#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 3.00 0.06 3.17 -0.21 -1.26 -2.25 119.66 122.17 2k39 s GLN 2 Ca 0.00 -0.62 0.01 0.00 0.02 0.00 0.00 55.36 54.77 2k39 s GLN 2 Cb 0.00 -2.80 -0.03 0.00 1.00 0.00 0.00 33.01 31.18 2k39 s GLN 2 CO 0.00 0.58 -0.06 0.96 -2.12 0.00 0.00 175.29 174.66 2k39 s ILE 3 N -1.39 0.47 -0.15 1.08 -4.36 0.60 -0.99 121.20 116.46 2k39 s ILE 3 Ca 0.30 -1.55 -0.04 0.00 -0.26 0.00 0.00 60.65 59.10 2k39 s ILE 3 Cb -0.12 -1.17 -0.03 0.00 1.25 0.00 0.00 42.46 42.38 2k39 s ILE 3 CO 0.22 -0.72 -0.00 -0.36 0.24 0.00 0.00 174.94 174.32 2k39 s PHE 4 N -2.81 3.11 -0.22 1.37 0.08 -1.20 -1.79 117.98 116.52 2k39 s PHE 4 Ca 0.01 -0.09 -0.00 0.00 0.12 0.00 0.00 56.93 56.97 2k39 s PHE 4 Cb -0.00 -1.95 0.02 0.00 -0.57 0.00 0.00 43.02 40.53 2k39 s PHE 4 CO -0.04 0.13 -0.12 0.08 -0.10 0.00 0.00 175.22 175.17 2k39 s VAL 5 N 0.07 2.51 -0.01 -0.44 1.01 -0.14 -2.67 120.40 120.73 2k39 s VAL 5 Ca 0.02 -1.02 -0.15 0.00 0.00 0.00 0.00 61.98 60.82 2k39 s VAL 5 Cb -0.13 -2.21 -0.06 0.00 0.00 0.00 0.00 36.38 33.99 2k39 s VAL 5 CO 0.02 0.32 0.43 -0.54 0.00 0.00 0.00 175.10 175.33 2k39 s LYS 6 N 1.30 4.00 0.59 2.72 1.02 0.08 -1.59 119.74 127.86 2k39 s LYS 6 Ca 0.01 0.44 -0.04 0.00 0.02 0.00 0.00 55.97 56.41 2k39 s LYS 6 Cb -0.15 -3.25 0.03 0.00 -0.52 0.00 0.00 37.83 33.93 2k39 s LYS 6 CO -0.08 0.62 0.87 0.95 -0.92 0.00 0.00 175.35 176.79 2k39 s THR 7 N -0.86 3.08 0.21 2.17 -4.23 -0.22 -0.84 115.64 114.96 2k39 s THR 7 Ca 0.24 -0.30 0.27 0.00 -1.18 0.00 0.00 61.69 60.72 2k39 s THR 7 Cb -0.17 -3.22 0.28 0.00 1.34 0.00 0.00 72.50 70.72 2k39 s THR 7 CO 0.13 -0.21 1.92 0.17 -0.54 0.00 0.00 174.62 176.10 2k39 h LEU 8 N -0.16 0.00 0.00 4.79 -0.00 -1.87 -3.33 115.31 114.73 2k39 h LEU 8 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.44 2k39 h LEU 8 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.94 2k39 h LEU 8 CO 0.58 0.16 -0.70 0.35 -0.00 0.00 0.00 178.44 178.84 2k39 n THR 9 N -3.40 0.24 0.00 0.15 -2.24 -1.26 -4.97 114.28 102.79 2k39 n THR 9 Ca -0.00 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2k39 n THR 9 Cb 0.35 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 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 1.38 0.58 3.88 3.38 0.00 -1.25 -5.13 105.19 108.03 2k39 n GLY 10 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2k39 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k39 s LYS 11 N 0.00 3.74 -0.29 1.61 1.02 -1.26 -4.93 119.74 119.62 2k39 s LYS 11 Ca 0.00 0.15 -0.08 0.00 0.02 0.00 0.00 55.97 56.06 2k39 s LYS 11 Cb 0.00 -2.74 -0.00 0.00 -0.52 0.00 0.00 37.83 34.57 2k39 s LYS 11 CO 0.00 0.38 0.11 0.99 -0.92 0.00 0.00 175.35 175.91 2k39 s THR 12 N -1.73 4.26 -0.07 2.17 2.01 -1.26 -1.06 115.64 119.95 2k39 s THR 12 Ca 0.44 -0.52 -0.10 0.00 0.31 0.00 0.00 61.69 61.83 2k39 s THR 12 Cb -0.12 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.19 2k39 s THR 12 CO 0.22 0.11 0.24 -0.63 -0.69 0.00 0.00 174.62 173.88 2k39 s ILE 13 N 1.56 5.32 -0.56 1.82 1.01 -0.62 -4.91 121.20 124.82 2k39 s ILE 13 Ca 0.04 0.44 -0.14 0.00 0.00 0.00 0.00 60.65 60.98 2k39 s ILE 13 Cb -0.17 -3.52 0.14 0.00 0.01 0.00 0.00 42.46 38.92 2k39 s ILE 13 CO 0.04 0.59 0.50 -0.89 0.00 0.00 0.00 174.94 175.19 2k39 s THR 14 N -1.06 5.05 0.36 2.92 2.01 -1.26 -0.97 115.64 122.69 2k39 s THR 14 Ca 0.19 -1.68 -0.06 0.00 0.31 0.00 0.00 61.69 60.44 2k39 s THR 14 Cb -0.14 -4.24 -0.05 0.00 0.01 0.00 0.00 72.50 68.08 2k39 s THR 14 CO 0.08 -0.87 0.65 -0.76 -0.69 0.00 0.00 174.62 173.03 2k39 s LEU 15 N 1.37 3.92 -0.17 4.42 2.01 -0.74 -4.95 118.68 124.54 2k39 s LEU 15 Ca 0.05 0.83 0.01 0.00 0.01 0.00 0.00 54.13 55.03 2k39 s LEU 15 Cb -0.27 -3.69 0.02 0.00 0.01 0.00 0.00 46.19 42.26 2k39 s LEU 15 CO 0.01 -0.32 -0.18 -1.61 1.01 0.00 0.00 176.35 175.25 2k39 s GLU 16 N -3.90 2.80 0.05 1.70 8.01 -1.26 -0.30 118.70 125.80 2k39 s GLU 16 Ca 0.46 -0.77 -0.17 0.00 0.01 0.00 0.00 54.97 54.50 2k39 s GLU 16 Cb -0.10 -2.46 0.03 0.00 -4.31 0.00 0.00 34.13 27.29 2k39 s GLU 16 CO 0.33 -0.22 0.40 0.14 0.01 0.00 0.00 175.26 175.92 2k39 s VAL 17 N 1.34 0.06 0.36 2.63 -7.23 -0.96 -4.98 120.40 111.62 2k39 s VAL 17 Ca 0.05 -0.49 0.07 0.00 -1.81 0.00 0.00 61.98 59.80 2k39 s VAL 17 Cb -0.13 -0.95 -0.00 0.00 0.56 0.00 0.00 36.38 35.85 2k39 s VAL 17 CO -0.12 -0.27 0.49 -1.61 -0.31 0.00 0.00 175.10 173.27 2k39 s GLU 18 N -2.52 3.01 0.45 4.82 0.41 -1.26 -1.24 118.70 122.36 2k39 s GLU 18 Ca -0.05 -1.10 0.24 0.00 -0.41 0.00 0.00 54.97 53.64 2k39 s GLU 18 Cb -0.01 -2.78 1.24 0.00 -1.78 0.00 0.00 34.13 30.80 2k39 s GLU 18 CO -0.03 -0.04 1.81 -1.35 -0.49 0.00 0.00 175.26 175.16 2k39 h PRO 19 N 0.84 0.26 -0.00 0.39 0.11 -1.96 -2.52 132.00 129.11 2k39 h PRO 19 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2k39 h PRO 19 Cb 1.26 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2k39 h PRO 19 CO 0.51 0.17 -0.16 -1.13 -0.21 0.00 0.00 178.00 177.17 2k39 n SER 20 N -4.47 0.56 -4.80 -2.05 3.41 -1.26 0.46 113.62 105.46 2k39 n SER 20 Ca 0.23 -0.54 -0.37 0.00 -0.26 0.00 0.00 58.87 57.93 2k39 n SER 20 Cb 0.93 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.78 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 -2.56 7.18 0.66 4.04 1.01 -0.95 -4.70 116.67 121.35 2k39 s ASP 21 Ca 0.25 1.50 -0.11 0.00 0.71 0.00 0.00 52.55 54.91 2k39 s ASP 21 Cb 0.20 -2.45 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 2k39 s ASP 21 CO 0.51 0.10 1.05 0.42 0.21 0.00 0.00 175.17 177.46 2k39 s THR 22 N -1.38 4.27 0.48 -1.27 -4.23 -1.26 -1.67 115.64 110.58 2k39 s THR 22 Ca 0.40 0.74 0.35 0.00 -1.18 0.00 0.00 61.69 62.00 2k39 s THR 22 Cb -0.19 -3.68 0.55 0.00 1.34 0.00 0.00 72.50 70.52 2k39 s THR 22 CO 0.23 -0.96 1.63 0.40 -0.54 0.00 0.00 174.62 175.37 2k39 h ILE 23 N -0.49 0.12 0.00 2.99 1.08 -1.88 -2.61 117.51 116.73 2k39 h ILE 23 Ca -0.44 -0.02 -0.01 0.00 -0.39 0.00 0.00 64.86 63.99 2k39 h ILE 23 Cb 1.21 0.06 -0.00 0.00 -3.07 0.00 0.00 36.82 35.01 2k39 h ILE 23 CO 0.61 0.01 -0.06 -0.08 -0.69 0.00 0.00 178.15 177.95 2k39 h GLU 24 N 0.06 0.00 0.08 2.37 4.81 -1.94 -2.12 114.58 117.84 2k39 h GLU 24 Ca 0.83 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 60.05 2k39 h GLU 24 Cb 2.83 0.00 0.00 0.00 0.63 0.00 0.00 28.75 32.21 2k39 h GLU 24 CO -0.28 0.06 -0.04 -0.97 -0.73 0.00 0.00 179.01 177.04 2k39 h ASN 25 N 0.00 -0.09 0.29 1.04 -0.73 -1.86 -2.78 115.58 111.45 2k39 h ASN 25 Ca -0.00 -0.48 0.00 0.00 1.87 0.00 0.00 56.30 57.69 2k39 h ASN 25 Cb 0.38 0.02 -0.04 0.00 0.27 0.00 0.00 38.32 38.96 2k39 h ASN 25 CO 0.01 0.48 -0.48 0.58 -0.37 0.00 0.00 177.43 177.65 2k39 h VAL 26 N -0.72 0.07 -0.62 2.57 2.07 -1.62 -2.00 116.25 116.00 2k39 h VAL 26 Ca -0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.62 2k39 h VAL 26 Cb 0.57 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2k39 h VAL 26 CO 0.02 0.00 0.42 0.11 0.02 0.00 0.00 177.57 178.14 2k39 h LYS 27 N -0.83 0.40 -0.01 1.57 1.57 -1.50 -0.25 116.57 117.51 2k39 h LYS 27 Ca -0.02 -0.02 -0.26 0.00 -1.87 0.00 0.00 60.65 58.48 2k39 h LYS 27 Cb 0.78 -0.09 0.02 0.00 0.08 0.00 0.00 32.23 33.02 2k39 h LYS 27 CO -0.17 0.26 -1.01 0.00 -0.57 0.00 0.00 179.45 177.96 2k39 h ALA 28 N 1.69 0.18 -0.75 3.86 0.00 -1.08 -1.78 119.26 121.38 2k39 h ALA 28 Ca 0.29 -0.69 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 2k39 h ALA 28 Cb 0.59 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2k39 h ALA 28 CO -0.08 0.71 0.26 0.87 0.00 0.00 0.00 179.25 181.01 2k39 h LYS 29 N 0.38 1.15 -0.72 0.00 1.57 -1.32 0.01 116.57 117.64 2k39 h LYS 29 Ca -0.12 -0.23 0.02 0.00 -1.87 0.00 0.00 60.65 58.45 2k39 h LYS 29 Cb 1.66 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 33.76 2k39 h LYS 29 CO 0.20 0.96 0.46 0.82 -0.57 0.00 0.00 179.45 181.32 2k39 h ILE 30 N 1.10 1.14 -0.53 1.86 2.04 -0.95 -1.55 117.51 120.61 2k39 h ILE 30 Ca 0.25 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.81 2k39 h ILE 30 Cb 0.27 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 2k39 h ILE 30 CO -0.01 0.17 0.33 -0.61 0.00 0.00 0.00 178.15 178.02 2k39 h GLN 31 N 0.92 0.64 0.00 2.37 -0.00 -1.14 -2.38 115.11 115.52 2k39 h GLN 31 Ca 0.28 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.89 2k39 h GLN 31 Cb -0.04 -0.14 0.00 0.00 0.00 0.00 0.00 27.48 27.30 2k39 h GLN 31 CO -0.09 0.42 0.00 0.22 0.00 0.00 0.00 178.83 179.39 2k39 h ASP 32 N 0.66 0.00 0.00 -0.69 3.58 -0.03 -2.23 116.42 117.71 2k39 h ASP 32 Ca 0.21 0.00 -0.31 0.00 0.42 0.00 0.00 57.03 57.35 2k39 h ASP 32 Cb -0.01 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.00 2k39 h ASP 32 CO -0.08 0.00 -1.97 0.29 -2.88 0.00 0.00 179.24 174.60 2k39 n LYS 33 N -2.97 0.57 0.00 0.28 5.02 -0.81 -4.72 118.16 115.53 2k39 n LYS 33 Ca 0.02 0.28 0.04 0.00 -2.02 0.00 0.00 58.31 56.63 2k39 n LYS 33 Cb 0.39 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.91 2k39 n LYS 33 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2k39 n GLU 34 N -4.33 1.69 -1.05 1.97 4.07 -0.90 -5.01 120.64 117.08 2k39 n GLU 34 Ca -0.40 -0.66 0.00 0.00 -0.06 0.00 0.00 57.16 56.04 2k39 n GLU 34 Cb 0.75 -1.06 0.00 0.00 -0.06 0.00 0.00 31.44 31.08 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 0.72 1.02 3.45 8.31 0.00 -0.84 -5.02 105.19 112.83 2k39 n GLY 35 Ca 0.04 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.17 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 4.46 0.14 -0.61 1.01 -1.22 -5.01 121.20 117.96 2k39 s ILE 36 Ca 0.00 -0.28 -0.30 0.00 0.00 0.00 0.00 60.65 60.07 2k39 s ILE 36 Cb 0.00 -3.18 -0.07 0.00 0.01 0.00 0.00 42.46 39.22 2k39 s ILE 36 CO 0.00 0.21 1.22 -2.16 0.00 0.00 0.00 174.94 174.21 2k39 s PRO 37 N 1.62 4.45 0.48 2.79 0.04 -1.26 -3.83 135.00 139.29 2k39 s PRO 37 Ca 0.05 1.87 0.28 0.00 0.04 0.00 0.00 61.00 63.25 2k39 s PRO 37 Cb -0.16 -3.27 0.89 0.00 0.04 0.00 0.00 34.50 32.00 2k39 s PRO 37 CO 0.05 -0.18 1.81 -1.00 0.04 0.00 0.00 177.00 177.72 2k39 h PRO 38 N 5.87 0.00 0.00 0.56 0.13 -1.96 -1.89 132.00 134.71 2k39 h PRO 38 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2k39 h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2k39 h PRO 38 CO 0.78 0.00 -0.18 -0.40 -0.23 0.00 0.00 178.00 177.97 2k39 n ASP 39 N -3.03 0.76 0.07 1.44 5.75 -1.26 -3.03 116.55 117.24 2k39 n ASP 39 Ca 0.02 0.44 0.12 0.00 -0.01 0.00 0.00 54.79 55.36 2k39 n ASP 39 Cb 0.40 -0.51 0.16 0.00 -1.03 0.00 0.00 41.12 40.14 2k39 n ASP 39 CO 0.00 0.00 0.00 -0.61 -0.11 0.00 0.00 177.20 176.48 2k39 h GLN 40 N 0.00 0.00 -6.73 0.11 4.15 -1.53 -3.39 115.11 107.71 2k39 h GLN 40 Ca 0.00 0.00 -0.50 0.00 0.77 0.00 0.00 58.65 58.92 2k39 h GLN 40 Cb 0.73 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.42 2k39 h GLN 40 CO 0.00 0.00 0.03 -0.65 -1.93 0.00 0.00 178.83 176.28 2k39 s GLN 41 N -3.18 3.72 -0.14 1.69 -0.21 -1.17 -0.72 119.66 119.65 2k39 s GLN 41 Ca 0.06 0.31 -0.06 0.00 0.02 0.00 0.00 55.36 55.69 2k39 s GLN 41 Cb 0.13 -2.47 0.07 0.00 1.00 0.00 0.00 33.01 31.73 2k39 s GLN 41 CO 0.73 0.04 0.30 0.50 -2.12 0.00 0.00 175.29 174.74 2k39 s ARG 42 N -3.79 0.21 -0.08 2.91 3.52 -0.87 -4.70 118.95 116.16 2k39 s ARG 42 Ca 0.49 0.76 0.04 0.00 -0.13 0.00 0.00 55.73 56.89 2k39 s ARG 42 Cb -0.10 0.02 -0.00 0.00 -1.56 0.00 0.00 34.95 33.30 2k39 s ARG 42 CO 0.31 -0.24 -0.21 -0.51 -0.81 0.00 0.00 175.30 173.84 2k39 s LEU 43 N 2.13 1.99 0.02 -0.88 1.02 -1.26 -0.67 118.68 121.02 2k39 s LEU 43 Ca -0.02 -0.48 0.03 0.00 0.02 0.00 0.00 54.13 53.67 2k39 s LEU 43 Cb -0.11 -1.26 -0.01 0.00 0.02 0.00 0.00 46.19 44.83 2k39 s LEU 43 CO -0.10 0.15 -0.08 -0.51 0.02 0.00 0.00 176.35 175.84 2k39 s ILE 44 N 0.27 0.61 -0.18 -0.59 2.07 -0.22 -0.71 121.20 122.45 2k39 s ILE 44 Ca -0.14 -0.69 -0.22 0.00 -1.41 0.00 0.00 60.65 58.20 2k39 s ILE 44 Cb -0.16 -0.59 0.06 0.00 0.13 0.00 0.00 42.46 41.90 2k39 s ILE 44 CO 0.06 -0.08 0.58 0.12 -1.91 0.00 0.00 174.94 173.72 2k39 s PHE 45 N -0.72 -0.61 -0.87 3.50 5.36 -0.76 -0.96 117.98 122.94 2k39 s PHE 45 Ca -0.02 1.39 0.00 0.00 -0.96 0.00 0.00 56.93 57.34 2k39 s PHE 45 Cb -0.06 0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.86 2k39 s PHE 45 CO 0.00 -0.36 0.00 0.00 -1.46 0.00 0.00 175.22 173.40 2k39 n ALA 46 N 2.34 -0.78 0.00 11.12 0.00 -1.26 -1.70 120.51 130.23 2k39 n ALA 46 Ca -0.15 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2k39 n ALA 46 Cb 0.56 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.71 2.45 3.51 0.00 0.00 -1.26 -5.04 105.19 104.14 2k39 n GLY 47 Ca -0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.63 3.79 0.19 1.61 1.02 -0.69 -5.09 119.74 119.95 2k39 s LYS 48 Ca 0.00 -0.40 -0.30 0.00 0.02 0.00 0.00 55.97 55.29 2k39 s LYS 48 Cb 0.00 -3.48 -0.08 0.00 -0.52 0.00 0.00 37.83 33.75 2k39 s LYS 48 CO 0.00 -0.18 1.19 -0.65 -0.92 0.00 0.00 175.35 174.79 2k39 s GLN 49 N 1.68 4.50 -0.25 1.68 -0.21 -1.26 -1.82 119.66 123.98 2k39 s GLN 49 Ca 0.07 1.88 -0.18 0.00 0.02 0.00 0.00 55.36 57.15 2k39 s GLN 49 Cb -0.15 -3.23 -0.03 0.00 1.00 0.00 0.00 33.01 30.59 2k39 s GLN 49 CO 0.07 -0.07 0.50 -0.51 -2.12 0.00 0.00 175.29 173.16 2k39 s LEU 50 N -0.33 4.07 -0.13 2.90 1.43 0.11 -4.99 118.68 121.74 2k39 s LEU 50 Ca 0.52 0.53 -0.28 0.00 -1.03 0.00 0.00 54.13 53.87 2k39 s LEU 50 Cb -0.33 -2.64 -0.01 0.00 0.03 0.00 0.00 46.19 43.24 2k39 s LEU 50 CO 0.37 -0.25 0.95 -0.70 0.23 0.00 0.00 176.35 176.95 2k39 s GLU 51 N 2.11 4.38 -0.36 1.70 2.12 -1.26 -4.81 118.70 122.58 2k39 s GLU 51 Ca 0.21 1.26 -0.28 0.00 0.36 0.00 0.00 54.97 56.52 2k39 s GLU 51 Cb -0.16 -3.55 -0.03 0.00 0.26 0.00 0.00 34.13 30.66 2k39 s GLU 51 CO 0.09 -0.32 1.89 -0.51 -0.54 0.00 0.00 175.26 175.87 2k39 s ASP 52 N 1.11 5.69 0.00 -1.70 1.11 -1.26 -3.05 116.67 118.57 2k39 s ASP 52 Ca 0.45 1.26 0.00 0.00 0.18 0.00 0.00 52.55 54.44 2k39 s ASP 52 Cb -0.18 -2.52 0.00 0.00 1.07 0.00 0.00 42.92 41.29 2k39 s ASP 52 CO 0.16 -1.88 0.00 0.61 1.18 0.00 0.00 175.17 175.24 2k39 n GLY 53 N 5.53 1.20 3.74 0.21 0.00 -1.26 -5.08 105.19 109.52 2k39 n GLY 53 Ca 0.24 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.06 2.95 0.25 1.61 0.52 -1.17 -5.05 118.95 117.99 2k39 s ARG 54 Ca 0.00 -0.53 -0.20 0.00 -0.52 0.00 0.00 55.73 54.48 2k39 s ARG 54 Cb 0.00 -2.78 -0.09 0.00 0.52 0.00 0.00 34.95 32.60 2k39 s ARG 54 CO 0.00 0.64 0.76 0.95 0.02 0.00 0.00 175.30 177.67 2k39 s THR 55 N -1.13 4.52 0.28 0.02 -4.23 -1.26 -3.82 115.64 110.01 2k39 s THR 55 Ca 0.21 1.34 -0.06 0.00 -1.18 0.00 0.00 61.69 62.00 2k39 s THR 55 Cb -0.12 -3.85 0.40 0.00 1.34 0.00 0.00 72.50 70.27 2k39 s THR 55 CO 0.12 0.15 1.58 0.25 -0.54 0.00 0.00 174.62 176.18 2k39 h LEU 56 N 3.25 -0.69 -1.82 4.79 5.85 -1.25 0.17 115.31 125.62 2k39 h LEU 56 Ca -0.48 0.27 0.16 0.00 0.84 0.00 0.00 57.88 58.67 2k39 h LEU 56 Cb 1.19 0.52 -0.03 0.00 0.37 0.00 0.00 40.66 42.71 2k39 h LEU 56 CO 0.65 -0.31 0.45 -1.28 -0.34 0.00 0.00 178.44 177.62 2k39 h SER 57 N 0.02 0.17 0.17 1.25 0.87 -0.29 -1.24 113.55 114.49 2k39 h SER 57 Ca 0.49 0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.97 2k39 h SER 57 Cb 0.85 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 2k39 h SER 57 CO -0.91 0.09 -0.32 -0.78 -0.53 0.00 0.00 176.83 174.37 2k39 h ASP 58 N 0.18 0.24 0.41 6.23 3.58 -0.92 -1.89 116.42 124.26 2k39 h ASP 58 Ca 0.32 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2k39 h ASP 58 Cb 0.99 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.98 2k39 h ASP 58 CO -0.05 0.56 -0.31 -1.22 -2.88 0.00 0.00 179.24 175.34 2k39 n TYR 59 N -4.10 0.00 -4.02 0.28 4.01 -0.49 -4.96 117.16 107.88 2k39 n TYR 59 Ca -0.01 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.41 2k39 n TYR 59 Cb 0.41 -0.21 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 0.09 -0.46 0.00 0.00 176.86 176.49 2k39 n ASN 60 N -1.09 -4.34 -4.73 7.72 3.02 -0.71 -4.98 115.26 110.16 2k39 n ASN 60 Ca 0.10 -0.85 -0.41 0.00 -0.03 0.00 0.00 54.58 53.38 2k39 n ASN 60 Cb 0.33 -3.52 -0.04 0.00 -0.61 0.00 0.00 39.78 35.93 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 -3.30 4.51 0.41 2.41 1.01 -1.24 -5.04 121.20 119.96 2k39 s ILE 61 Ca 0.69 2.07 0.07 0.00 0.00 0.00 0.00 60.65 63.48 2k39 s ILE 61 Cb -0.36 -4.32 -0.08 0.00 0.01 0.00 0.00 42.46 37.71 2k39 s ILE 61 CO 0.86 0.31 0.01 -1.10 0.00 0.00 0.00 174.94 175.03 2k39 s GLN 62 N 0.03 1.97 -0.03 2.79 -1.52 -1.26 -4.74 119.66 116.90 2k39 s GLN 62 Ca 0.47 -2.08 -0.37 0.00 -1.95 0.00 0.00 55.36 51.43 2k39 s GLN 62 Cb -0.23 -1.67 -0.16 0.00 -0.22 0.00 0.00 33.01 30.73 2k39 s GLN 62 CO 0.30 -0.04 1.52 0.36 -0.25 0.00 0.00 175.29 177.18 2k39 n LYS 63 N -0.98 1.29 -0.90 2.91 2.85 -1.26 -2.04 118.16 120.04 2k39 n LYS 63 Ca -0.05 0.47 0.00 0.00 -1.05 0.00 0.00 58.31 57.68 2k39 n LYS 63 Cb 0.67 -2.15 0.00 0.00 -0.65 0.00 0.00 35.03 32.90 2k39 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2k39 n GLU 64 N 3.72 -0.50 -1.71 -1.58 1.02 -0.16 -4.98 120.64 116.46 2k39 n GLU 64 Ca 0.21 0.12 -0.43 0.00 -0.02 0.00 0.00 57.16 57.05 2k39 n GLU 64 Cb 0.19 -3.67 -0.03 0.00 -0.02 0.00 0.00 31.44 27.90 2k39 n GLU 64 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2k39 n SER 65 N -0.25 3.91 -4.67 1.62 7.64 -0.87 -4.57 113.62 116.43 2k39 n SER 65 Ca 0.00 1.05 -0.42 0.00 1.01 0.00 0.00 58.87 60.51 2k39 n SER 65 Cb 0.12 -1.55 -0.04 0.00 -1.01 0.00 0.00 64.21 61.74 2k39 n SER 65 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2k39 s THR 66 N 1.48 4.85 0.19 0.44 2.01 -1.26 -3.26 115.64 120.09 2k39 s THR 66 Ca 0.77 1.74 0.09 0.00 0.31 0.00 0.00 61.69 64.60 2k39 s THR 66 Cb -0.52 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 67.76 2k39 s THR 66 CO 0.34 0.01 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.34 2k39 s LEU 67 N 2.19 2.48 0.08 4.42 1.43 -1.09 -4.93 118.68 123.26 2k39 s LEU 67 Ca 0.41 -0.91 0.08 0.00 -1.03 0.00 0.00 54.13 52.68 2k39 s LEU 67 Cb -0.17 -0.86 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 2k39 s LEU 67 CO 0.13 -0.04 -0.21 -1.00 0.23 0.00 0.00 176.35 175.46 2k39 s HIS 68 N -2.24 1.84 -0.13 0.29 3.76 -0.13 -0.74 115.29 117.94 2k39 s HIS 68 Ca 0.19 -0.40 0.02 0.00 -0.15 0.00 0.00 55.06 54.72 2k39 s HIS 68 Cb -0.05 -1.04 -0.00 0.00 1.11 0.00 0.00 32.58 32.60 2k39 s HIS 68 CO 0.08 0.17 -0.19 -1.17 -0.85 0.00 0.00 174.74 172.78 2k39 s LEU 69 N -1.66 2.33 0.35 0.89 2.96 -0.02 -1.06 118.68 122.48 2k39 s LEU 69 Ca 0.07 -0.50 0.09 0.00 -0.22 0.00 0.00 54.13 53.58 2k39 s LEU 69 Cb -0.10 -1.50 -0.06 0.00 0.50 0.00 0.00 46.19 45.03 2k39 s LEU 69 CO 0.03 0.12 -0.09 0.68 -1.32 0.00 0.00 176.35 175.78 2k39 s VAL 70 N 0.57 2.24 -0.10 1.68 -7.23 0.15 -3.26 120.40 114.45 2k39 s VAL 70 Ca -0.11 -2.20 -0.07 0.00 -1.81 0.00 0.00 61.98 57.80 2k39 s VAL 70 Cb -0.16 -2.66 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 2k39 s VAL 70 CO 0.04 -0.20 0.16 -0.76 -0.31 0.00 0.00 175.10 174.03 2k39 s LEU 71 N -3.61 4.39 -0.21 1.32 1.43 -1.26 -2.04 118.68 118.69 2k39 s LEU 71 Ca 0.33 0.47 -0.07 0.00 -1.03 0.00 0.00 54.13 53.83 2k39 s LEU 71 Cb 0.03 -2.19 0.10 0.00 0.03 0.00 0.00 46.19 44.15 2k39 s LEU 71 CO 0.17 0.38 0.43 -0.60 0.23 0.00 0.00 176.35 176.96 2k39 s ARG 72 N -1.20 0.35 -0.89 1.70 3.52 0.10 -4.87 118.95 117.66 2k39 s ARG 72 Ca 0.18 1.03 -0.04 0.00 -0.13 0.00 0.00 55.73 56.76 2k39 s ARG 72 Cb -0.12 0.31 0.14 0.00 -1.56 0.00 0.00 34.95 33.72 2k39 s ARG 72 CO 0.07 -0.28 2.45 1.28 -0.81 0.00 0.00 175.30 178.01 2k39 n LEU 73 N 5.39 7.28 -3.64 -0.88 4.32 -1.26 -4.31 117.00 123.90 2k39 n LEU 73 Ca -0.08 -4.60 -0.03 0.00 -0.02 0.00 0.00 56.01 51.28 2k39 n LEU 73 Cb 0.49 -1.26 -0.07 0.00 -1.62 0.00 0.00 43.42 40.97 2k39 n LEU 73 CO 0.00 1.90 0.68 -0.60 -1.22 0.00 0.00 177.39 178.15 2k39 s ARG 74 N -2.00 0.39 -0.59 3.23 3.52 -1.26 -5.06 118.95 117.18 2k39 s ARG 74 Ca 0.54 0.66 0.04 0.00 -0.13 0.00 0.00 55.73 56.84 2k39 s ARG 74 Cb 0.29 0.09 0.15 0.00 -1.56 0.00 0.00 34.95 33.92 2k39 s ARG 74 CO -0.18 -0.08 0.37 0.20 -0.81 0.00 0.00 175.30 174.80 2k39 s GLY 75 N 1.25 2.52 0.00 8.12 0.00 -1.26 -4.99 107.32 112.96 2k39 s GLY 75 Ca -0.08 -3.42 0.00 0.00 0.00 0.00 0.00 44.72 41.22 2k39 s GLY 75 CO -0.14 1.17 0.00 0.61 0.00 0.00 0.00 173.10 174.74