 s THR 7 Cb -0.19 -3.75 0.00 0.00 1.34 0.00 0.00 72.50 69.90 2k39 s THR 7 CO -0.08 -0.81 0.00 0.18 -0.54 0.00 0.00 174.62 173.37 2k39 n LEU 8 N -2.49 0.00 0.01 4.79 7.99 -1.26 0.14 117.00 126.18 2k39 n LEU 8 Ca 0.03 0.00 0.01 0.00 -0.01 0.00 0.00 56.01 56.04 2k39 n LEU 8 Cb 0.56 0.00 0.07 0.00 -0.11 0.00 0.00 43.42 43.93 2k39 n LEU 8 CO 0.54 0.00 0.55 0.35 -1.51 0.00 0.00 177.39 177.32 2k39 n THR 9 N -1.38 1.83 0.00 -5.08 -2.24 -1.26 -4.86 114.28 101.30 2k39 n THR 9 Ca 0.00 0.48 0.00 0.00 -2.27 0.00 0.00 64.05 62.26 2k39 n THR 9 Cb 0.00 -1.45 0.00 0.00 -2.10 0.00 0.00 70.33 66.78 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 -1.31 0.63 3.60 3.38 0.00 0.36 -5.05 105.19 106.81 2k39 n GLY 10 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.62 3.28 -0.11 1.61 2.20 -1.20 -4.62 119.74 120.27 2k39 s LYS 11 Ca 0.00 1.86 -0.08 0.00 -0.36 0.00 0.00 55.97 57.38 2k39 s LYS 11 Cb 0.00 -4.29 -0.04 0.00 -1.51 0.00 0.00 37.83 31.99 2k39 s LYS 11 CO 0.00 -1.93 0.18 0.99 -0.36 0.00 0.00 175.35 174.22 2k39 s THR 12 N 7.53 5.44 0.00 3.43 2.01 -1.26 -1.65 115.64 131.13 2k39 s THR 12 Ca 0.92 0.30 0.07 0.00 0.31 0.00 0.00 61.69 63.29 2k39 s THR 12 Cb -0.30 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 68.74 2k39 s THR 12 CO 0.35 0.60 -0.22 -0.63 -0.69 0.00 0.00 174.62 174.03 2k39 s ILE 13 N -0.93 1.75 -0.47 1.82 1.01 0.21 -5.00 121.20 119.59 2k39 s ILE 13 Ca 0.16 -1.03 -0.16 0.00 0.00 0.00 0.00 60.65 59.61 2k39 s ILE 13 Cb -0.13 -1.47 0.06 0.00 0.01 0.00 0.00 42.46 40.94 2k39 s ILE 13 CO 0.05 0.41 0.44 -0.89 0.00 0.00 0.00 174.94 174.96 2k39 s THR 14 N -0.60 5.15 -0.16 2.92 2.01 -1.26 -0.47 115.64 123.23 2k39 s THR 14 Ca 0.08 -0.87 -0.10 0.00 0.31 0.00 0.00 61.69 61.12 2k39 s THR 14 Cb -0.09 -4.15 -0.05 0.00 0.01 0.00 0.00 72.50 68.23 2k39 s THR 14 CO -0.00 -0.60 0.17 -0.22 -0.69 0.00 0.00 174.62 173.28 2k39 s LEU 15 N 1.90 4.28 0.16 4.42 2.96 0.08 -4.94 118.68 127.54 2k39 s LEU 15 Ca 0.07 0.38 -0.21 0.00 -0.22 0.00 0.00 54.13 54.15 2k39 s LEU 15 Cb -0.22 -2.15 -0.08 0.00 0.50 0.00 0.00 46.19 44.24 2k39 s LEU 15 CO 0.08 0.25 0.69 -0.70 -1.32 0.00 0.00 176.35 175.35 2k39 s GLU 16 N -0.13 4.35 0.34 1.98 2.12 -1.26 -0.12 118.70 125.98 2k39 s GLU 16 Ca 0.12 0.93 0.02 0.00 0.36 0.00 0.00 54.97 56.40 2k39 s GLU 16 Cb -0.12 -3.13 -0.01 0.00 0.26 0.00 0.00 34.13 31.13 2k39 s GLU 16 CO 0.02 0.53 0.39 0.14 -0.54 0.00 0.00 175.26 175.80 2k39 s VAL 17 N -1.26 0.00 0.14 3.70 -7.23 -0.54 -4.94 120.40 110.26 2k39 s VAL 17 Ca 0.36 -1.79 0.05 0.00 -1.81 0.00 0.00 61.98 58.80 2k39 s VAL 17 Cb -0.20 -2.59 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 2k39 s VAL 17 CO 0.22 0.00 0.06 -1.61 -0.31 0.00 0.00 175.10 173.46 2k39 s GLU 18 N -3.19 2.68 0.43 4.82 0.41 -1.26 -3.52 118.70 119.07 2k39 s GLU 18 Ca 0.35 -0.90 0.22 0.00 -0.41 0.00 0.00 54.97 54.23 2k39 s GLU 18 Cb 0.01 -2.55 0.90 0.00 -1.78 0.00 0.00 34.13 30.71 2k39 s GLU 18 CO 0.24 0.50 1.83 -1.00 -0.49 0.00 0.00 175.26 176.34 2k39 h PRO 19 N 2.86 0.00 0.00 0.39 0.13 -1.97 -2.61 132.00 130.79 2k39 h PRO 19 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2k39 h PRO 19 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k39 h PRO 19 CO 0.61 0.27 0.00 -1.13 -0.23 0.00 0.00 178.00 177.53 2k39 n SER 20 N -3.52 0.00 -4.80 1.44 3.41 -1.26 -0.92 113.62 107.97 2k39 n SER 20 Ca -0.00 -0.76 -0.34 0.00 -0.26 0.00 0.00 58.87 57.50 2k39 n SER 20 Cb 0.43 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.29 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 -2.08 6.71 -0.00 4.04 2.15 -0.99 -4.90 116.67 121.61 2k39 s ASP 21 Ca 0.40 1.85 0.02 0.00 0.43 0.00 0.00 52.55 55.24 2k39 s ASP 21 Cb 0.19 -2.56 -0.03 0.00 -0.30 0.00 0.00 42.92 40.22 2k39 s ASP 21 CO 0.34 -0.52 -0.03 0.28 -0.17 0.00 0.00 175.17 175.07 2k39 s THR 22 N -1.98 3.94 0.52 1.71 -1.32 -1.26 -2.45 115.64 114.80 2k39 s THR 22 Ca 0.62 -0.66 0.26 0.00 -1.21 0.00 0.00 61.69 60.70 2k39 s THR 22 Cb -0.15 -2.73 0.41 0.00 -1.51 0.00 0.00 72.50 68.52 2k39 s THR 22 CO 0.19 0.39 1.97 0.40 -2.21 0.00 0.00 174.62 175.36 2k39 h ILE 23 N 3.65 0.71 -0.25 5.08 1.08 -1.64 -0.13 117.51 126.01 2k39 h ILE 23 Ca -0.49 -0.01 -0.07 0.00 -0.39 0.00 0.00 64.86 63.90 2k39 h ILE 23 Cb 1.17 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 35.59 2k39 h ILE 23 CO 0.56 0.01 -0.16 -0.08 -0.69 0.00 0.00 178.15 177.78 2k39 h GLU 24 N 0.03 0.42 0.00 2.37 4.81 -1.92 -2.47 114.58 117.82 2k39 h GLU 24 Ca 0.29 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2k39 h GLU 24 Cb 1.12 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.45 2k39 h GLU 24 CO -0.01 0.58 -0.05 -0.97 -0.73 0.00 0.00 179.01 177.82 2k39 h ASN 25 N 0.39 0.00 0.01 1.04 -1.24 -1.43 0.69 115.58 115.04 2k39 h ASN 25 Ca 0.07 -0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.07 2k39 h ASN 25 Cb 0.51 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.56 2k39 h ASN 25 CO 0.03 0.01 -0.01 0.58 -1.29 0.00 0.00 177.43 176.75 2k39 h VAL 26 N 0.00 1.14 -0.76 2.57 2.07 -1.38 -3.23 116.25 116.66 2k39 h VAL 26 Ca 0.00 -1.80 -0.00 0.00 0.82 0.00 0.00 66.70 65.72 2k39 h VAL 26 Cb 0.82 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.69 2k39 h VAL 26 CO 0.00 0.38 0.46 0.11 0.02 0.00 0.00 177.57 178.54 2k39 h LYS 27 N -0.98 1.02 0.00 1.57 1.57 -1.41 -2.27 116.57 116.07 2k39 h LYS 27 Ca -0.00 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2k39 h LYS 27 Cb 0.63 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2k39 h LYS 27 CO 0.00 0.71 0.00 0.00 -0.57 0.00 0.00 179.45 179.60 2k39 n ALA 28 N -2.42 2.10 -0.02 3.86 0.00 0.23 -2.16 120.51 122.11 2k39 n ALA 28 Ca 0.08 -0.08 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2k39 n ALA 28 Cb 0.06 -1.39 -0.14 0.00 0.00 0.00 0.00 19.45 17.98 2k39 n ALA 28 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2k39 n LYS 29 N -1.51 0.72 -0.23 0.00 4.81 -0.89 -3.33 118.16 117.73 2k39 n LYS 29 Ca 0.06 0.25 -0.08 0.00 -0.87 0.00 0.00 58.31 57.67 2k39 n LYS 29 Cb 0.28 -1.71 0.03 0.00 0.02 0.00 0.00 35.03 33.66 2k39 n LYS 29 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 2k39 h ILE 30 N 0.05 1.26 -0.54 3.15 2.04 -1.42 -0.88 117.51 121.17 2k39 h ILE 30 Ca -0.40 -1.08 0.10 0.00 1.00 0.00 0.00 64.86 64.47 2k39 h ILE 30 Cb 2.03 0.69 -0.08 0.00 -0.74 0.00 0.00 36.82 38.72 2k39 h ILE 30 CO 0.07 0.40 0.09 -0.61 0.00 0.00 0.00 178.15 178.10 2k39 h GLN 31 N 1.01 0.21 -0.56 2.37 4.15 -1.50 0.84 115.11 121.63 2k39 h GLN 31 Ca 0.19 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.52 2k39 h GLN 31 Cb 0.48 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2k39 h GLN 31 CO 0.02 0.14 0.06 0.22 -1.93 0.00 0.00 178.83 177.34 2k39 h ASP 32 N 0.22 0.92 0.35 -0.69 1.82 -1.45 0.00 116.42 117.59 2k39 h ASP 32 Ca 0.27 -0.28 -0.27 0.00 -0.39 0.00 0.00 57.03 56.36 2k39 h ASP 32 Cb 0.39 -0.25 0.01 0.00 0.68 0.00 0.00 39.33 40.17 2k39 h ASP 32 CO -0.37 0.97 -1.17 0.11 -1.61 0.00 0.00 179.24 177.17 2k39 h LYS 33 N 0.84 0.45 0.00 0.28 1.79 -1.12 -3.43 116.57 115.38 2k39 h LYS 33 Ca 0.17 -0.61 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 2k39 h LYS 33 Cb 0.46 0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 2k39 h LYS 33 CO 0.02 1.25 -0.78 0.39 -1.08 0.00 0.00 179.45 179.25 2k39 n GLU 34 N -3.70 1.96 0.00 3.15 -0.58 0.27 -5.07 120.64 116.68 2k39 n GLU 34 Ca -0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 2k39 n GLU 34 Cb 0.96 -0.89 0.00 0.00 -0.57 0.00 0.00 31.44 30.94 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 2.68 1.03 3.20 0.62 0.00 -0.01 -4.98 105.19 107.72 2k39 n GLY 35 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 1.71 0.20 -0.61 1.01 -1.26 -4.98 121.20 115.26 2k39 s ILE 36 Ca 0.00 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.48 2k39 s ILE 36 Cb 0.00 -1.45 -0.08 0.00 0.01 0.00 0.00 42.46 40.94 2k39 s ILE 36 CO 0.00 0.48 1.05 -2.16 0.00 0.00 0.00 174.94 174.31 2k39 s PRO 37 N -0.09 4.67 0.55 2.79 0.04 -1.26 -3.74 135.00 137.95 2k39 s PRO 37 Ca -0.03 1.65 0.42 0.00 0.04 0.00 0.00 61.00 63.08 2k39 s PRO 37 Cb -0.12 -3.28 1.62 0.00 0.04 0.00 0.00 34.50 32.76 2k39 s PRO 37 CO 0.03 0.21 1.71 -1.35 0.04 0.00 0.00 177.00 177.63 2k39 h PRO 38 N 4.77 0.01 0.00 0.56 0.11 -1.95 -2.13 132.00 133.38 2k39 h PRO 38 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 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 0.70 0.01 -0.28 -0.40 -0.21 0.00 0.00 178.00 177.82 2k39 n ASP 39 N -4.10 0.34 -0.60 -2.05 5.75 -1.26 -2.20 116.55 112.43 2k39 n ASP 39 Ca 0.33 0.14 0.12 0.00 -0.01 0.00 0.00 54.79 55.37 2k39 n ASP 39 Cb 1.55 -0.13 0.10 0.00 -1.03 0.00 0.00 41.12 41.61 2k39 n ASP 39 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 2k39 n GLN 40 N -1.62 1.51 -4.36 0.11 7.27 -0.80 -4.90 117.38 114.60 2k39 n GLN 40 Ca 0.06 -1.20 -0.34 0.00 0.07 0.00 0.00 57.00 55.59 2k39 n GLN 40 Cb 0.35 -1.48 -0.11 0.00 2.41 0.00 0.00 30.24 31.42 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 -2.32 3.50 -0.13 3.69 -0.21 -0.94 -0.12 119.66 123.13 2k39 s GLN 41 Ca 0.23 -0.47 -0.00 0.00 0.02 0.00 0.00 55.36 55.14 2k39 s GLN 41 Cb 0.19 -2.91 -0.02 0.00 1.00 0.00 0.00 33.01 31.28 2k39 s GLN 41 CO 0.48 0.38 -0.13 1.03 -2.12 0.00 0.00 175.29 174.93 2k39 s ARG 42 N 0.00 3.39 -0.27 2.91 0.52 0.12 -4.85 118.95 120.78 2k39 s ARG 42 Ca 0.02 -0.68 -0.10 0.00 -0.52 0.00 0.00 55.73 54.45 2k39 s ARG 42 Cb -0.13 -2.64 -0.05 0.00 0.52 0.00 0.00 34.95 32.65 2k39 s ARG 42 CO 0.02 0.21 0.16 -0.51 0.02 0.00 0.00 175.30 175.21 2k39 s LEU 43 N 0.35 3.90 -0.16 2.53 1.43 -1.26 -1.07 118.68 124.40 2k39 s LEU 43 Ca -0.11 -0.04 -0.12 0.00 -1.03 0.00 0.00 54.13 52.83 2k39 s LEU 43 Cb -0.16 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 2k39 s LEU 43 CO 0.06 -0.03 0.23 -0.63 0.23 0.00 0.00 176.35 176.20 2k39 s ILE 44 N 1.65 5.34 -0.09 -0.59 -1.09 -0.07 -2.61 121.20 123.74 2k39 s ILE 44 Ca 0.07 0.42 0.01 0.00 -2.23 0.00 0.00 60.65 58.91 2k39 s ILE 44 Cb -0.16 -3.56 -0.03 0.00 -1.58 0.00 0.00 42.46 37.14 2k39 s ILE 44 CO 0.09 0.44 -0.09 0.12 -1.23 0.00 0.00 174.94 174.26 2k39 s PHE 45 N 0.20 2.87 0.00 3.97 2.19 -0.79 -1.41 117.98 125.01 2k39 s PHE 45 Ca 0.14 -0.21 0.00 0.00 0.33 0.00 0.00 56.93 57.19 2k39 s PHE 45 Cb -0.12 -1.76 0.00 0.00 -1.31 0.00 0.00 43.02 39.83 2k39 s PHE 45 CO 0.02 0.13 0.00 0.00 1.83 0.00 0.00 175.22 177.20 2k39 n ALA 46 N 2.71 0.00 -1.93 11.12 0.00 -1.26 -0.16 120.51 131.00 2k39 n ALA 46 Ca -0.18 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.30 2k39 n ALA 46 Cb 0.53 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.05 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 0.00 2.28 3.52 0.00 0.00 -1.26 -5.06 105.19 104.67 2k39 n GLY 47 Ca 0.00 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.88 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 -1.10 3.32 -0.77 1.61 1.02 0.78 -5.00 119.74 119.60 2k39 s LYS 48 Ca 0.24 -0.43 -0.26 0.00 0.02 0.00 0.00 55.97 55.53 2k39 s LYS 48 Cb 0.24 -3.92 0.01 0.00 -0.52 0.00 0.00 37.83 33.65 2k39 s LYS 48 CO -0.06 -0.86 1.54 -0.65 -0.92 0.00 0.00 175.35 174.39 2k39 s GLN 49 N 2.50 3.04 0.13 1.68 -0.21 -1.26 -1.88 119.66 123.66 2k39 s GLN 49 Ca 0.18 -0.17 -0.31 0.00 0.02 0.00 0.00 55.36 55.08 2k39 s GLN 49 Cb -0.15 -4.54 -0.10 0.00 1.00 0.00 0.00 33.01 29.22 2k39 s GLN 49 CO 0.16 -2.45 1.63 -0.51 -2.12 0.00 0.00 175.29 172.00 2k39 s LEU 50 N 6.96 4.37 -0.16 2.90 1.43 -1.07 -4.98 118.68 128.13 2k39 s LEU 50 Ca 0.49 2.60 -0.06 0.00 -1.03 0.00 0.00 54.13 56.14 2k39 s LEU 50 Cb -0.08 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.52 2k39 s LEU 50 CO 0.10 -0.87 0.04 -0.70 0.23 0.00 0.00 176.35 175.15 2k39 s GLU 51 N 1.79 3.75 0.05 1.70 2.12 -1.26 -4.77 118.70 122.08 2k39 s GLU 51 Ca 0.73 -0.37 -0.30 0.00 0.36 0.00 0.00 54.97 55.39 2k39 s GLU 51 Cb -0.43 -3.10 -0.08 0.00 0.26 0.00 0.00 34.13 30.77 2k39 s GLU 51 CO 0.32 0.37 1.75 -0.51 -0.54 0.00 0.00 175.26 176.64 2k39 s ASP 52 N 0.09 6.56 0.00 -1.70 1.11 -1.26 -2.91 116.67 118.55 2k39 s ASP 52 Ca 0.04 2.52 0.00 0.00 0.18 0.00 0.00 52.55 55.29 2k39 s ASP 52 Cb -0.12 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.31 2k39 s ASP 52 CO 0.01 -0.95 0.00 0.61 1.18 0.00 0.00 175.17 176.02 2k39 n GLY 53 N 4.17 1.09 3.63 0.21 0.00 -1.26 -4.98 105.19 108.05 2k39 n GLY 53 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.21 1.99 0.49 1.61 0.52 -1.15 -5.01 118.95 117.19 2k39 s ARG 54 Ca 0.00 -2.19 0.04 0.00 -0.52 0.00 0.00 55.73 53.07 2k39 s ARG 54 Cb 0.00 -1.39 -0.01 0.00 0.52 0.00 0.00 34.95 34.07 2k39 s ARG 54 CO 0.00 -0.22 0.17 0.95 0.02 0.00 0.00 175.30 176.22 2k39 s THR 55 N -2.90 1.67 0.20 0.02 -4.23 -1.26 -1.77 115.64 107.37 2k39 s THR 55 Ca 0.24 -1.77 0.08 0.00 -1.18 0.00 0.00 61.69 59.07 2k39 s THR 55 Cb 0.06 -2.44 -0.11 0.00 1.34 0.00 0.00 72.50 71.36 2k39 s THR 55 CO 0.12 0.00 1.46 -0.07 -0.54 0.00 0.00 174.62 175.60 2k39 h LEU 56 N 1.22 0.03 -1.39 4.79 3.38 -1.24 -3.14 115.31 118.96 2k39 h LEU 56 Ca -0.42 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.56 2k39 h LEU 56 Cb 1.29 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.99 2k39 h LEU 56 CO 0.69 0.80 0.44 -1.28 0.09 0.00 0.00 178.44 179.18 2k39 h SER 57 N 0.01 0.69 -0.31 -0.43 0.87 -1.28 -1.77 113.55 111.33 2k39 h SER 57 Ca -0.01 -0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.41 2k39 h SER 57 Cb 1.39 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2k39 h SER 57 CO 0.10 0.48 -0.32 0.44 -0.53 0.00 0.00 176.83 177.00 2k39 h ASP 58 N 0.81 0.81 -0.18 6.23 3.32 -1.83 -1.54 116.42 124.04 2k39 h ASP 58 Ca 0.26 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.84 2k39 h ASP 58 Cb 0.05 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.37 2k39 h ASP 58 CO -0.07 1.12 0.00 -1.22 -1.72 0.00 0.00 179.24 177.35 2k39 n TYR 59 N -4.21 0.27 -3.10 4.55 4.01 -1.13 -4.94 117.16 112.61 2k39 n TYR 59 Ca -0.04 -0.13 -0.23 0.00 -0.16 0.00 0.00 57.90 57.35 2k39 n TYR 59 Cb 0.49 -0.02 0.04 0.00 -0.31 0.00 0.00 39.34 39.54 2k39 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2k39 n ASN 60 N 0.04 -5.96 -4.82 7.72 3.02 -0.58 -4.97 115.26 109.71 2k39 n ASN 60 Ca 0.06 -0.32 -0.37 0.00 -0.03 0.00 0.00 54.58 53.92 2k39 n ASN 60 Cb 0.18 -4.81 -0.06 0.00 -0.61 0.00 0.00 39.78 34.48 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2k39 s ILE 61 N -3.17 4.74 0.00 2.41 1.01 -0.71 -5.02 121.20 120.45 2k39 s ILE 61 Ca 0.34 1.10 0.00 0.00 0.00 0.00 0.00 60.65 62.09 2k39 s ILE 61 Cb -0.15 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.48 2k39 s ILE 61 CO 0.42 0.37 0.00 0.00 0.00 0.00 0.00 174.94 175.72 2k39 n GLN 62 N 1.17 0.33 -1.77 2.79 0.00 -1.26 -4.61 117.38 114.03 2k39 n GLN 62 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 57.00 56.52 2k39 n GLN 62 Cb 0.51 0.00 -0.02 0.00 0.00 0.00 0.00 30.24 30.73 2k39 n GLN 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 2k39 s LYS 63 N -0.87 4.13 0.00 2.61 2.20 -1.26 -3.03 119.74 123.53 2k39 s LYS 63 Ca 0.00 2.57 0.00 0.00 -0.36 0.00 0.00 55.97 58.18 2k39 s LYS 63 Cb 0.00 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.25 2k39 s LYS 63 CO 0.00 -0.69 0.00 -1.91 -0.36 0.00 0.00 175.35 172.39 2k39 n GLU 64 N 3.34 0.00 -2.88 4.03 4.07 -1.26 -5.05 120.64 122.90 2k39 n GLU 64 Ca 0.13 0.24 -0.41 0.00 -0.06 0.00 0.00 57.16 57.06 2k39 n GLU 64 Cb 0.36 -2.53 -0.04 0.00 -0.06 0.00 0.00 31.44 29.18 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 2k39 s SER 65 N -2.48 7.11 -0.30 4.31 1.04 -1.17 -4.98 113.70 117.22 2k39 s SER 65 Ca 0.00 1.35 -0.08 0.00 0.48 0.00 0.00 55.95 57.70 2k39 s SER 65 Cb 0.00 -2.48 0.01 0.00 0.10 0.00 0.00 66.02 63.65 2k39 s SER 65 CO 0.00 -0.26 0.11 -0.89 0.98 0.00 0.00 173.24 173.18 2k39 s THR 66 N 1.31 4.16 -0.20 2.02 2.01 -1.26 -1.26 115.64 122.43 2k39 s THR 66 Ca 0.43 -0.64 -0.10 0.00 0.31 0.00 0.00 61.69 61.69 2k39 s THR 66 Cb -0.18 -3.15 -0.05 0.00 0.01 0.00 0.00 72.50 69.12 2k39 s THR 66 CO 0.19 0.05 0.12 -0.76 -0.69 0.00 0.00 174.62 173.54 2k39 s LEU 67 N 1.53 4.16 -0.20 4.42 1.02 -0.09 -4.67 118.68 124.85 2k39 s LEU 67 Ca 0.03 0.22 -0.09 0.00 0.02 0.00 0.00 54.13 54.31 2k39 s LEU 67 Cb -0.17 -2.07 -0.04 0.00 0.02 0.00 0.00 46.19 43.92 2k39 s LEU 67 CO 0.04 0.19 0.10 -2.28 0.02 0.00 0.00 176.35 174.41 2k39 s HIS 68 N 0.32 3.28 0.19 0.29 2.46 -0.50 -2.78 115.29 118.56 2k39 s HIS 68 Ca 0.08 0.12 -0.06 0.00 0.47 0.00 0.00 55.06 55.66 2k39 s HIS 68 Cb -0.11 -2.15 -0.06 0.00 -0.13 0.00 0.00 32.58 30.13 2k39 s HIS 68 CO -0.02 0.12 0.45 -1.17 -2.47 0.00 0.00 174.74 171.65 2k39 s LEU 69 N 0.63 4.21 -0.01 8.88 2.96 -1.22 -0.89 118.68 133.23 2k39 s LEU 69 Ca 0.05 0.70 -0.02 0.00 -0.22 0.00 0.00 54.13 54.65 2k39 s LEU 69 Cb -0.13 -3.45 0.00 0.00 0.50 0.00 0.00 46.19 43.11 2k39 s LEU 69 CO 0.01 -0.02 0.04 0.54 -1.32 0.00 0.00 176.35 175.60 2k39 s VAL 70 N -1.77 0.02 0.56 1.68 0.11 -0.23 -4.61 120.40 116.16 2k39 s VAL 70 Ca 0.43 -0.14 -0.16 0.00 -2.93 0.00 0.00 61.98 59.19 2k39 s VAL 70 Cb -0.12 -0.11 -0.06 0.00 -1.53 0.00 0.00 36.38 34.56 2k39 s VAL 70 CO 0.24 -0.08 1.02 -0.76 -3.33 0.00 0.00 175.10 172.20 2k39 s LEU 71 N -0.21 3.54 -0.30 2.54 1.43 -1.26 -0.70 118.68 123.71 2k39 s LEU 71 Ca -0.03 1.67 -0.14 0.00 -1.03 0.00 0.00 54.13 54.61 2k39 s LEU 71 Cb -0.02 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.66 2k39 s LEU 71 CO 0.00 -0.87 0.32 -0.60 0.23 0.00 0.00 176.35 175.43 2k39 s ARG 72 N -4.15 3.80 0.00 1.70 3.52 0.83 -4.73 118.95 119.92 2k39 s ARG 72 Ca 0.61 -0.26 0.00 0.00 -0.13 0.00 0.00 55.73 55.95 2k39 s ARG 72 Cb -0.13 -3.72 0.00 0.00 -1.56 0.00 0.00 34.95 29.54 2k39 s ARG 72 CO 0.35 -0.36 0.05 1.28 -0.81 0.00 0.00 175.30 175.82 2k39 n LEU 73 N 5.27 0.10 -3.70 -0.88 4.77 -1.26 -4.83 117.00 116.47 2k39 n LEU 73 Ca -0.10 -0.15 -0.12 0.00 -0.03 0.00 0.00 56.01 55.60 2k39 n LEU 73 Cb 0.50 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 2k39 n LEU 73 CO 0.37 0.03 0.14 -0.60 -1.33 0.00 0.00 177.39 176.00 2k39 s ARG 74 N -0.11 0.52 0.00 3.23 3.52 -1.26 -5.16 118.95 119.69 2k39 s ARG 74 Ca 0.00 0.74 0.00 0.00 -0.13 0.00 0.00 55.73 56.34 2k39 s ARG 74 Cb 0.00 0.18 0.00 0.00 -1.56 0.00 0.00 34.95 33.57 2k39 s ARG 74 CO 0.00 -0.10 0.00 0.41 -0.81 0.00 0.00 175.30 174.80 2k39 n GLY 75 N 3.32 0.35 0.66 8.12 0.00 -1.26 -5.26 105.19 111.12 2k39 n GLY 75 Ca -0.17 -2.26 0.08 0.00 0.00 0.00 0.00 46.02 43.67 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93