#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 3.53 -0.02 2.12 0.74 -1.26 -0.59 119.66 124.18 2k39 s GLN 2 Ca 0.00 -0.03 0.02 0.00 0.05 0.00 0.00 55.36 55.40 2k39 s GLN 2 Cb 0.00 -3.87 -0.03 0.00 1.10 0.00 0.00 33.01 30.20 2k39 s GLN 2 CO 0.00 -0.92 -0.04 0.96 -0.55 0.00 0.00 175.29 174.74 2k39 s ILE 3 N 2.96 3.85 0.30 -2.34 -4.36 0.12 -0.05 121.20 121.67 2k39 s ILE 3 Ca 0.27 -0.62 -0.12 0.00 -0.26 0.00 0.00 60.65 59.92 2k39 s ILE 3 Cb -0.14 -2.66 -0.08 0.00 1.25 0.00 0.00 42.46 40.84 2k39 s ILE 3 CO 0.18 0.45 0.67 -0.36 0.24 0.00 0.00 174.94 176.12 2k39 s PHE 4 N -0.97 3.41 -0.09 1.37 0.08 -1.24 -0.05 117.98 120.48 2k39 s PHE 4 Ca 0.16 1.04 -0.01 0.00 0.12 0.00 0.00 56.93 58.25 2k39 s PHE 4 Cb -0.11 -2.40 0.03 0.00 -0.57 0.00 0.00 43.02 39.96 2k39 s PHE 4 CO 0.06 0.13 -0.04 0.08 -0.10 0.00 0.00 175.22 175.35 2k39 s VAL 5 N -1.99 0.72 -0.13 -0.44 1.01 -0.14 -1.95 120.40 117.49 2k39 s VAL 5 Ca 0.51 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.35 2k39 s VAL 5 Cb -0.11 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 2k39 s VAL 5 CO 0.21 0.31 -0.04 -0.75 0.00 0.00 0.00 175.10 174.84 2k39 s LYS 6 N 1.72 3.37 0.47 2.72 2.20 -0.43 -0.02 119.74 129.77 2k39 s LYS 6 Ca 0.03 -0.51 0.07 0.00 -0.36 0.00 0.00 55.97 55.21 2k39 s LYS 6 Cb -0.13 -2.83 0.01 0.00 -1.51 0.00 0.00 37.83 33.38 2k39 s LYS 6 CO -0.06 0.41 0.47 0.95 -0.36 0.00 0.00 175.35 176.76 2k39 s THR 7 N -0.09 2.37 -0.11 3.43 -4.23 -1.03 -2.83 115.64 113.15 2k39 s THR 7 Ca 0.02 -1.29 0.03 0.00 -1.18 0.00 0.00 61.69 59.27 2k39 s THR 7 Cb -0.13 -2.66 -0.24 0.00 1.34 0.00 0.00 72.50 70.81 2k39 s THR 7 CO 0.02 0.00 0.40 -0.11 -0.54 0.00 0.00 174.62 174.39 2k39 n LEU 8 N -1.74 1.85 0.00 4.79 0.00 -1.26 -3.61 117.00 117.03 2k39 n LEU 8 Ca 0.05 0.24 0.04 0.00 0.00 0.00 0.00 56.01 56.33 2k39 n LEU 8 Cb 0.62 -0.52 0.19 0.00 0.00 0.00 0.00 43.42 43.71 2k39 n LEU 8 CO 0.41 0.67 0.56 0.35 0.00 0.00 0.00 177.39 179.38 2k39 n THR 9 N -3.25 0.94 0.00 1.96 -2.24 -1.26 -4.90 114.28 105.53 2k39 n THR 9 Ca -0.28 0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2k39 n THR 9 Cb 1.05 -1.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 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 -0.65 0.72 3.74 3.38 0.00 -1.24 -5.09 105.19 106.04 2k39 n GLY 10 Ca 0.03 0.00 -0.40 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 0.00 4.78 -0.29 1.61 2.20 -1.26 -4.87 119.74 121.91 2k39 s LYS 11 Ca 0.00 1.52 -0.12 0.00 -0.36 0.00 0.00 55.97 57.01 2k39 s LYS 11 Cb 0.00 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.98 2k39 s LYS 11 CO 0.00 0.39 0.22 0.99 -0.36 0.00 0.00 175.35 176.59 2k39 s THR 12 N -0.81 5.29 0.17 3.43 2.01 -1.26 -2.45 115.64 122.01 2k39 s THR 12 Ca 0.43 0.13 -0.02 0.00 0.31 0.00 0.00 61.69 62.54 2k39 s THR 12 Cb -0.26 -3.59 -0.05 0.00 0.01 0.00 0.00 72.50 68.61 2k39 s THR 12 CO 0.32 0.18 0.37 -0.63 -0.69 0.00 0.00 174.62 174.17 2k39 s ILE 13 N 1.79 5.22 0.01 1.82 1.01 0.97 -4.99 121.20 127.03 2k39 s ILE 13 Ca 0.08 -0.28 0.06 0.00 0.00 0.00 0.00 60.65 60.52 2k39 s ILE 13 Cb -0.16 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 2k39 s ILE 13 CO 0.11 -0.08 -0.20 0.28 0.00 0.00 0.00 174.94 175.05 2k39 s THR 14 N -1.78 1.56 -0.06 2.92 -1.32 -1.26 -0.97 115.64 114.74 2k39 s THR 14 Ca 0.39 -0.97 0.03 0.00 -1.21 0.00 0.00 61.69 59.92 2k39 s THR 14 Cb -0.11 -1.32 0.01 0.00 -1.51 0.00 0.00 72.50 69.56 2k39 s THR 14 CO 0.28 0.33 -0.14 -0.22 -2.21 0.00 0.00 174.62 172.66 2k39 s LEU 15 N -0.75 1.75 -0.40 9.08 2.96 0.92 -5.00 118.68 127.24 2k39 s LEU 15 Ca 0.07 -0.32 -0.15 0.00 -0.22 0.00 0.00 54.13 53.51 2k39 s LEU 15 Cb -0.08 -0.88 0.02 0.00 0.50 0.00 0.00 46.19 45.74 2k39 s LEU 15 CO 0.00 0.07 0.31 -1.61 -1.32 0.00 0.00 176.35 173.81 2k39 s GLU 16 N 0.48 3.06 0.20 1.98 8.01 -1.26 0.10 118.70 131.27 2k39 s GLU 16 Ca -0.12 -0.93 0.02 0.00 0.01 0.00 0.00 54.97 53.96 2k39 s GLU 16 Cb -0.15 -3.95 -0.01 0.00 -4.31 0.00 0.00 34.13 25.71 2k39 s GLU 16 CO 0.04 -0.72 0.08 1.33 0.01 0.00 0.00 175.26 176.00 2k39 n VAL 17 N 5.20 0.00 -4.24 2.63 0.24 0.24 -4.81 118.33 117.58 2k39 n VAL 17 Ca -0.11 -1.21 -0.26 0.00 -2.04 0.00 0.00 64.34 60.73 2k39 n VAL 17 Cb 0.47 0.46 -0.08 0.00 -1.47 0.00 0.00 33.84 33.23 2k39 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2k39 s GLU 18 N -2.77 2.33 0.00 7.34 2.02 -1.26 0.72 118.70 127.08 2k39 s GLU 18 Ca 0.12 -1.21 0.29 0.00 0.02 0.00 0.00 54.97 54.19 2k39 s GLU 18 Cb 0.01 -2.28 1.28 0.00 0.10 0.00 0.00 34.13 33.24 2k39 s GLU 18 CO 0.08 0.43 1.92 -0.35 0.02 0.00 0.00 175.26 177.36 2k39 n PRO 19 N -0.32 0.35 -0.08 0.39 -0.04 -1.26 -2.89 135.00 131.15 2k39 n PRO 19 Ca -0.09 -0.06 0.08 0.00 -0.04 0.00 0.00 63.50 63.39 2k39 n PRO 19 Cb 0.56 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.64 2k39 n PRO 19 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2k39 n SER 20 N -1.27 2.69 -4.81 3.54 7.64 -1.26 -1.27 113.62 118.88 2k39 n SER 20 Ca 0.12 -1.79 -0.33 0.00 1.01 0.00 0.00 58.87 57.88 2k39 n SER 20 Cb 0.28 -0.10 -0.02 0.00 -1.01 0.00 0.00 64.21 63.37 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 -1.28 6.18 0.52 6.43 1.01 -1.14 -4.79 116.67 123.60 2k39 s ASP 21 Ca 0.24 1.81 0.02 0.00 0.71 0.00 0.00 52.55 55.33 2k39 s ASP 21 Cb 0.15 -2.54 0.03 0.00 1.01 0.00 0.00 42.92 41.57 2k39 s ASP 21 CO 0.22 -0.89 0.73 0.42 0.21 0.00 0.00 175.17 175.86 2k39 s THR 22 N -2.30 2.83 0.10 -1.27 -4.23 -1.26 -2.67 115.64 106.84 2k39 s THR 22 Ca 0.64 -0.70 0.26 0.00 -1.18 0.00 0.00 61.69 60.71 2k39 s THR 22 Cb -0.15 -3.04 0.27 0.00 1.34 0.00 0.00 72.50 70.92 2k39 s THR 22 CO 0.29 -0.03 1.85 0.40 -0.54 0.00 0.00 174.62 176.59 2k39 h ILE 23 N 0.19 0.41 0.00 2.99 1.08 -1.81 -0.10 117.51 120.27 2k39 h ILE 23 Ca -0.42 -0.99 0.00 0.00 -0.39 0.00 0.00 64.86 63.06 2k39 h ILE 23 Cb 1.29 1.72 0.00 0.00 -3.07 0.00 0.00 36.82 36.76 2k39 h ILE 23 CO 0.51 0.16 0.00 -0.08 -0.69 0.00 0.00 178.15 178.06 2k39 h GLU 24 N 0.00 0.00 -0.02 2.37 4.81 -1.94 -1.88 114.58 117.91 2k39 h GLU 24 Ca -0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 2k39 h GLU 24 Cb 0.71 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.09 2k39 h GLU 24 CO 0.02 0.00 -0.16 -0.97 -0.73 0.00 0.00 179.01 177.17 2k39 h ASN 25 N 0.00 0.19 -0.31 1.04 -0.73 -1.38 -1.69 115.58 112.70 2k39 h ASN 25 Ca 0.00 -0.69 -0.07 0.00 1.87 0.00 0.00 56.30 57.42 2k39 h ASN 25 Cb 0.45 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 38.98 2k39 h ASN 25 CO 0.00 0.84 -0.07 0.58 -0.37 0.00 0.00 177.43 178.42 2k39 h VAL 26 N -0.46 1.28 -1.05 2.57 2.07 -1.46 -2.16 116.25 117.05 2k39 h VAL 26 Ca -0.01 -1.10 0.27 0.00 0.82 0.00 0.00 66.70 66.68 2k39 h VAL 26 Cb 0.85 1.37 -0.10 0.00 -1.52 0.00 0.00 31.29 31.89 2k39 h VAL 26 CO 0.03 0.35 0.67 0.11 0.02 0.00 0.00 177.57 178.76 2k39 h LYS 27 N 0.36 0.38 0.12 1.57 1.57 -1.42 -2.13 116.57 117.01 2k39 h LYS 27 Ca 0.08 -0.02 -0.30 0.00 -1.87 0.00 0.00 60.65 58.54 2k39 h LYS 27 Cb 0.55 -0.09 0.03 0.00 0.08 0.00 0.00 32.23 32.81 2k39 h LYS 27 CO 0.03 0.25 -1.25 0.00 -0.57 0.00 0.00 179.45 177.91 2k39 h ALA 28 N 1.63 -0.01 -0.12 3.86 0.00 -0.70 -2.36 119.26 121.56 2k39 h ALA 28 Ca 0.61 -0.77 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2k39 h ALA 28 Cb 1.54 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 2k39 h ALA 28 CO -0.31 0.69 -0.46 0.87 0.00 0.00 0.00 179.25 180.04 2k39 h LYS 29 N 0.28 0.29 -0.29 0.00 1.57 -1.28 0.25 116.57 117.39 2k39 h LYS 29 Ca -0.19 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.41 2k39 h LYS 29 Cb 1.92 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 34.23 2k39 h LYS 29 CO 0.24 0.70 0.08 0.82 -0.57 0.00 0.00 179.45 180.72 2k39 h ILE 30 N 0.23 1.21 -0.46 1.86 2.04 -1.44 -2.36 117.51 118.58 2k39 h ILE 30 Ca 0.01 -0.67 0.03 0.00 1.00 0.00 0.00 64.86 65.23 2k39 h ILE 30 Cb 0.91 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 2k39 h ILE 30 CO 0.07 0.22 0.26 -0.61 0.00 0.00 0.00 178.15 178.10 2k39 h GLN 31 N 0.30 0.51 -0.12 2.37 4.15 -1.12 -2.22 115.11 118.98 2k39 h GLN 31 Ca 0.09 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.50 2k39 h GLN 31 Cb 0.26 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.80 2k39 h GLN 31 CO -0.00 0.34 -0.30 0.22 -1.93 0.00 0.00 178.83 177.15 2k39 h ASP 32 N 0.52 -0.98 0.12 -0.69 3.58 -0.54 -3.01 116.42 115.41 2k39 h ASP 32 Ca 0.19 0.12 -0.02 0.00 0.42 0.00 0.00 57.03 57.74 2k39 h ASP 32 Cb 0.04 0.39 -0.00 0.00 1.72 0.00 0.00 39.33 41.48 2k39 h ASP 32 CO -0.10 -0.25 -1.91 0.29 -2.88 0.00 0.00 179.24 174.38 2k39 n LYS 33 N -4.16 0.66 -0.07 0.28 4.76 -0.89 -4.46 118.16 114.28 2k39 n LYS 33 Ca -0.03 -0.15 0.02 0.00 -2.87 0.00 0.00 58.31 55.28 2k39 n LYS 33 Cb 0.20 -1.56 0.03 0.00 -1.84 0.00 0.00 35.03 31.86 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2k39 n GLU 34 N -2.34 1.56 -1.56 1.97 -0.58 -0.85 -5.05 120.64 113.77 2k39 n GLU 34 Ca -0.05 -1.39 -0.18 0.00 -0.42 0.00 0.00 57.16 55.12 2k39 n GLU 34 Cb 0.61 -0.91 -0.07 0.00 -0.57 0.00 0.00 31.44 30.50 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 -0.49 1.63 3.75 0.62 0.00 -1.11 -4.92 105.19 104.67 2k39 n GLY 35 Ca 0.03 -0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.67 5.12 -0.24 -0.61 1.01 -1.25 -4.98 121.20 117.57 2k39 s ILE 36 Ca 0.00 0.95 -0.29 0.00 0.00 0.00 0.00 60.65 61.32 2k39 s ILE 36 Cb 0.00 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 2k39 s ILE 36 CO 0.00 0.40 1.87 -2.16 0.00 0.00 0.00 174.94 175.04 2k39 s PRO 37 N 0.14 3.48 0.03 2.79 0.04 -1.26 -3.99 135.00 136.23 2k39 s PRO 37 Ca 0.26 1.74 0.20 0.00 0.04 0.00 0.00 61.00 63.24 2k39 s PRO 37 Cb -0.16 -4.19 0.86 0.00 0.04 0.00 0.00 34.50 31.04 2k39 s PRO 37 CO 0.12 -1.69 1.65 -0.35 0.04 0.00 0.00 177.00 176.76 2k39 n PRO 38 N 8.23 0.03 0.23 0.56 -0.04 -1.26 -2.20 135.00 140.55 2k39 n PRO 38 Ca 0.23 0.18 0.07 0.00 -0.04 0.00 0.00 63.50 63.95 2k39 n PRO 38 Cb 0.45 -1.54 0.55 0.00 -0.04 0.00 0.00 33.50 32.92 2k39 n PRO 38 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2k39 h ASP 39 N 0.00 0.00 -1.74 3.54 3.58 -1.97 -3.28 116.42 116.55 2k39 h ASP 39 Ca 0.00 0.00 -0.64 0.00 0.42 0.00 0.00 57.03 56.81 2k39 h ASP 39 Cb 0.36 0.00 -0.38 0.00 1.72 0.00 0.00 39.33 41.03 2k39 h ASP 39 CO 0.00 0.21 -0.27 0.00 -2.88 0.00 0.00 179.24 176.30 2k39 n GLN 40 N -3.98 3.35 -3.55 0.28 1.13 -0.93 -4.91 117.38 108.76 2k39 n GLN 40 Ca -0.02 -4.35 -0.16 0.00 -1.94 0.00 0.00 57.00 50.53 2k39 n GLN 40 Cb 0.29 -2.26 -0.06 0.00 0.11 0.00 0.00 30.24 28.31 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 -3.68 0.96 -0.15 -1.09 0.74 -1.24 -1.75 119.66 113.45 2k39 s GLN 41 Ca 0.49 0.46 -0.07 0.00 0.05 0.00 0.00 55.36 56.28 2k39 s GLN 41 Cb 0.39 0.46 0.06 0.00 1.10 0.00 0.00 33.01 35.02 2k39 s GLN 41 CO -0.23 -0.26 0.35 1.03 -0.55 0.00 0.00 175.29 175.63 2k39 s ARG 42 N -0.74 0.29 0.18 1.67 0.52 -1.13 -4.85 118.95 114.91 2k39 s ARG 42 Ca -0.07 0.77 -0.07 0.00 -0.52 0.00 0.00 55.73 55.84 2k39 s ARG 42 Cb -0.01 0.02 -0.06 0.00 0.52 0.00 0.00 34.95 35.41 2k39 s ARG 42 CO 0.07 -0.20 0.45 -0.51 0.02 0.00 0.00 175.30 175.13 2k39 s LEU 43 N 1.79 4.22 -0.04 2.53 1.43 -1.26 -1.70 118.68 125.64 2k39 s LEU 43 Ca -0.06 0.73 0.04 0.00 -1.03 0.00 0.00 54.13 53.81 2k39 s LEU 43 Cb -0.10 -3.47 -0.00 0.00 0.03 0.00 0.00 46.19 42.64 2k39 s LEU 43 CO -0.11 -0.01 -0.16 -0.63 0.23 0.00 0.00 176.35 175.67 2k39 s ILE 44 N -1.74 1.37 -0.15 -0.59 1.01 0.18 -1.15 121.20 120.12 2k39 s ILE 44 Ca 0.44 -0.68 -0.10 0.00 0.00 0.00 0.00 60.65 60.31 2k39 s ILE 44 Cb -0.12 -1.18 0.05 0.00 0.01 0.00 0.00 42.46 41.22 2k39 s ILE 44 CO 0.23 0.40 0.38 0.12 0.00 0.00 0.00 174.94 176.07 2k39 s PHE 45 N 0.08 -0.51 -1.33 3.97 2.19 -0.14 -0.15 117.98 122.09 2k39 s PHE 45 Ca -0.04 1.15 0.00 0.00 0.33 0.00 0.00 56.93 58.36 2k39 s PHE 45 Cb -0.11 0.20 0.00 0.00 -1.31 0.00 0.00 43.02 41.80 2k39 s PHE 45 CO 0.02 -0.29 0.00 0.00 1.83 0.00 0.00 175.22 176.79 2k39 n ALA 46 N 3.82 -0.27 0.00 11.12 0.00 -1.26 -1.04 120.51 132.88 2k39 n ALA 46 Ca -0.20 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2k39 n ALA 46 Cb 0.56 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 -0.31 0.42 3.16 0.00 0.00 -1.26 -5.08 105.19 102.11 2k39 n GLY 47 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.82 3.03 -0.01 1.61 1.02 -0.20 -5.05 119.74 119.33 2k39 s LYS 48 Ca 0.00 -0.83 -0.35 0.00 0.02 0.00 0.00 55.97 54.81 2k39 s LYS 48 Cb 0.00 -2.51 -0.13 0.00 -0.52 0.00 0.00 37.83 34.67 2k39 s LYS 48 CO 0.00 -0.09 1.73 0.94 -0.92 0.00 0.00 175.35 177.01 2k39 n GLN 49 N 4.29 2.02 -2.17 1.68 7.27 -1.26 -0.97 117.38 128.25 2k39 n GLN 49 Ca -0.20 0.74 -0.42 0.00 0.07 0.00 0.00 57.00 57.18 2k39 n GLN 49 Cb 0.51 -2.53 -0.03 0.00 2.41 0.00 0.00 30.24 30.60 2k39 n GLN 49 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2k39 s LEU 50 N 2.73 3.50 0.24 1.69 1.43 -0.30 -4.92 118.68 123.05 2k39 s LEU 50 Ca 0.88 0.93 -0.08 0.00 -1.03 0.00 0.00 54.13 54.83 2k39 s LEU 50 Cb -0.73 -3.38 -0.07 0.00 0.03 0.00 0.00 46.19 42.04 2k39 s LEU 50 CO 0.48 -1.68 0.54 -0.70 0.23 0.00 0.00 176.35 175.22 2k39 s GLU 51 N 5.52 3.75 0.03 1.70 2.12 -1.26 -4.72 118.70 125.84 2k39 s GLU 51 Ca 0.69 0.20 -0.30 0.00 0.36 0.00 0.00 54.97 55.92 2k39 s GLU 51 Cb -0.17 -2.65 -0.05 0.00 0.26 0.00 0.00 34.13 31.51 2k39 s GLU 51 CO 0.31 0.30 1.23 -0.51 -0.54 0.00 0.00 175.26 176.05 2k39 s ASP 52 N -2.54 7.04 0.00 -1.70 1.01 -1.26 -3.77 116.67 115.44 2k39 s ASP 52 Ca 0.46 2.00 0.00 0.00 0.71 0.00 0.00 52.55 55.72 2k39 s ASP 52 Cb -0.11 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.25 2k39 s ASP 52 CO 0.23 -0.53 0.00 0.61 0.21 0.00 0.00 175.17 175.69 2k39 n GLY 53 N 3.31 1.23 3.55 0.21 0.00 -1.26 -5.11 105.19 107.12 2k39 n GLY 53 Ca 0.10 0.00 -0.26 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 -0.14 1.83 0.06 1.61 0.52 -1.25 -5.04 118.95 116.54 2k39 s ARG 54 Ca 0.00 -2.00 0.08 0.00 -0.52 0.00 0.00 55.73 53.29 2k39 s ARG 54 Cb 0.00 -1.49 -0.03 0.00 0.52 0.00 0.00 34.95 33.96 2k39 s ARG 54 CO 0.00 -0.01 -0.21 0.95 0.02 0.00 0.00 175.30 176.05 2k39 s THR 55 N -2.81 1.72 0.30 0.02 -4.23 -1.26 -2.43 115.64 106.96 2k39 s THR 55 Ca 0.34 -1.31 0.06 0.00 -1.18 0.00 0.00 61.69 59.60 2k39 s THR 55 Cb 0.07 -1.51 0.30 0.00 1.34 0.00 0.00 72.50 72.69 2k39 s THR 55 CO 0.17 0.15 1.71 -0.07 -0.54 0.00 0.00 174.62 176.03 2k39 h LEU 56 N 4.65 0.45 -0.83 4.79 3.38 -1.45 0.20 115.31 126.49 2k39 h LEU 56 Ca -0.44 0.15 0.26 0.00 0.09 0.00 0.00 57.88 57.94 2k39 h LEU 56 Cb 1.16 0.10 -0.15 0.00 0.09 0.00 0.00 40.66 41.86 2k39 h LEU 56 CO 0.43 0.03 0.12 -0.24 0.09 0.00 0.00 178.44 178.87 2k39 n SER 57 N -4.99 -0.00 0.00 -0.43 2.88 -0.39 -0.99 113.62 109.69 2k39 n SER 57 Ca 0.24 1.40 0.09 0.00 -1.33 0.00 0.00 58.87 59.28 2k39 n SER 57 Cb 0.69 -0.55 0.46 0.00 -0.75 0.00 0.00 64.21 64.05 2k39 n SER 57 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2k39 n ASP 58 N -5.11 0.00 -0.00 -3.46 8.00 0.69 -2.31 116.55 114.36 2k39 n ASP 58 Ca 0.22 0.23 0.02 0.00 0.71 0.00 0.00 54.79 55.97 2k39 n ASP 58 Cb 0.75 -0.38 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 2k39 n ASP 58 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2k39 n TYR 59 N -1.38 0.00 -2.25 1.24 4.01 -0.73 -5.01 117.16 113.04 2k39 n TYR 59 Ca 0.07 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.79 2k39 n TYR 59 Cb 0.19 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 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 -1.21 -1.83 -4.65 7.72 5.15 -0.17 -5.01 115.26 115.25 2k39 n ASN 60 Ca 0.00 -0.02 -0.43 0.00 -0.60 0.00 0.00 54.58 53.54 2k39 n ASN 60 Cb 0.06 -0.94 -0.03 0.00 -0.53 0.00 0.00 39.78 38.35 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 -2.45 3.75 0.48 -1.44 1.01 -1.08 -4.99 121.20 116.47 2k39 s ILE 61 Ca 0.02 0.90 0.03 0.00 0.00 0.00 0.00 60.65 61.60 2k39 s ILE 61 Cb -0.01 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 2k39 s ILE 61 CO 0.03 -0.11 0.02 0.00 0.00 0.00 0.00 174.94 174.87 2k39 s GLN 62 N 4.03 2.12 -0.37 2.79 1.03 -1.26 -4.73 119.66 123.27 2k39 s GLN 62 Ca 0.69 -2.29 -0.37 0.00 0.04 0.00 0.00 55.36 53.43 2k39 s GLN 62 Cb -0.29 -1.59 -0.13 0.00 0.03 0.00 0.00 33.01 31.02 2k39 s GLN 62 CO 0.26 -0.26 2.12 1.17 -2.54 0.00 0.00 175.29 176.05 2k39 n LYS 63 N -1.18 0.89 -2.07 9.60 4.81 -1.26 -1.59 118.16 127.37 2k39 n LYS 63 Ca -0.14 0.26 -0.07 0.00 -0.87 0.00 0.00 58.31 57.49 2k39 n LYS 63 Cb 0.67 -2.24 -0.01 0.00 0.02 0.00 0.00 35.03 33.48 2k39 n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k39 n GLU 64 N 7.71 -0.54 -2.90 1.64 1.02 0.93 -4.98 120.64 123.52 2k39 n GLU 64 Ca 0.42 0.36 -0.41 0.00 -0.02 0.00 0.00 57.16 57.51 2k39 n GLU 64 Cb 0.17 -4.24 -0.04 0.00 -0.02 0.00 0.00 31.44 27.31 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 -2.71 7.02 -0.42 1.62 0.01 -0.62 -4.71 113.70 113.88 2k39 s SER 65 Ca 0.00 1.24 -0.18 0.00 1.31 0.00 0.00 55.95 58.32 2k39 s SER 65 Cb 0.00 -2.46 0.02 0.00 0.21 0.00 0.00 66.02 63.79 2k39 s SER 65 CO 0.00 -0.32 0.49 -0.89 0.41 0.00 0.00 173.24 172.93 2k39 s THR 66 N 1.73 5.02 0.57 1.44 2.01 -1.26 -3.73 115.64 121.43 2k39 s THR 66 Ca 0.40 -0.22 -0.14 0.00 0.31 0.00 0.00 61.69 62.04 2k39 s THR 66 Cb -0.17 -4.08 -0.06 0.00 0.01 0.00 0.00 72.50 68.20 2k39 s THR 66 CO 0.15 -0.47 1.01 -0.76 -0.69 0.00 0.00 174.62 173.87 2k39 s LEU 67 N 2.32 3.42 0.02 4.42 1.02 -0.82 -4.86 118.68 124.19 2k39 s LEU 67 Ca 0.15 1.50 0.08 0.00 0.02 0.00 0.00 54.13 55.88 2k39 s LEU 67 Cb -0.16 -4.49 -0.02 0.00 0.02 0.00 0.00 46.19 41.53 2k39 s LEU 67 CO 0.15 -0.76 -0.24 -2.28 0.02 0.00 0.00 176.35 173.24 2k39 s HIS 68 N -2.90 2.17 -0.11 0.29 2.46 0.79 -1.31 115.29 116.68 2k39 s HIS 68 Ca 0.57 -0.40 0.03 0.00 0.47 0.00 0.00 55.06 55.72 2k39 s HIS 68 Cb -0.11 -1.34 0.01 0.00 -0.13 0.00 0.00 32.58 31.01 2k39 s HIS 68 CO 0.43 0.04 -0.19 -1.17 -2.47 0.00 0.00 174.74 171.39 2k39 s LEU 69 N -0.92 1.89 0.00 8.88 0.20 -1.13 0.50 118.68 128.11 2k39 s LEU 69 Ca 0.10 -0.48 0.07 0.00 0.69 0.00 0.00 54.13 54.51 2k39 s LEU 69 Cb -0.09 -1.21 -0.03 0.00 -0.43 0.00 0.00 46.19 44.43 2k39 s LEU 69 CO 0.01 0.07 -0.21 0.68 -0.29 0.00 0.00 176.35 176.61 2k39 s VAL 70 N 0.72 2.56 -0.35 1.68 -7.23 -0.69 -4.35 120.40 112.74 2k39 s VAL 70 Ca -0.11 -1.09 -0.18 0.00 -1.81 0.00 0.00 61.98 58.79 2k39 s VAL 70 Cb -0.16 -2.00 -0.00 0.00 0.56 0.00 0.00 36.38 34.78 2k39 s VAL 70 CO 0.02 0.47 0.50 -1.48 -0.31 0.00 0.00 175.10 174.30 2k39 s LEU 71 N -1.01 4.36 0.00 1.32 2.34 -1.26 -2.81 118.68 121.61 2k39 s LEU 71 Ca 0.12 -0.05 0.00 0.00 0.06 0.00 0.00 54.13 54.26 2k39 s LEU 71 Cb -0.10 -2.56 0.00 0.00 -0.56 0.00 0.00 46.19 42.96 2k39 s LEU 71 CO 0.02 -0.47 0.00 -1.14 -1.06 0.00 0.00 176.35 173.70 2k39 n ARG 72 N 5.71 0.00 -1.61 1.48 0.63 -0.72 -4.92 116.66 117.24 2k39 n ARG 72 Ca -0.05 0.00 -0.44 0.00 -0.92 0.00 0.00 57.85 56.44 2k39 n ARG 72 Cb 0.49 -2.13 -0.01 0.00 0.45 0.00 0.00 32.46 31.26 2k39 n ARG 72 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2k39 n LEU 73 N 0.00 2.13 -4.78 6.15 4.77 -1.26 -4.87 117.00 119.13 2k39 n LEU 73 Ca 0.00 1.18 -0.39 0.00 -0.03 0.00 0.00 56.01 56.77 2k39 n LEU 73 Cb 0.00 -1.33 -0.06 0.00 -2.33 0.00 0.00 43.42 39.71 2k39 n LEU 73 CO 0.00 -1.22 0.37 -0.60 -1.33 0.00 0.00 177.39 174.61 2k39 s ARG 74 N -1.59 4.38 0.00 3.23 3.52 -1.26 -4.86 118.95 122.37 2k39 s ARG 74 Ca 0.58 0.91 0.00 0.00 -0.13 0.00 0.00 55.73 57.09 2k39 s ARG 74 Cb -0.68 -3.29 0.00 0.00 -1.56 0.00 0.00 34.95 29.42 2k39 s ARG 74 CO 0.60 0.50 0.00 0.41 -0.81 0.00 0.00 175.30 176.00 2k39 n GLY 75 N 1.96 5.24 0.00 8.12 0.00 -1.26 -5.19 105.19 114.06 2k39 n GLY 75 Ca -0.07 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93