#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 0.02 3.17 1.11 -1.26 -0.64 119.66 125.35 2k39 s GLN 2 Ca 0.00 -0.26 0.03 0.00 0.01 0.00 0.00 55.36 55.15 2k39 s GLN 2 Cb 0.00 -3.05 -0.02 0.00 -1.01 0.00 0.00 33.01 28.93 2k39 s GLN 2 CO 0.00 0.74 -0.10 0.96 0.01 0.00 0.00 175.29 176.90 2k39 s ILE 3 N -1.05 0.74 0.01 1.08 -4.36 -1.04 -0.78 121.20 115.81 2k39 s ILE 3 Ca 0.17 -0.75 -0.13 0.00 -0.26 0.00 0.00 60.65 59.68 2k39 s ILE 3 Cb -0.12 -0.69 -0.06 0.00 1.25 0.00 0.00 42.46 42.84 2k39 s ILE 3 CO 0.06 -0.04 0.39 -0.36 0.24 0.00 0.00 174.94 175.24 2k39 s PHE 4 N -0.72 3.69 -0.15 1.37 0.08 -0.04 -1.76 117.98 120.46 2k39 s PHE 4 Ca -0.01 0.93 0.02 0.00 0.12 0.00 0.00 56.93 57.98 2k39 s PHE 4 Cb -0.06 -2.24 0.02 0.00 -0.57 0.00 0.00 43.02 40.16 2k39 s PHE 4 CO 0.00 0.62 -0.20 0.08 -0.10 0.00 0.00 175.22 175.63 2k39 s VAL 5 N -1.14 1.95 -0.18 -0.44 1.01 -0.11 -0.86 120.40 120.63 2k39 s VAL 5 Ca 0.25 -0.90 -0.21 0.00 0.00 0.00 0.00 61.98 61.13 2k39 s VAL 5 Cb -0.16 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2k39 s VAL 5 CO 0.14 0.53 0.62 -0.54 0.00 0.00 0.00 175.10 175.85 2k39 s LYS 6 N 1.08 4.24 0.00 2.72 1.02 -0.10 -1.66 119.74 127.03 2k39 s LYS 6 Ca -0.01 0.62 0.00 0.00 0.02 0.00 0.00 55.97 56.60 2k39 s LYS 6 Cb -0.14 -3.56 0.00 0.00 -0.52 0.00 0.00 37.83 33.61 2k39 s LYS 6 CO -0.07 -0.18 0.00 0.25 -0.92 0.00 0.00 175.35 174.43 2k39 n THR 7 N 4.54 0.00 -0.48 2.17 -2.24 -0.82 -1.19 114.28 116.26 2k39 n THR 7 Ca -0.02 0.00 0.39 0.00 -2.27 0.00 0.00 64.05 62.15 2k39 n THR 7 Cb 0.50 -1.02 0.69 0.00 -2.10 0.00 0.00 70.33 68.40 2k39 n THR 7 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2k39 h LEU 8 N 0.00 0.17 -0.75 3.22 4.07 -1.89 0.18 115.31 120.31 2k39 h LEU 8 Ca 0.00 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2k39 h LEU 8 Cb 0.00 0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.80 2k39 h LEU 8 CO 0.00 -0.08 -0.23 0.35 -1.08 0.00 0.00 178.44 177.39 2k39 n THR 9 N -4.42 0.00 -0.23 0.22 -2.24 -1.26 -5.01 114.28 101.34 2k39 n THR 9 Ca 0.36 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2k39 n THR 9 Cb 1.49 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 70.85 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 0.94 0.68 3.70 3.38 0.00 0.64 -5.04 105.19 109.49 2k39 n GLY 10 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.72 4.19 -0.08 1.61 2.20 -1.26 -4.63 119.74 121.05 2k39 s LYS 11 Ca 0.00 2.40 -0.19 0.00 -0.36 0.00 0.00 55.97 57.82 2k39 s LYS 11 Cb 0.00 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.90 2k39 s LYS 11 CO 0.00 -0.70 0.52 0.99 -0.36 0.00 0.00 175.35 175.80 2k39 s THR 12 N 1.94 5.10 -0.06 3.43 2.01 -1.26 -1.95 115.64 124.85 2k39 s THR 12 Ca 0.73 1.06 0.05 0.00 0.31 0.00 0.00 61.69 63.84 2k39 s THR 12 Cb -0.43 -3.86 -0.02 0.00 0.01 0.00 0.00 72.50 68.21 2k39 s THR 12 CO 0.32 0.36 -0.20 0.27 -0.69 0.00 0.00 174.62 174.68 2k39 s ILE 13 N 0.32 2.48 -0.41 1.82 -4.36 -0.67 -4.96 121.20 115.43 2k39 s ILE 13 Ca 0.28 -0.91 -0.22 0.00 -0.26 0.00 0.00 60.65 59.53 2k39 s ILE 13 Cb -0.16 -1.94 0.02 0.00 1.25 0.00 0.00 42.46 41.62 2k39 s ILE 13 CO 0.13 0.57 0.75 -0.89 0.24 0.00 0.00 174.94 175.74 2k39 s THR 14 N -0.27 4.73 -0.19 8.37 2.01 -1.26 -0.94 115.64 128.09 2k39 s THR 14 Ca 0.00 0.56 -0.08 0.00 0.31 0.00 0.00 61.69 62.48 2k39 s THR 14 Cb -0.13 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 2k39 s THR 14 CO 0.03 -0.56 0.08 -0.76 -0.69 0.00 0.00 174.62 172.71 2k39 s LEU 15 N 3.10 3.88 0.05 4.42 2.01 -0.72 -5.00 118.68 126.42 2k39 s LEU 15 Ca 0.29 0.09 -0.27 0.00 0.01 0.00 0.00 54.13 54.25 2k39 s LEU 15 Cb -0.13 -1.99 -0.05 0.00 0.01 0.00 0.00 46.19 44.03 2k39 s LEU 15 CO 0.19 0.16 0.84 -0.70 1.01 0.00 0.00 176.35 177.86 2k39 s GLU 16 N 0.45 4.56 0.21 1.70 2.12 -1.26 -2.50 118.70 123.98 2k39 s GLU 16 Ca 0.04 1.21 -0.06 0.00 0.36 0.00 0.00 54.97 56.52 2k39 s GLU 16 Cb -0.12 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.86 2k39 s GLU 16 CO 0.00 0.21 0.26 0.14 -0.54 0.00 0.00 175.26 175.33 2k39 s VAL 17 N 0.15 0.02 0.16 3.70 -7.23 0.19 -4.97 120.40 112.41 2k39 s VAL 17 Ca 0.42 -1.72 0.07 0.00 -1.81 0.00 0.00 61.98 58.94 2k39 s VAL 17 Cb -0.21 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 2k39 s VAL 17 CO 0.25 -0.07 -0.14 -1.61 -0.31 0.00 0.00 175.10 173.22 2k39 s GLU 18 N -4.08 1.17 0.00 4.82 0.41 -1.26 0.40 118.70 120.16 2k39 s GLU 18 Ca 0.30 -1.43 0.14 0.00 -0.41 0.00 0.00 54.97 53.57 2k39 s GLU 18 Cb 0.04 -0.98 0.69 0.00 -1.78 0.00 0.00 34.13 32.10 2k39 s GLU 18 CO 0.09 0.17 1.40 -0.35 -0.49 0.00 0.00 175.26 176.08 2k39 n PRO 19 N 0.04 0.15 0.05 0.39 -0.04 -1.26 -1.09 135.00 133.24 2k39 n PRO 19 Ca -0.11 0.18 0.12 0.00 -0.04 0.00 0.00 63.50 63.65 2k39 n PRO 19 Cb 0.59 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.82 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 -1.34 0.61 -4.72 3.54 3.41 -1.26 -4.80 113.62 109.06 2k39 n SER 20 Ca 0.06 0.17 -0.42 0.00 -0.26 0.00 0.00 58.87 58.42 2k39 n SER 20 Cb 0.13 -0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 63.98 2k39 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2k39 s ASP 21 N -3.91 6.85 0.57 4.04 1.01 -0.25 -5.00 116.67 119.98 2k39 s ASP 21 Ca 0.09 2.35 -0.01 0.00 0.71 0.00 0.00 52.55 55.69 2k39 s ASP 21 Cb 0.15 -2.60 0.03 0.00 1.01 0.00 0.00 42.92 41.51 2k39 s ASP 21 CO 0.67 -0.60 0.82 0.42 0.21 0.00 0.00 175.17 176.69 2k39 s THR 22 N 0.71 2.77 -0.23 -1.27 -4.23 -1.26 -3.85 115.64 108.28 2k39 s THR 22 Ca 0.61 -0.54 0.28 0.00 -1.18 0.00 0.00 61.69 60.87 2k39 s THR 22 Cb -0.37 -3.07 0.33 0.00 1.34 0.00 0.00 72.50 70.73 2k39 s THR 22 CO 0.33 -0.05 1.83 0.40 -0.54 0.00 0.00 174.62 176.59 2k39 h ILE 23 N -0.04 0.00 -0.24 2.99 5.03 -1.80 0.05 117.51 123.50 2k39 h ILE 23 Ca -0.43 -0.47 -0.01 0.00 -0.12 0.00 0.00 64.86 63.82 2k39 h ILE 23 Cb 1.29 1.39 -0.01 0.00 -3.03 0.00 0.00 36.82 36.46 2k39 h ILE 23 CO 0.55 0.00 0.11 -0.08 -0.68 0.00 0.00 178.15 178.05 2k39 h GLU 24 N 0.00 0.36 0.00 2.37 4.81 -1.93 -1.54 114.58 118.65 2k39 h GLU 24 Ca 0.00 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.11 2k39 h GLU 24 Cb 0.54 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2k39 h GLU 24 CO 0.00 0.38 -0.31 -0.91 -0.73 0.00 0.00 179.01 177.44 2k39 h ASN 25 N 0.25 0.00 0.35 1.04 2.35 -1.51 -3.18 115.58 114.88 2k39 h ASN 25 Ca 0.08 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.51 2k39 h ASN 25 Cb 0.14 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.48 2k39 h ASN 25 CO -0.01 0.31 -1.83 0.52 -1.65 0.00 0.00 177.43 174.77 2k39 n VAL 26 N -3.61 1.67 -0.32 2.81 0.31 -0.15 -3.17 118.33 115.87 2k39 n VAL 26 Ca -0.01 -0.75 0.16 0.00 -0.01 0.00 0.00 64.34 63.74 2k39 n VAL 26 Cb 0.43 -1.28 0.33 0.00 -0.91 0.00 0.00 33.84 32.42 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 0.03 0.11 0.00 5.55 1.57 -1.34 -0.84 116.57 121.64 2k39 h LYS 27 Ca -0.34 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2k39 h LYS 27 Cb 2.03 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.31 2k39 h LYS 27 CO 0.08 0.07 0.00 0.00 -0.57 0.00 0.00 179.45 179.03 2k39 h ALA 28 N 1.88 1.00 0.00 3.86 0.00 -1.57 -3.09 119.26 121.33 2k39 h ALA 28 Ca 0.61 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.45 2k39 h ALA 28 Cb 1.31 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2k39 h ALA 28 CO -0.76 0.00 -1.23 1.63 0.00 0.00 0.00 179.25 178.89 2k39 n LYS 29 N -2.68 0.61 -0.11 0.00 5.02 -0.40 -3.46 118.16 117.14 2k39 n LYS 29 Ca 0.04 0.15 -0.08 0.00 -2.02 0.00 0.00 58.31 56.41 2k39 n LYS 29 Cb 0.46 -1.80 0.08 0.00 -0.02 0.00 0.00 35.03 33.75 2k39 n LYS 29 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2k39 h ILE 30 N 0.00 1.27 -0.85 -0.18 2.04 -1.36 -1.04 117.51 117.38 2k39 h ILE 30 Ca -0.07 -1.27 0.16 0.00 1.00 0.00 0.00 64.86 64.68 2k39 h ILE 30 Cb 1.25 1.10 -0.10 0.00 -0.74 0.00 0.00 36.82 38.33 2k39 h ILE 30 CO 0.02 0.43 0.41 -0.61 0.00 0.00 0.00 178.15 178.40 2k39 h GLN 31 N 0.74 0.53 0.44 2.37 -0.00 -1.55 0.36 115.11 118.00 2k39 h GLN 31 Ca 0.11 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.65 58.71 2k39 h GLN 31 Cb 0.67 -0.12 0.00 0.00 0.00 0.00 0.00 27.48 28.04 2k39 h GLN 31 CO 0.05 0.35 -0.21 0.22 0.00 0.00 0.00 178.83 179.24 2k39 h ASP 32 N 0.55 -0.50 1.72 -0.69 3.58 -1.49 -2.86 116.42 116.74 2k39 h ASP 32 Ca 0.48 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.86 2k39 h ASP 32 Cb 0.74 0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.92 2k39 h ASP 32 CO -0.40 -0.22 -0.07 0.11 -2.88 0.00 0.00 179.24 175.77 2k39 h LYS 33 N -0.77 0.00 0.00 0.28 1.79 -0.95 -3.37 116.57 113.55 2k39 h LYS 33 Ca -0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2k39 h LYS 33 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 2k39 h LYS 33 CO 0.10 0.00 0.00 -1.91 -1.08 0.00 0.00 179.45 176.56 2k39 n GLU 34 N -2.74 1.31 -0.52 3.15 4.07 0.13 -4.98 120.64 121.05 2k39 n GLU 34 Ca 0.04 -0.01 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 2k39 n GLU 34 Cb 0.49 -0.17 0.00 0.00 -0.06 0.00 0.00 31.44 31.70 2k39 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2k39 n GLY 35 N 0.19 0.75 3.66 8.31 0.00 -1.08 -4.97 105.19 112.04 2k39 n GLY 35 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.24 5.09 0.67 -0.61 -1.09 -1.26 -4.92 121.20 116.83 2k39 s ILE 36 Ca 0.00 0.98 -0.16 0.00 -2.23 0.00 0.00 60.65 59.25 2k39 s ILE 36 Cb 0.00 -3.86 0.00 0.00 -1.58 0.00 0.00 42.46 37.03 2k39 s ILE 36 CO 0.00 0.15 1.15 -2.16 -1.23 0.00 0.00 174.94 172.85 2k39 s PRO 37 N 1.78 2.66 0.55 2.79 0.04 -1.26 -3.41 135.00 138.14 2k39 s PRO 37 Ca 0.24 1.54 0.32 0.00 0.04 0.00 0.00 61.00 63.15 2k39 s PRO 37 Cb -0.15 -1.92 1.54 0.00 0.04 0.00 0.00 34.50 34.01 2k39 s PRO 37 CO 0.10 -1.39 2.07 -1.00 0.04 0.00 0.00 177.00 176.82 2k39 h PRO 38 N 0.09 0.00 -0.00 0.56 0.13 -1.98 -3.15 132.00 127.64 2k39 h PRO 38 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2k39 h PRO 38 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2k39 h PRO 38 CO 0.53 0.08 -0.40 -0.40 -0.23 0.00 0.00 178.00 177.58 2k39 n ASP 39 N -3.37 0.70 -0.01 1.44 5.75 -1.26 -3.99 116.55 115.82 2k39 n ASP 39 Ca -0.01 -0.50 0.05 0.00 -0.01 0.00 0.00 54.79 54.31 2k39 n ASP 39 Cb 0.25 0.20 -0.06 0.00 -1.03 0.00 0.00 41.12 40.48 2k39 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k39 n GLN 40 N -1.16 3.60 -3.06 0.11 6.02 -1.19 -4.70 117.38 117.00 2k39 n GLN 40 Ca 0.08 -0.02 -0.41 0.00 -0.01 0.00 0.00 57.00 56.65 2k39 n GLN 40 Cb 0.34 -0.98 -0.06 0.00 1.02 0.00 0.00 30.24 30.56 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2k39 s GLN 41 N -1.94 4.18 -0.51 -1.09 -0.21 -1.26 -1.44 119.66 117.39 2k39 s GLN 41 Ca 0.04 0.69 -0.13 0.00 0.02 0.00 0.00 55.36 55.97 2k39 s GLN 41 Cb 0.08 -3.61 0.12 0.00 1.00 0.00 0.00 33.01 30.60 2k39 s GLN 41 CO 0.41 -0.35 0.44 0.50 -2.12 0.00 0.00 175.29 174.17 2k39 s ARG 42 N 2.29 2.80 -0.16 2.91 3.52 0.94 -4.91 118.95 126.33 2k39 s ARG 42 Ca 0.30 -1.72 -0.19 0.00 -0.13 0.00 0.00 55.73 53.99 2k39 s ARG 42 Cb -0.16 -4.15 -0.03 0.00 -1.56 0.00 0.00 34.95 29.05 2k39 s ARG 42 CO 0.09 -1.27 0.55 -0.51 -0.81 0.00 0.00 175.30 173.36 2k39 s LEU 43 N 1.51 4.20 -0.01 -0.88 1.43 -1.26 -0.57 118.68 123.10 2k39 s LEU 43 Ca 0.04 0.80 0.03 0.00 -1.03 0.00 0.00 54.13 53.97 2k39 s LEU 43 Cb -0.28 -2.78 -0.01 0.00 0.03 0.00 0.00 46.19 43.15 2k39 s LEU 43 CO 0.02 -0.14 -0.10 -0.63 0.23 0.00 0.00 176.35 175.73 2k39 s ILE 44 N 1.32 0.78 -0.30 -0.59 1.01 -0.07 -0.80 121.20 122.55 2k39 s ILE 44 Ca 0.27 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 2k39 s ILE 44 Cb -0.16 -0.66 0.17 0.00 0.01 0.00 0.00 42.46 41.83 2k39 s ILE 44 CO 0.11 0.22 0.70 0.12 0.00 0.00 0.00 174.94 176.09 2k39 s PHE 45 N -0.20 -1.33 -1.37 3.97 5.36 -0.50 -1.18 117.98 122.72 2k39 s PHE 45 Ca 0.03 1.64 -0.10 0.00 -0.96 0.00 0.00 56.93 57.55 2k39 s PHE 45 Cb -0.04 0.55 0.07 0.00 -0.34 0.00 0.00 43.02 43.26 2k39 s PHE 45 CO -0.00 -0.71 0.57 0.00 -1.46 0.00 0.00 175.22 173.62 2k39 n ALA 46 N 5.41 -1.08 0.00 11.12 0.00 -1.26 -2.15 120.51 132.54 2k39 n ALA 46 Ca -0.05 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2k39 n ALA 46 Cb 0.51 -3.15 0.00 0.00 0.00 0.00 0.00 19.45 16.81 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 -1.29 0.49 3.62 0.00 0.00 -1.26 -5.04 105.19 101.71 2k39 n GLY 47 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.70 4.07 -0.24 1.61 1.02 -0.91 -5.06 119.74 119.54 2k39 s LYS 48 Ca 0.00 0.32 -0.29 0.00 0.02 0.00 0.00 55.97 56.02 2k39 s LYS 48 Cb 0.00 -3.65 0.01 0.00 -0.52 0.00 0.00 37.83 33.67 2k39 s LYS 48 CO 0.00 -0.35 1.09 -1.14 -0.92 0.00 0.00 175.35 174.03 2k39 s GLN 49 N 2.30 4.21 -0.01 1.68 0.74 -1.26 -1.41 119.66 125.91 2k39 s GLN 49 Ca 0.21 1.36 -0.30 0.00 0.05 0.00 0.00 55.36 56.68 2k39 s GLN 49 Cb -0.16 -3.68 -0.03 0.00 1.10 0.00 0.00 33.01 30.24 2k39 s GLN 49 CO 0.09 -0.70 1.02 -0.51 -0.55 0.00 0.00 175.29 174.64 2k39 s LEU 50 N 3.35 4.35 0.44 3.68 1.43 0.02 -4.99 118.68 126.97 2k39 s LEU 50 Ca 0.46 1.70 -0.15 0.00 -1.03 0.00 0.00 54.13 55.11 2k39 s LEU 50 Cb -0.16 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.42 2k39 s LEU 50 CO 0.09 -0.33 0.88 -1.61 0.23 0.00 0.00 176.35 175.61 2k39 s GLU 51 N 1.20 3.93 -0.08 1.70 2.02 -1.26 -4.82 118.70 121.39 2k39 s GLU 51 Ca 0.53 0.78 -0.29 0.00 0.02 0.00 0.00 54.97 56.00 2k39 s GLU 51 Cb -0.22 -2.26 -0.02 0.00 0.10 0.00 0.00 34.13 31.73 2k39 s GLU 51 CO 0.27 -0.11 0.98 -0.51 0.02 0.00 0.00 175.26 175.91 2k39 s ASP 52 N -2.89 7.25 0.00 -0.19 1.01 -1.26 -3.39 116.67 117.20 2k39 s ASP 52 Ca 0.56 1.53 0.00 0.00 0.71 0.00 0.00 52.55 55.35 2k39 s ASP 52 Cb -0.10 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.28 2k39 s ASP 52 CO 0.27 -0.39 0.00 0.61 0.21 0.00 0.00 175.17 175.87 2k39 n GLY 53 N 3.07 1.08 3.87 0.21 0.00 -1.26 -5.09 105.19 107.07 2k39 n GLY 53 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.13 3.15 -0.02 1.61 1.81 -1.22 -4.98 118.95 119.16 2k39 s ARG 54 Ca 0.00 -0.78 -0.11 0.00 -1.72 0.00 0.00 55.73 53.12 2k39 s ARG 54 Cb 0.00 -2.77 -0.05 0.00 -0.45 0.00 0.00 34.95 31.67 2k39 s ARG 54 CO 0.00 0.48 0.31 0.95 -0.68 0.00 0.00 175.30 176.36 2k39 s THR 55 N -1.80 5.22 0.34 0.02 -4.23 -1.26 -2.36 115.64 111.55 2k39 s THR 55 Ca 0.33 0.50 0.10 0.00 -1.18 0.00 0.00 61.69 61.43 2k39 s THR 55 Cb -0.10 -3.59 0.33 0.00 1.34 0.00 0.00 72.50 70.47 2k39 s THR 55 CO 0.26 0.52 1.79 -0.07 -0.54 0.00 0.00 174.62 176.58 2k39 h LEU 56 N 4.53 0.68 -0.76 4.79 3.38 -1.89 -2.21 115.31 123.82 2k39 h LEU 56 Ca -0.52 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 2k39 h LEU 56 Cb 1.22 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 2k39 h LEU 56 CO 0.62 0.24 -0.03 0.28 0.09 0.00 0.00 178.44 179.63 2k39 h SER 57 N 0.66 0.00 1.44 -0.43 0.02 -1.87 -1.93 113.55 111.44 2k39 h SER 57 Ca 0.56 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.39 2k39 h SER 57 Cb 1.01 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 2k39 h SER 57 CO -0.33 0.03 -0.54 -0.78 -1.14 0.00 0.00 176.83 174.07 2k39 h ASP 58 N 0.00 0.00 1.25 3.07 3.58 -1.77 -2.88 116.42 119.66 2k39 h ASP 58 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k39 h ASP 58 Cb 0.77 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.82 2k39 h ASP 58 CO 0.00 0.54 -0.52 1.88 -2.88 0.00 0.00 179.24 178.27 2k39 h TYR 59 N 0.00 0.00 -1.55 0.28 0.05 -1.45 -3.49 116.97 110.80 2k39 h TYR 59 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.77 2k39 h TYR 59 Cb 1.41 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.15 2k39 h TYR 59 CO 0.00 0.00 0.00 0.09 -1.05 0.00 0.00 178.16 177.20 2k39 n ASN 60 N -2.54 -1.68 -4.24 3.88 3.02 -0.78 -5.02 115.26 107.90 2k39 n ASN 60 Ca 0.03 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.18 2k39 n ASN 60 Cb 0.49 -0.42 -0.10 0.00 -0.61 0.00 0.00 39.78 39.15 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 -2.71 4.16 0.46 2.41 1.01 -0.89 -5.01 121.20 120.63 2k39 s ILE 61 Ca 0.00 -1.57 -0.14 0.00 0.00 0.00 0.00 60.65 58.94 2k39 s ILE 61 Cb 0.00 -3.63 -0.07 0.00 0.01 0.00 0.00 42.46 38.77 2k39 s ILE 61 CO 0.00 -0.61 0.88 -1.10 0.00 0.00 0.00 174.94 174.12 2k39 s GLN 62 N 1.39 3.88 0.06 2.79 -1.52 -1.26 -4.35 119.66 120.65 2k39 s GLN 62 Ca 0.04 0.73 -0.33 0.00 -1.95 0.00 0.00 55.36 53.86 2k39 s GLN 62 Cb -0.24 -2.26 -0.17 0.00 -0.22 0.00 0.00 33.01 30.12 2k39 s GLN 62 CO 0.01 -0.15 0.80 0.36 -0.25 0.00 0.00 175.29 176.06 2k39 n LYS 63 N -1.40 0.00 -0.97 2.91 0.00 -1.26 -2.78 118.16 114.65 2k39 n LYS 63 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.36 2k39 n LYS 63 Cb 0.54 -1.21 0.00 0.00 -0.00 0.00 0.00 35.03 34.36 2k39 n LYS 63 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2k39 n GLU 64 N 1.21 0.00 -2.16 -1.58 1.02 0.04 -5.02 120.64 114.15 2k39 n GLU 64 Ca 0.18 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.94 2k39 n GLU 64 Cb 0.12 -2.50 -0.00 0.00 -0.02 0.00 0.00 31.44 29.04 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 -2.85 6.11 -0.29 1.62 0.01 -1.12 -4.72 113.70 112.46 2k39 s SER 65 Ca 0.00 2.44 -0.07 0.00 1.31 0.00 0.00 55.95 59.63 2k39 s SER 65 Cb 0.00 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.62 2k39 s SER 65 CO 0.00 -0.97 0.08 -0.89 0.41 0.00 0.00 173.24 171.87 2k39 s THR 66 N -1.44 3.94 0.18 1.44 2.01 -1.26 -0.86 115.64 119.65 2k39 s THR 66 Ca 0.63 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.94 2k39 s THR 66 Cb -0.32 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 2k39 s THR 66 CO 0.40 0.08 0.34 -0.76 -0.69 0.00 0.00 174.62 173.98 2k39 s LEU 67 N 1.49 4.28 0.02 4.42 1.02 -0.04 -4.96 118.68 124.92 2k39 s LEU 67 Ca 0.02 0.27 0.01 0.00 0.02 0.00 0.00 54.13 54.45 2k39 s LEU 67 Cb -0.17 -3.02 -0.04 0.00 0.02 0.00 0.00 46.19 42.98 2k39 s LEU 67 CO 0.02 -0.00 0.05 -2.28 0.02 0.00 0.00 176.35 174.17 2k39 s HIS 68 N -1.82 3.19 -0.05 0.29 2.46 -0.33 -0.93 115.29 118.11 2k39 s HIS 68 Ca 0.36 0.13 0.04 0.00 0.47 0.00 0.00 55.06 56.06 2k39 s HIS 68 Cb -0.11 -1.68 -0.00 0.00 -0.13 0.00 0.00 32.58 30.66 2k39 s HIS 68 CO 0.29 0.52 -0.17 -1.17 -2.47 0.00 0.00 174.74 171.73 2k39 s LEU 69 N -1.87 1.91 0.23 8.88 0.20 -0.33 -0.89 118.68 126.80 2k39 s LEU 69 Ca 0.24 -0.36 0.05 0.00 0.69 0.00 0.00 54.13 54.74 2k39 s LEU 69 Cb -0.12 -0.99 -0.05 0.00 -0.43 0.00 0.00 46.19 44.60 2k39 s LEU 69 CO 0.15 0.15 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.63 2k39 s VAL 70 N 0.09 1.24 -0.13 1.68 1.01 0.27 -4.20 120.40 120.35 2k39 s VAL 70 Ca -0.05 -2.07 0.03 0.00 0.00 0.00 0.00 61.98 59.89 2k39 s VAL 70 Cb -0.12 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 33.97 2k39 s VAL 70 CO 0.03 -0.38 -0.22 -0.22 0.00 0.00 0.00 175.10 174.30 2k39 s LEU 71 N -3.32 2.12 -0.07 3.92 1.98 -1.26 -0.04 118.68 122.01 2k39 s LEU 71 Ca 0.27 -0.59 -0.03 0.00 -2.89 0.00 0.00 54.13 50.90 2k39 s LEU 71 Cb 0.05 -1.44 0.04 0.00 0.66 0.00 0.00 46.19 45.50 2k39 s LEU 71 CO 0.08 0.10 0.13 -0.60 -1.89 0.00 0.00 176.35 174.18 2k39 s ARG 72 N 0.68 0.01 -0.13 1.98 3.52 -0.52 -4.89 118.95 119.60 2k39 s ARG 72 Ca -0.10 0.48 -0.29 0.00 -0.13 0.00 0.00 55.73 55.68 2k39 s ARG 72 Cb -0.16 -0.31 -0.01 0.00 -1.56 0.00 0.00 34.95 32.91 2k39 s ARG 72 CO 0.01 -0.29 1.05 -0.51 -0.81 0.00 0.00 175.30 174.76 2k39 s LEU 73 N 2.06 4.22 -0.29 -0.88 1.43 -1.26 -4.39 118.68 119.57 2k39 s LEU 73 Ca 0.01 1.55 0.03 0.00 -1.03 0.00 0.00 54.13 54.69 2k39 s LEU 73 Cb -0.12 -3.55 0.17 0.00 0.03 0.00 0.00 46.19 42.72 2k39 s LEU 73 CO -0.05 -0.53 0.47 -0.60 0.23 0.00 0.00 176.35 175.88 2k39 s ARG 74 N 2.35 0.47 -0.13 1.70 6.06 -1.26 -5.13 118.95 123.00 2k39 s ARG 74 Ca 0.49 0.32 -0.01 0.00 -2.50 0.00 0.00 55.73 54.02 2k39 s ARG 74 Cb -0.19 -0.10 0.04 0.00 0.06 0.00 0.00 34.95 34.76 2k39 s ARG 74 CO 0.16 -1.01 -0.01 0.20 -2.50 0.00 0.00 175.30 172.14 2k39 s GLY 75 N 2.65 0.70 0.00 8.12 0.00 -1.26 -5.04 107.32 112.49 2k39 s GLY 75 Ca 0.10 -0.51 0.00 0.00 0.00 0.00 0.00 44.72 44.32 2k39 s GLY 75 CO -0.28 1.13 0.00 0.61 0.00 0.00 0.00 173.10 174.56