#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 4.46 0.12 2.12 0.74 -1.26 -1.61 119.66 124.22 2k39 s GLN 2 Ca 0.00 1.91 0.04 0.00 0.05 0.00 0.00 55.36 57.36 2k39 s GLN 2 Cb 0.00 -3.24 -0.04 0.00 1.10 0.00 0.00 33.01 30.83 2k39 s GLN 2 CO 0.00 -0.15 -0.10 0.96 -0.55 0.00 0.00 175.29 175.45 2k39 s ILE 3 N 0.15 1.00 0.14 -2.34 -4.36 -0.95 -1.29 121.20 113.54 2k39 s ILE 3 Ca 0.55 -1.83 0.11 0.00 -0.26 0.00 0.00 60.65 59.21 2k39 s ILE 3 Cb -0.33 -1.58 -0.04 0.00 1.25 0.00 0.00 42.46 41.75 2k39 s ILE 3 CO 0.36 -0.67 -0.25 -0.36 0.24 0.00 0.00 174.94 174.26 2k39 s PHE 4 N -2.91 2.21 -0.03 1.37 0.40 -0.92 -1.99 117.98 116.11 2k39 s PHE 4 Ca 0.10 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.07 2k39 s PHE 4 Cb 0.00 -1.17 0.00 0.00 0.51 0.00 0.00 43.02 42.36 2k39 s PHE 4 CO -0.00 0.35 -0.09 0.08 0.70 0.00 0.00 175.22 176.26 2k39 s VAL 5 N -1.23 0.79 -0.26 -0.44 1.01 0.33 -1.97 120.40 118.63 2k39 s VAL 5 Ca 0.14 -0.36 -0.09 0.00 0.00 0.00 0.00 61.98 61.68 2k39 s VAL 5 Cb -0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 2k39 s VAL 5 CO 0.06 0.25 0.12 -0.75 0.00 0.00 0.00 175.10 174.78 2k39 s LYS 6 N 0.24 3.78 -0.10 2.72 2.20 0.96 -1.54 119.74 128.00 2k39 s LYS 6 Ca -0.04 -0.41 -0.11 0.00 -0.36 0.00 0.00 55.97 55.05 2k39 s LYS 6 Cb -0.09 -3.46 -0.05 0.00 -1.51 0.00 0.00 37.83 32.73 2k39 s LYS 6 CO 0.01 -0.17 0.25 0.99 -0.36 0.00 0.00 175.35 176.06 2k39 s THR 7 N 1.64 5.32 0.12 3.43 2.01 -0.83 -1.83 115.64 125.50 2k39 s THR 7 Ca 0.07 0.46 0.04 0.00 0.31 0.00 0.00 61.69 62.56 2k39 s THR 7 Cb -0.15 -3.54 0.14 0.00 0.01 0.00 0.00 72.50 68.95 2k39 s THR 7 CO 0.06 0.55 0.55 0.18 -0.69 0.00 0.00 174.62 175.28 2k39 n LEU 8 N 2.37 0.05 0.12 4.42 4.77 -1.25 0.36 117.00 127.84 2k39 n LEU 8 Ca -0.16 0.59 0.12 0.00 -0.03 0.00 0.00 56.01 56.53 2k39 n LEU 8 Cb 0.53 -0.25 0.26 0.00 -2.33 0.00 0.00 43.42 41.63 2k39 n LEU 8 CO 0.35 -0.63 0.66 0.71 -1.33 0.00 0.00 177.39 177.15 2k39 h THR 9 N 0.00 0.00 0.00 -5.08 1.35 -1.93 -3.47 112.91 103.78 2k39 h THR 9 Ca 0.26 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 2k39 h THR 9 Cb 0.63 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 2k39 h THR 9 CO -0.30 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.58 2k39 n GLY 10 N 1.26 0.95 3.72 5.82 0.00 0.16 -5.11 105.19 112.00 2k39 n GLY 10 Ca 0.04 0.00 -0.41 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 -0.29 4.62 -0.19 1.61 2.20 -1.24 -4.88 119.74 121.57 2k39 s LYS 11 Ca 0.00 1.39 -0.07 0.00 -0.36 0.00 0.00 55.97 56.93 2k39 s LYS 11 Cb 0.00 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.87 2k39 s LYS 11 CO 0.00 0.11 0.04 0.99 -0.36 0.00 0.00 175.35 176.13 2k39 s THR 12 N 0.42 4.54 -0.03 3.43 2.01 -1.26 -1.97 115.64 122.77 2k39 s THR 12 Ca 0.48 -0.12 0.03 0.00 0.31 0.00 0.00 61.69 62.39 2k39 s THR 12 Cb -0.22 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.24 2k39 s THR 12 CO 0.28 0.45 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.90 2k39 s ILE 13 N 0.57 1.07 0.06 1.82 1.01 -0.59 -5.01 121.20 120.14 2k39 s ILE 13 Ca 0.02 -0.51 0.06 0.00 0.00 0.00 0.00 60.65 60.22 2k39 s ILE 13 Cb -0.13 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.37 2k39 s ILE 13 CO 0.02 0.32 -0.18 0.28 0.00 0.00 0.00 174.94 175.38 2k39 s THR 14 N 0.15 1.44 -0.06 2.92 -1.32 -1.26 -0.51 115.64 116.99 2k39 s THR 14 Ca -0.04 -1.23 -0.03 0.00 -1.21 0.00 0.00 61.69 59.18 2k39 s THR 14 Cb -0.10 -1.29 0.04 0.00 -1.51 0.00 0.00 72.50 69.64 2k39 s THR 14 CO 0.01 0.02 0.14 -0.76 -2.21 0.00 0.00 174.62 171.82 2k39 s LEU 15 N -1.41 0.74 -0.09 9.08 1.02 -0.84 -5.01 118.68 122.17 2k39 s LEU 15 Ca 0.04 0.28 -0.30 0.00 0.02 0.00 0.00 54.13 54.17 2k39 s LEU 15 Cb -0.09 0.33 -0.03 0.00 0.02 0.00 0.00 46.19 46.42 2k39 s LEU 15 CO 0.02 -0.15 1.21 -1.61 0.02 0.00 0.00 176.35 175.85 2k39 s GLU 16 N 1.18 4.32 0.28 1.70 8.01 -1.26 -2.25 118.70 130.68 2k39 s GLU 16 Ca -0.09 1.66 0.03 0.00 0.01 0.00 0.00 54.97 56.58 2k39 s GLU 16 Cb -0.12 -3.61 -0.04 0.00 -4.31 0.00 0.00 34.13 26.05 2k39 s GLU 16 CO -0.06 -0.52 0.17 0.14 0.01 0.00 0.00 175.26 175.00 2k39 s VAL 17 N 2.58 0.22 0.15 2.63 -7.23 -0.64 -4.91 120.40 113.20 2k39 s VAL 17 Ca 0.55 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.77 2k39 s VAL 17 Cb -0.24 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 2k39 s VAL 17 CO 0.20 0.00 0.13 -1.61 -0.31 0.00 0.00 175.10 173.51 2k39 s GLU 18 N -3.86 2.91 0.33 4.82 0.41 -1.26 0.21 118.70 122.27 2k39 s GLU 18 Ca 0.37 -0.84 0.13 0.00 -0.41 0.00 0.00 54.97 54.22 2k39 s GLU 18 Cb 0.05 -2.66 0.58 0.00 -1.78 0.00 0.00 34.13 30.32 2k39 s GLU 18 CO 0.17 0.49 1.73 -1.00 -0.49 0.00 0.00 175.26 176.17 2k39 h PRO 19 N 2.50 0.00 0.00 0.39 0.13 -1.93 -3.18 132.00 129.91 2k39 h PRO 19 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2k39 h PRO 19 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k39 h PRO 19 CO 0.64 0.47 0.00 0.77 -0.23 0.00 0.00 178.00 179.65 2k39 h SER 20 N 0.00 0.00 -3.16 1.44 0.02 -1.98 -2.74 113.55 107.13 2k39 h SER 20 Ca -0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2k39 h SER 20 Cb 0.87 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.45 2k39 h SER 20 CO 0.06 0.00 0.79 -1.81 -1.14 0.00 0.00 176.83 174.74 2k39 s ASP 21 N -4.84 6.65 0.51 3.07 1.01 -1.20 -4.89 116.67 116.97 2k39 s ASP 21 Ca 0.04 2.62 -0.19 0.00 0.71 0.00 0.00 52.55 55.73 2k39 s ASP 21 Cb 0.09 -2.61 -0.13 0.00 1.01 0.00 0.00 42.92 41.29 2k39 s ASP 21 CO 0.48 -0.74 0.19 0.35 0.21 0.00 0.00 175.17 175.66 2k39 n THR 22 N 3.02 1.02 -0.20 -1.27 -2.24 -1.26 -2.98 114.28 110.37 2k39 n THR 22 Ca 0.09 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.28 2k39 n THR 22 Cb 0.40 -0.29 0.03 0.00 -2.10 0.00 0.00 70.33 68.37 2k39 n THR 22 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2k39 h ILE 23 N 0.20 1.27 -0.90 2.28 1.08 -1.87 -3.27 117.51 116.29 2k39 h ILE 23 Ca -0.42 -1.18 0.12 0.00 -0.39 0.00 0.00 64.86 62.99 2k39 h ILE 23 Cb 1.43 0.85 -0.07 0.00 -3.07 0.00 0.00 36.82 35.95 2k39 h ILE 23 CO 0.45 0.43 0.58 -0.08 -0.69 0.00 0.00 178.15 178.84 2k39 h GLU 24 N 0.95 0.79 -0.36 2.37 4.81 -1.90 -1.41 114.58 119.83 2k39 h GLU 24 Ca 0.16 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.41 2k39 h GLU 24 Cb 0.59 -0.18 -0.06 0.00 0.63 0.00 0.00 28.75 29.73 2k39 h GLU 24 CO 0.04 0.52 -0.03 -0.97 -0.73 0.00 0.00 179.01 177.84 2k39 h ASN 25 N 0.81 -0.21 1.07 1.04 -0.00 -1.95 -3.08 115.58 113.27 2k39 h ASN 25 Ca 0.44 0.09 0.00 0.00 -0.00 0.00 0.00 56.30 56.83 2k39 h ASN 25 Cb 0.56 0.17 0.00 0.00 -0.00 0.00 0.00 38.32 39.05 2k39 h ASN 25 CO -0.20 -0.07 0.00 0.52 -0.00 0.00 0.00 177.43 177.68 2k39 n VAL 26 N -5.22 0.66 0.08 2.57 0.31 -0.56 -0.92 118.33 115.26 2k39 n VAL 26 Ca 0.02 -0.02 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 2k39 n VAL 26 Cb 0.19 -0.83 -0.07 0.00 -0.91 0.00 0.00 33.84 32.22 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 0.00 0.15 0.00 5.55 1.57 -1.52 -2.95 116.57 119.37 2k39 h LYS 27 Ca 0.00 -0.21 -0.24 0.00 -1.87 0.00 0.00 60.65 58.32 2k39 h LYS 27 Cb 0.53 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.88 2k39 h LYS 27 CO 0.00 1.03 -1.42 0.00 -0.57 0.00 0.00 179.45 178.49 2k39 h ALA 28 N 0.89 0.64 -0.17 3.86 0.00 -1.16 -3.18 119.26 120.14 2k39 h ALA 28 Ca -0.06 -1.19 -0.04 0.00 0.00 0.00 0.00 54.91 53.62 2k39 h ALA 28 Cb 1.69 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 2k39 h ALA 28 CO 0.15 1.37 -0.08 0.87 0.00 0.00 0.00 179.25 181.56 2k39 h LYS 29 N 0.00 0.26 0.00 0.00 1.57 -1.12 0.17 116.57 117.46 2k39 h LYS 29 Ca -0.18 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 2k39 h LYS 29 Cb 1.86 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 34.12 2k39 h LYS 29 CO 0.09 0.36 -0.26 0.82 -0.57 0.00 0.00 179.45 179.88 2k39 h ILE 30 N 0.25 1.06 -0.11 1.86 2.04 -1.52 -2.02 117.51 119.08 2k39 h ILE 30 Ca 0.06 -0.93 -0.22 0.00 1.00 0.00 0.00 64.86 64.76 2k39 h ILE 30 Cb 0.31 1.52 0.01 0.00 -0.74 0.00 0.00 36.82 37.91 2k39 h ILE 30 CO 0.01 0.25 -0.82 -0.61 0.00 0.00 0.00 178.15 176.99 2k39 h GLN 31 N 0.00 0.69 -0.43 2.37 4.15 -0.66 0.25 115.11 121.48 2k39 h GLN 31 Ca -0.00 -0.59 0.08 0.00 0.77 0.00 0.00 58.65 58.90 2k39 h GLN 31 Cb 0.50 0.13 -0.07 0.00 0.21 0.00 0.00 27.48 28.25 2k39 h GLN 31 CO 0.03 1.20 -0.00 0.22 -1.93 0.00 0.00 178.83 178.35 2k39 h ASP 32 N 0.45 -0.19 0.26 -0.69 3.58 -1.39 -2.57 116.42 115.87 2k39 h ASP 32 Ca -0.06 0.10 -0.34 0.00 0.42 0.00 0.00 57.03 57.15 2k39 h ASP 32 Cb 1.44 0.18 -0.02 0.00 1.72 0.00 0.00 39.33 42.65 2k39 h ASP 32 CO 0.16 -0.06 -1.85 0.11 -2.88 0.00 0.00 179.24 174.73 2k39 h LYS 33 N 0.10 0.22 0.00 0.28 6.56 -1.25 -3.43 116.57 119.05 2k39 h LYS 33 Ca 0.21 -0.37 0.00 0.00 -1.06 0.00 0.00 60.65 59.43 2k39 h LYS 33 Cb 0.31 0.14 0.00 0.00 -0.57 0.00 0.00 32.23 32.11 2k39 h LYS 33 CO -0.36 1.05 -0.08 0.39 -2.06 0.00 0.00 179.45 178.39 2k39 n GLU 34 N -3.39 2.97 0.00 3.15 -0.58 0.76 -5.04 120.64 118.50 2k39 n GLU 34 Ca -0.26 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.48 2k39 n GLU 34 Cb 1.05 -0.32 0.00 0.00 -0.57 0.00 0.00 31.44 31.60 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 0.28 1.07 3.73 0.62 0.00 -0.39 -4.99 105.19 105.51 2k39 n GLY 35 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 5.17 0.50 -0.61 1.01 -1.23 -4.88 121.20 119.16 2k39 s ILE 36 Ca 0.00 0.10 -0.19 0.00 0.00 0.00 0.00 60.65 60.55 2k39 s ILE 36 Cb 0.00 -3.31 -0.08 0.00 0.01 0.00 0.00 42.46 39.08 2k39 s ILE 36 CO 0.00 0.50 1.04 -2.16 0.00 0.00 0.00 174.94 174.32 2k39 s PRO 37 N -0.06 3.74 0.33 2.79 0.04 -1.26 -3.27 135.00 137.31 2k39 s PRO 37 Ca 0.09 1.31 0.11 0.00 0.04 0.00 0.00 61.00 62.55 2k39 s PRO 37 Cb -0.12 -2.09 0.96 0.00 0.04 0.00 0.00 34.50 33.30 2k39 s PRO 37 CO 0.00 -0.47 1.70 -1.35 0.04 0.00 0.00 177.00 176.92 2k39 h PRO 38 N 1.37 0.45 -0.60 0.56 0.11 -1.93 -3.32 132.00 128.64 2k39 h PRO 38 Ca -0.49 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.63 2k39 h PRO 38 Cb 1.22 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 2k39 h PRO 38 CO 0.59 0.30 0.36 0.22 -0.21 0.00 0.00 178.00 179.25 2k39 h ASP 39 N 0.46 0.57 -0.03 -2.05 3.58 -1.95 -2.95 116.42 114.05 2k39 h ASP 39 Ca 0.68 0.01 0.00 0.00 0.42 0.00 0.00 57.03 58.14 2k39 h ASP 39 Cb 1.41 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.35 2k39 h ASP 39 CO -0.54 0.40 -0.14 0.00 -2.88 0.00 0.00 179.24 176.08 2k39 n GLN 40 N -4.76 1.97 -3.46 0.28 1.13 -1.25 -4.88 117.38 106.42 2k39 n GLN 40 Ca 0.06 -1.64 -0.38 0.00 -1.94 0.00 0.00 57.00 53.11 2k39 n GLN 40 Cb 0.10 -1.46 -0.08 0.00 0.11 0.00 0.00 30.24 28.91 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 -2.10 4.16 -0.06 -1.09 0.74 -1.12 0.30 119.66 120.49 2k39 s GLN 41 Ca 0.25 0.10 0.04 0.00 0.05 0.00 0.00 55.36 55.80 2k39 s GLN 41 Cb 0.19 -3.52 0.00 0.00 1.10 0.00 0.00 33.01 30.78 2k39 s GLN 41 CO 0.37 0.01 -0.19 0.50 -0.55 0.00 0.00 175.29 175.44 2k39 s ARG 42 N 1.17 2.18 0.12 1.67 3.52 -1.02 -4.95 118.95 121.65 2k39 s ARG 42 Ca 0.16 -0.67 0.07 0.00 -0.13 0.00 0.00 55.73 55.16 2k39 s ARG 42 Cb -0.14 -1.79 -0.04 0.00 -1.56 0.00 0.00 34.95 31.42 2k39 s ARG 42 CO 0.07 0.20 -0.06 -0.51 -0.81 0.00 0.00 175.30 174.19 2k39 s LEU 43 N 0.22 3.17 -0.05 -0.88 1.43 -1.26 -1.91 118.68 119.40 2k39 s LEU 43 Ca -0.10 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 52.66 2k39 s LEU 43 Cb -0.14 -1.92 0.01 0.00 0.03 0.00 0.00 46.19 44.17 2k39 s LEU 43 CO 0.04 0.15 -0.11 -0.63 0.23 0.00 0.00 176.35 176.04 2k39 s ILE 44 N -1.37 1.01 -0.09 -0.59 1.01 -0.02 -1.46 121.20 119.69 2k39 s ILE 44 Ca 0.24 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 2k39 s ILE 44 Cb -0.11 -0.92 0.05 0.00 0.01 0.00 0.00 42.46 41.49 2k39 s ILE 44 CO 0.16 0.32 0.13 0.12 0.00 0.00 0.00 174.94 175.67 2k39 s PHE 45 N 0.55 -0.09 -1.39 3.97 5.36 -1.03 -1.08 117.98 124.27 2k39 s PHE 45 Ca -0.11 0.41 0.00 0.00 -0.96 0.00 0.00 56.93 56.27 2k39 s PHE 45 Cb -0.14 -0.36 0.00 0.00 -0.34 0.00 0.00 43.02 42.18 2k39 s PHE 45 CO 0.02 -0.29 0.00 0.00 -1.46 0.00 0.00 175.22 173.49 2k39 n ALA 46 N 5.31 -0.38 0.00 11.12 0.00 -1.26 -2.29 120.51 133.00 2k39 n ALA 46 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2k39 n ALA 46 Cb 0.50 -1.70 0.00 0.00 0.00 0.00 0.00 19.45 18.24 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 -1.04 3.31 3.86 0.00 0.00 -1.26 -5.06 105.19 104.99 2k39 n GLY 47 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.83 3.76 0.25 1.61 1.02 -0.97 -5.06 119.74 119.50 2k39 s LYS 48 Ca 0.00 0.19 -0.30 0.00 0.02 0.00 0.00 55.97 55.88 2k39 s LYS 48 Cb 0.00 -3.08 -0.09 0.00 -0.52 0.00 0.00 37.83 34.14 2k39 s LYS 48 CO 0.00 0.62 1.21 1.14 -0.92 0.00 0.00 175.35 177.40 2k39 s GLN 49 N -1.62 4.49 -0.09 1.68 -2.07 -1.26 -2.48 119.66 118.30 2k39 s GLN 49 Ca 0.29 1.96 -0.03 0.00 -1.82 0.00 0.00 55.36 55.76 2k39 s GLN 49 Cb -0.14 -3.18 -0.04 0.00 -1.09 0.00 0.00 33.01 28.56 2k39 s GLN 49 CO 0.16 -0.05 0.05 -0.51 -1.32 0.00 0.00 175.29 173.61 2k39 s LEU 50 N -0.89 3.85 0.15 2.60 1.43 -0.53 -5.00 118.68 120.29 2k39 s LEU 50 Ca 0.50 0.24 0.06 0.00 -1.03 0.00 0.00 54.13 53.91 2k39 s LEU 50 Cb -0.35 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 2k39 s LEU 50 CO 0.42 0.38 -0.13 -1.61 0.23 0.00 0.00 176.35 175.63 2k39 s GLU 51 N -1.00 1.12 0.38 1.70 0.41 -1.26 -4.56 118.70 115.49 2k39 s GLU 51 Ca 0.15 -1.38 -0.28 0.00 -0.41 0.00 0.00 54.97 53.04 2k39 s GLU 51 Cb -0.12 -0.91 -0.11 0.00 -1.78 0.00 0.00 34.13 31.21 2k39 s GLU 51 CO 0.04 0.16 1.46 -0.40 -0.49 0.00 0.00 175.26 176.02 2k39 n ASP 52 N 0.12 3.62 0.00 -0.19 5.75 -1.26 -3.97 116.55 120.62 2k39 n ASP 52 Ca -0.12 1.22 0.00 0.00 -0.01 0.00 0.00 54.79 55.88 2k39 n ASP 52 Cb 0.59 -1.60 0.00 0.00 -1.03 0.00 0.00 41.12 39.08 2k39 n ASP 52 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k39 n GLY 53 N 0.50 3.45 4.01 6.12 0.00 -1.26 -5.04 105.19 112.98 2k39 n GLY 53 Ca 0.02 -1.00 -0.19 0.00 0.00 0.00 0.00 46.02 44.84 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 0.00 2.45 0.27 1.61 0.52 -1.25 -5.00 118.95 117.55 2k39 s ARG 54 Ca 0.00 -1.55 0.10 0.00 -0.52 0.00 0.00 55.73 53.75 2k39 s ARG 54 Cb 0.00 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.78 2k39 s ARG 54 CO 0.00 -0.66 -0.15 0.95 0.02 0.00 0.00 175.30 175.46 2k39 s THR 55 N -2.58 2.13 0.39 0.02 -4.23 -1.26 -3.33 115.64 106.78 2k39 s THR 55 Ca 0.58 -2.29 0.12 0.00 -1.18 0.00 0.00 61.69 58.92 2k39 s THR 55 Cb -0.07 -2.31 0.33 0.00 1.34 0.00 0.00 72.50 71.80 2k39 s THR 55 CO 0.36 -0.41 1.92 -0.07 -0.54 0.00 0.00 174.62 175.88 2k39 h LEU 56 N 2.31 0.52 -0.45 4.79 3.38 -1.60 -1.82 115.31 122.44 2k39 h LEU 56 Ca -0.40 0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.63 2k39 h LEU 56 Cb 1.24 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.87 2k39 h LEU 56 CO 0.63 0.28 0.23 -1.28 0.09 0.00 0.00 178.44 178.40 2k39 h SER 57 N 0.56 0.34 -0.75 -0.43 0.87 -1.75 -2.21 113.55 110.18 2k39 h SER 57 Ca 0.37 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.97 2k39 h SER 57 Cb 0.67 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.55 2k39 h SER 57 CO -0.14 0.24 0.50 0.44 -0.53 0.00 0.00 176.83 177.34 2k39 h ASP 58 N 0.46 0.85 -0.34 6.23 3.32 -1.65 -1.86 116.42 123.44 2k39 h ASP 58 Ca 0.19 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2k39 h ASP 58 Cb 0.09 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.43 2k39 h ASP 58 CO -0.13 0.62 0.00 -1.22 -1.72 0.00 0.00 179.24 176.78 2k39 n TYR 59 N -4.42 0.79 -1.02 4.55 4.01 -1.06 -4.96 117.16 115.05 2k39 n TYR 59 Ca 0.08 -0.31 -0.01 0.00 -0.16 0.00 0.00 57.90 57.50 2k39 n TYR 59 Cb 0.04 -0.16 -0.00 0.00 -0.31 0.00 0.00 39.34 38.90 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 0.46 -4.25 -4.64 7.72 4.13 -0.70 -4.97 115.26 113.01 2k39 n ASN 60 Ca 0.13 0.02 -0.46 0.00 1.68 0.00 0.00 54.58 55.95 2k39 n ASN 60 Cb 0.53 -1.82 -0.03 0.00 -1.54 0.00 0.00 39.78 36.92 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2k39 n ILE 61 N -2.59 0.91 -4.06 2.41 5.41 -0.88 -4.98 119.36 115.57 2k39 n ILE 61 Ca -0.01 -0.23 -0.13 0.00 1.00 0.00 0.00 62.75 63.39 2k39 n ILE 61 Cb 0.22 -1.26 -0.04 0.00 -0.71 0.00 0.00 39.64 37.85 2k39 n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k39 n GLN 62 N 1.97 0.46 -1.49 0.38 1.13 -1.26 -4.67 117.38 113.89 2k39 n GLN 62 Ca 0.13 -2.36 -0.44 0.00 -1.94 0.00 0.00 57.00 52.39 2k39 n GLN 62 Cb 0.29 2.12 -0.07 0.00 0.11 0.00 0.00 30.24 32.69 2k39 n GLN 62 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 2k39 n LYS 63 N -0.47 0.88 -1.41 -1.09 4.81 -1.26 -1.56 118.16 118.06 2k39 n LYS 63 Ca 0.03 0.15 -0.10 0.00 -0.87 0.00 0.00 58.31 57.52 2k39 n LYS 63 Cb 0.46 -2.60 -0.04 0.00 0.02 0.00 0.00 35.03 32.88 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 8.54 -0.68 -1.67 1.64 2.13 -0.41 -4.99 120.64 125.21 2k39 n GLU 64 Ca 0.45 0.78 -0.44 0.00 0.66 0.00 0.00 57.16 58.60 2k39 n GLU 64 Cb 0.29 -4.70 -0.04 0.00 0.27 0.00 0.00 31.44 27.27 2k39 n GLU 64 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2k39 n SER 65 N 0.42 3.90 -4.64 4.31 7.64 -0.60 -4.71 113.62 119.93 2k39 n SER 65 Ca -0.10 0.91 -0.39 0.00 1.01 0.00 0.00 58.87 60.30 2k39 n SER 65 Cb 0.35 -1.47 -0.07 0.00 -1.01 0.00 0.00 64.21 62.01 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 4.42 5.12 0.43 0.44 2.01 -1.26 -2.18 115.64 124.62 2k39 s THR 66 Ca 0.91 0.84 0.07 0.00 0.31 0.00 0.00 61.69 63.81 2k39 s THR 66 Cb -0.53 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 2k39 s THR 66 CO 0.46 0.16 0.19 -0.76 -0.69 0.00 0.00 174.62 173.97 2k39 s LEU 67 N 1.85 3.05 0.02 4.42 1.02 -0.83 -4.82 118.68 123.39 2k39 s LEU 67 Ca 0.21 -1.11 0.02 0.00 0.02 0.00 0.00 54.13 53.26 2k39 s LEU 67 Cb -0.15 -1.39 -0.01 0.00 0.02 0.00 0.00 46.19 44.65 2k39 s LEU 67 CO 0.09 -0.60 -0.06 -1.00 0.02 0.00 0.00 176.35 174.80 2k39 s HIS 68 N -2.62 0.53 -0.29 0.29 3.76 -0.24 -0.03 115.29 116.68 2k39 s HIS 68 Ca 0.39 -0.26 0.01 0.00 -0.15 0.00 0.00 55.06 55.04 2k39 s HIS 68 Cb 0.03 -0.33 0.09 0.00 1.11 0.00 0.00 32.58 33.48 2k39 s HIS 68 CO 0.22 -0.04 0.04 -1.17 -0.85 0.00 0.00 174.74 172.93 2k39 s LEU 69 N -0.75 2.98 -0.10 0.89 0.20 -0.76 -0.84 118.68 120.31 2k39 s LEU 69 Ca -0.03 -1.62 -0.22 0.00 0.69 0.00 0.00 54.13 52.94 2k39 s LEU 69 Cb -0.05 -1.15 -0.03 0.00 -0.43 0.00 0.00 46.19 44.52 2k39 s LEU 69 CO 0.00 -0.35 0.67 0.68 -0.29 0.00 0.00 176.35 177.06 2k39 s VAL 70 N 1.37 5.05 -0.37 1.68 -7.23 -0.80 -3.87 120.40 116.23 2k39 s VAL 70 Ca 0.05 1.35 -0.19 0.00 -1.81 0.00 0.00 61.98 61.39 2k39 s VAL 70 Cb -0.18 -4.00 0.00 0.00 0.56 0.00 0.00 36.38 32.76 2k39 s VAL 70 CO -0.14 0.23 0.53 -0.22 -0.31 0.00 0.00 175.10 175.18 2k39 s LEU 71 N 1.03 4.39 0.00 1.32 2.96 -1.26 -2.43 118.68 124.69 2k39 s LEU 71 Ca 0.35 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.16 2k39 s LEU 71 Cb -0.17 -2.60 0.00 0.00 0.50 0.00 0.00 46.19 43.92 2k39 s LEU 71 CO 0.15 -0.53 0.00 -1.14 -1.32 0.00 0.00 176.35 173.51 2k39 n ARG 72 N 5.82 0.00 -2.38 1.98 0.63 0.15 -4.90 116.66 117.96 2k39 n ARG 72 Ca -0.04 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.48 2k39 n ARG 72 Cb 0.49 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.36 2k39 n ARG 72 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2k39 s LEU 73 N 0.00 4.50 -0.11 6.15 2.96 -1.26 -5.00 118.68 125.91 2k39 s LEU 73 Ca 0.00 2.34 -0.01 0.00 -0.22 0.00 0.00 54.13 56.24 2k39 s LEU 73 Cb 0.00 -3.62 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 2k39 s LEU 73 CO 0.00 -0.29 -0.07 -0.60 -1.32 0.00 0.00 176.35 174.08 2k39 s ARG 74 N -1.13 3.22 0.00 1.98 3.52 -1.26 -4.79 118.95 120.48 2k39 s ARG 74 Ca 0.48 -0.56 0.00 0.00 -0.13 0.00 0.00 55.73 55.52 2k39 s ARG 74 Cb -0.34 -2.72 0.00 0.00 -1.56 0.00 0.00 34.95 30.33 2k39 s ARG 74 CO 0.42 0.42 0.00 0.41 -0.81 0.00 0.00 175.30 175.74 2k39 n GLY 75 N 2.96 0.49 0.00 8.12 0.00 -1.26 -5.23 105.19 110.28 2k39 n GLY 75 Ca -0.18 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.57 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93