#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 4.61 0.37 3.17 0.74 -1.26 -0.43 119.66 126.86 2k39 s GLN 2 Ca 0.00 1.82 0.04 0.00 0.05 0.00 0.00 55.36 57.27 2k39 s GLN 2 Cb 0.00 -3.20 -0.04 0.00 1.10 0.00 0.00 33.01 30.87 2k39 s GLN 2 CO 0.00 0.15 0.09 0.96 -0.55 0.00 0.00 175.29 175.94 2k39 s ILE 3 N -0.97 0.91 0.13 -2.34 -4.36 -0.69 -0.17 121.20 113.71 2k39 s ILE 3 Ca 0.46 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.88 2k39 s ILE 3 Cb -0.32 -2.57 -0.04 0.00 1.25 0.00 0.00 42.46 40.78 2k39 s ILE 3 CO 0.41 0.00 -0.08 -0.36 0.24 0.00 0.00 174.94 175.15 2k39 s PHE 4 N -3.26 1.14 -0.11 1.37 0.08 -0.16 -1.76 117.98 115.28 2k39 s PHE 4 Ca 0.30 -0.83 -0.02 0.00 0.12 0.00 0.00 56.93 56.49 2k39 s PHE 4 Cb 0.06 -0.61 0.04 0.00 -0.57 0.00 0.00 43.02 41.94 2k39 s PHE 4 CO 0.14 -0.02 0.03 0.08 -0.10 0.00 0.00 175.22 175.36 2k39 s VAL 5 N -3.45 0.30 0.05 -0.44 1.01 -0.41 -1.56 120.40 115.90 2k39 s VAL 5 Ca 0.16 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.79 2k39 s VAL 5 Cb 0.04 -0.62 -0.05 0.00 0.00 0.00 0.00 36.38 35.75 2k39 s VAL 5 CO -0.01 0.06 1.11 -0.75 0.00 0.00 0.00 175.10 175.52 2k39 s LYS 6 N 1.99 4.49 0.39 2.72 2.20 -0.08 -1.02 119.74 130.43 2k39 s LYS 6 Ca 0.03 1.65 0.07 0.00 -0.36 0.00 0.00 55.97 57.36 2k39 s LYS 6 Cb -0.14 -3.38 -0.00 0.00 -1.51 0.00 0.00 37.83 32.80 2k39 s LYS 6 CO -0.06 -0.15 0.51 0.95 -0.36 0.00 0.00 175.35 176.24 2k39 s THR 7 N 0.89 3.36 0.45 3.43 -4.23 0.78 -1.09 115.64 119.23 2k39 s THR 7 Ca 0.55 -1.04 0.12 0.00 -1.18 0.00 0.00 61.69 60.14 2k39 s THR 7 Cb -0.27 -3.15 0.29 0.00 1.34 0.00 0.00 72.50 70.72 2k39 s THR 7 CO 0.29 -0.06 2.05 -0.07 -0.54 0.00 0.00 174.62 176.29 2k39 h LEU 8 N 0.78 0.32 -1.15 4.79 3.38 -1.86 -2.38 115.31 119.19 2k39 h LEU 8 Ca -0.42 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 2k39 h LEU 8 Cb 1.27 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2k39 h LEU 8 CO 0.49 0.22 -0.15 0.71 0.09 0.00 0.00 178.44 179.80 2k39 h THR 9 N 0.37 0.37 0.00 0.22 1.35 -1.96 -3.47 112.91 109.80 2k39 h THR 9 Ca 0.17 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 2k39 h THR 9 Cb 0.19 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2k39 h THR 9 CO -0.04 0.15 0.00 0.61 -0.25 0.00 0.00 175.52 175.99 2k39 n GLY 10 N 0.17 2.23 3.76 5.82 0.00 -0.90 -5.10 105.19 111.17 2k39 n GLY 10 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.17 3.34 -0.09 1.61 2.20 -1.26 -4.58 119.74 120.79 2k39 s LYS 11 Ca 0.00 1.85 0.04 0.00 -0.36 0.00 0.00 55.97 57.50 2k39 s LYS 11 Cb 0.00 -2.17 -0.00 0.00 -1.51 0.00 0.00 37.83 34.15 2k39 s LYS 11 CO 0.00 -0.92 -0.23 0.99 -0.36 0.00 0.00 175.35 174.83 2k39 s THR 12 N -1.55 2.00 0.03 3.43 2.01 -1.26 -0.16 115.64 120.15 2k39 s THR 12 Ca 0.71 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 61.72 2k39 s THR 12 Cb -0.31 -1.73 -0.04 0.00 0.01 0.00 0.00 72.50 70.44 2k39 s THR 12 CO 0.35 0.55 0.11 -0.63 -0.69 0.00 0.00 174.62 174.31 2k39 s ILE 13 N 0.27 4.83 -0.22 1.82 -1.09 -0.19 -4.97 121.20 121.64 2k39 s ILE 13 Ca -0.16 -0.50 -0.06 0.00 -2.23 0.00 0.00 60.65 57.70 2k39 s ILE 13 Cb -0.17 -3.27 -0.03 0.00 -1.58 0.00 0.00 42.46 37.41 2k39 s ILE 13 CO 0.08 0.24 0.04 -0.89 -1.23 0.00 0.00 174.94 173.18 2k39 s THR 14 N -1.32 4.22 0.25 2.92 2.01 -1.26 -1.29 115.64 121.17 2k39 s THR 14 Ca 0.27 -0.21 0.10 0.00 0.31 0.00 0.00 61.69 62.15 2k39 s THR 14 Cb -0.12 -2.94 -0.05 0.00 0.01 0.00 0.00 72.50 69.40 2k39 s THR 14 CO 0.19 0.39 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.59 2k39 s LEU 15 N 1.24 2.58 -0.16 4.42 1.43 -0.72 -5.02 118.68 122.45 2k39 s LEU 15 Ca 0.04 -1.05 -0.01 0.00 -1.03 0.00 0.00 54.13 52.08 2k39 s LEU 15 Cb -0.15 -0.88 -0.01 0.00 0.03 0.00 0.00 46.19 45.18 2k39 s LEU 15 CO 0.02 -0.09 -0.11 -1.83 0.23 0.00 0.00 176.35 174.57 2k39 s GLU 16 N -3.59 3.34 0.30 1.70 1.03 -1.26 -1.71 118.70 118.52 2k39 s GLU 16 Ca 0.27 -0.68 0.10 0.00 0.03 0.00 0.00 54.97 54.69 2k39 s GLU 16 Cb -0.02 -2.74 -0.05 0.00 -0.80 0.00 0.00 34.13 30.52 2k39 s GLU 16 CO 0.11 0.05 -0.03 0.14 -1.33 0.00 0.00 175.26 174.20 2k39 s VAL 17 N 0.79 2.94 0.26 1.83 -7.23 0.43 -4.93 120.40 114.49 2k39 s VAL 17 Ca -0.04 -2.02 0.08 0.00 -1.81 0.00 0.00 61.98 58.18 2k39 s VAL 17 Cb -0.15 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.03 2k39 s VAL 17 CO 0.01 -0.31 0.16 -1.61 -0.31 0.00 0.00 175.10 173.04 2k39 s GLU 18 N -3.66 2.76 0.35 4.82 0.41 -1.26 -0.14 118.70 121.97 2k39 s GLU 18 Ca 0.33 -1.17 0.14 0.00 -0.41 0.00 0.00 54.97 53.86 2k39 s GLU 18 Cb -0.04 -2.46 1.14 0.00 -1.78 0.00 0.00 34.13 30.99 2k39 s GLU 18 CO 0.19 0.36 1.58 -1.35 -0.49 0.00 0.00 175.26 175.55 2k39 h PRO 19 N 1.56 0.02 0.00 0.39 0.11 -2.00 -2.65 132.00 129.43 2k39 h PRO 19 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2k39 h PRO 19 Cb 1.24 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2k39 h PRO 19 CO 0.61 0.01 0.00 -1.13 -0.21 0.00 0.00 178.00 177.28 2k39 n SER 20 N -5.32 0.00 -4.68 -2.05 3.41 -1.26 -4.46 113.62 99.26 2k39 n SER 20 Ca 0.33 -0.46 -0.42 0.00 -0.26 0.00 0.00 58.87 58.05 2k39 n SER 20 Cb 1.10 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.87 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 -2.30 7.08 0.96 4.04 1.01 -1.00 -4.92 116.67 121.54 2k39 s ASP 21 Ca 0.33 1.33 -0.15 0.00 0.71 0.00 0.00 52.55 54.77 2k39 s ASP 21 Cb 0.19 -2.50 0.22 0.00 1.01 0.00 0.00 42.92 41.83 2k39 s ASP 21 CO 0.37 -0.45 1.31 0.42 0.21 0.00 0.00 175.17 177.03 2k39 s THR 22 N 2.24 2.00 0.29 -1.27 -4.23 -1.26 -3.66 115.64 109.74 2k39 s THR 22 Ca 0.43 -0.09 0.01 0.00 -1.18 0.00 0.00 61.69 60.86 2k39 s THR 22 Cb -0.17 -2.92 0.13 0.00 1.34 0.00 0.00 72.50 70.89 2k39 s THR 22 CO 0.13 0.00 1.80 0.40 -0.54 0.00 0.00 174.62 176.42 2k39 h ILE 23 N -1.62 1.23 -0.46 2.99 1.08 -1.79 -1.80 117.51 117.15 2k39 h ILE 23 Ca -0.43 -0.93 0.06 0.00 -0.39 0.00 0.00 64.86 63.18 2k39 h ILE 23 Cb 1.22 0.92 -0.06 0.00 -3.07 0.00 0.00 36.82 35.83 2k39 h ILE 23 CO 0.32 0.32 0.14 -0.08 -0.69 0.00 0.00 178.15 178.16 2k39 h GLU 24 N 0.64 0.29 -0.35 2.37 4.81 -1.91 -2.05 114.58 118.38 2k39 h GLU 24 Ca 0.13 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 2k39 h GLU 24 Cb 0.41 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 2k39 h GLU 24 CO 0.02 0.19 -0.05 -0.91 -0.73 0.00 0.00 179.01 177.53 2k39 h ASN 25 N 0.30 0.54 -0.23 1.04 4.21 -1.70 -2.13 115.58 117.60 2k39 h ASN 25 Ca 0.22 -0.12 -0.14 0.00 1.21 0.00 0.00 56.30 57.47 2k39 h ASN 25 Cb 0.24 -0.14 -0.00 0.00 -1.12 0.00 0.00 38.32 37.30 2k39 h ASN 25 CO -0.24 0.64 -0.39 0.58 -1.29 0.00 0.00 177.43 176.72 2k39 h VAL 26 N 0.53 1.31 -0.02 2.81 2.07 -1.22 -2.95 116.25 118.79 2k39 h VAL 26 Ca 0.11 -1.60 -0.15 0.00 0.82 0.00 0.00 66.70 65.88 2k39 h VAL 26 Cb 0.41 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 2k39 h VAL 26 CO 0.02 0.50 -0.66 0.11 0.02 0.00 0.00 177.57 177.56 2k39 h LYS 27 N 0.38 0.09 -0.30 1.57 1.57 -1.21 -2.72 116.57 115.96 2k39 h LYS 27 Ca 0.02 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 2k39 h LYS 27 Cb 0.99 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.29 2k39 h LYS 27 CO 0.09 0.71 -0.08 0.00 -0.57 0.00 0.00 179.45 179.61 2k39 h ALA 28 N 1.27 1.31 -0.00 3.86 0.00 -1.45 -2.43 119.26 121.81 2k39 h ALA 28 Ca -0.01 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 2k39 h ALA 28 Cb 1.17 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2k39 h ALA 28 CO 0.09 0.46 -0.72 0.87 0.00 0.00 0.00 179.25 179.95 2k39 h LYS 29 N 0.46 0.01 -0.10 0.00 1.57 -1.30 -3.18 116.57 114.03 2k39 h LYS 29 Ca 0.09 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.68 2k39 h LYS 29 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 2k39 h LYS 29 CO 0.02 0.73 -0.73 0.82 -0.57 0.00 0.00 179.45 179.72 2k39 h ILE 30 N 0.00 1.36 -0.64 1.86 2.04 -1.28 -3.05 117.51 117.79 2k39 h ILE 30 Ca -0.01 -2.10 -0.02 0.00 1.00 0.00 0.00 64.86 63.74 2k39 h ILE 30 Cb 1.28 2.08 -0.03 0.00 -0.74 0.00 0.00 36.82 39.41 2k39 h ILE 30 CO 0.09 0.64 0.33 -0.61 0.00 0.00 0.00 178.15 178.61 2k39 h GLN 31 N 0.33 0.91 0.00 2.37 4.15 -1.48 -1.63 115.11 119.76 2k39 h GLN 31 Ca -0.03 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.27 2k39 h GLN 31 Cb 1.32 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.83 2k39 h GLN 31 CO 0.13 0.71 0.00 0.22 -1.93 0.00 0.00 178.83 177.96 2k39 h ASP 32 N 0.88 0.00 0.00 -0.69 3.58 -1.51 0.20 116.42 118.88 2k39 h ASP 32 Ca 0.22 0.00 -0.37 0.00 0.42 0.00 0.00 57.03 57.30 2k39 h ASP 32 Cb 0.08 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.06 2k39 h ASP 32 CO -0.03 0.00 -2.40 0.29 -2.88 0.00 0.00 179.24 174.22 2k39 n LYS 33 N -2.97 0.61 0.00 0.28 4.76 -1.15 -4.84 118.16 114.86 2k39 n LYS 33 Ca -0.02 0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 2k39 n LYS 33 Cb 0.10 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 2k39 n LYS 33 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2k39 n GLU 34 N -3.25 2.05 -0.97 1.97 4.07 -0.63 -5.03 120.64 118.85 2k39 n GLU 34 Ca -0.44 -0.20 0.00 0.00 -0.06 0.00 0.00 57.16 56.46 2k39 n GLU 34 Cb 0.96 -0.64 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 0.35 0.09 3.73 8.31 0.00 0.70 -4.97 105.19 113.39 2k39 n GLY 35 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.19 4.08 0.44 -0.61 1.01 -1.26 -5.00 121.20 118.68 2k39 s ILE 36 Ca 0.00 1.64 -0.24 0.00 0.00 0.00 0.00 60.65 62.06 2k39 s ILE 36 Cb 0.00 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.34 2k39 s ILE 36 CO 0.00 0.21 1.18 -2.16 0.00 0.00 0.00 174.94 174.17 2k39 s PRO 37 N 0.29 3.82 0.20 2.79 0.04 -1.26 -4.15 135.00 136.73 2k39 s PRO 37 Ca 0.53 1.82 -0.07 0.00 0.04 0.00 0.00 61.00 63.31 2k39 s PRO 37 Cb -0.28 -2.48 0.13 0.00 0.04 0.00 0.00 34.50 31.91 2k39 s PRO 37 CO 0.32 -0.51 1.67 -1.00 0.04 0.00 0.00 177.00 177.52 2k39 h PRO 38 N 2.20 1.00 -0.62 0.56 0.13 -1.96 -3.32 132.00 130.00 2k39 h PRO 38 Ca -0.49 -0.31 0.13 0.00 -0.87 0.00 0.00 66.00 64.45 2k39 h PRO 38 Cb 1.25 -0.09 -0.11 0.00 0.13 0.00 0.00 31.00 32.17 2k39 h PRO 38 CO 0.61 0.99 -0.05 0.22 -0.23 0.00 0.00 178.00 179.54 2k39 h ASP 39 N 0.92 -0.38 0.88 1.44 3.58 -1.95 -2.17 116.42 118.74 2k39 h ASP 39 Ca 0.16 0.17 -0.07 0.00 0.42 0.00 0.00 57.03 57.71 2k39 h ASP 39 Cb 0.55 0.31 -0.01 0.00 1.72 0.00 0.00 39.33 41.90 2k39 h ASP 39 CO 0.03 -0.15 -0.34 1.56 -2.88 0.00 0.00 179.24 177.46 2k39 h GLN 40 N 0.07 0.00 -6.41 0.28 1.08 -1.98 -3.46 115.11 104.70 2k39 h GLN 40 Ca 0.32 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.98 2k39 h GLN 40 Cb 0.51 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 2k39 h GLN 40 CO -0.57 0.34 0.52 -0.65 -0.95 0.00 0.00 178.83 177.52 2k39 s GLN 41 N -3.60 4.46 0.29 1.46 -0.21 -0.82 -1.72 119.66 119.51 2k39 s GLN 41 Ca 0.00 1.60 0.08 0.00 0.02 0.00 0.00 55.36 57.07 2k39 s GLN 41 Cb 0.11 -3.44 -0.04 0.00 1.00 0.00 0.00 33.01 30.64 2k39 s GLN 41 CO 0.68 -0.23 0.12 1.03 -2.12 0.00 0.00 175.29 174.77 2k39 s ARG 42 N 1.33 2.53 -0.27 2.91 0.52 0.19 -4.88 118.95 121.28 2k39 s ARG 42 Ca 0.55 -1.34 0.01 0.00 -0.52 0.00 0.00 55.73 54.44 2k39 s ARG 42 Cb -0.25 -2.31 0.07 0.00 0.52 0.00 0.00 34.95 32.99 2k39 s ARG 42 CO 0.27 0.28 -0.02 -0.51 0.02 0.00 0.00 175.30 175.34 2k39 s LEU 43 N -3.80 3.05 -0.15 2.53 1.43 -1.26 -1.92 118.68 118.57 2k39 s LEU 43 Ca 0.34 -1.46 -0.17 0.00 -1.03 0.00 0.00 54.13 51.81 2k39 s LEU 43 Cb -0.06 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.86 2k39 s LEU 43 CO 0.23 -0.28 0.45 -0.63 0.23 0.00 0.00 176.35 176.34 2k39 s ILE 44 N 1.30 5.20 -0.27 -0.59 -1.09 -1.26 -0.33 121.20 124.16 2k39 s ILE 44 Ca -0.01 0.86 -0.07 0.00 -2.23 0.00 0.00 60.65 59.20 2k39 s ILE 44 Cb -0.19 -3.78 0.13 0.00 -1.58 0.00 0.00 42.46 37.04 2k39 s ILE 44 CO -0.09 0.31 0.56 0.12 -1.23 0.00 0.00 174.94 174.60 2k39 s PHE 45 N 0.82 -1.20 -1.76 3.97 5.36 -0.36 -4.50 117.98 120.32 2k39 s PHE 45 Ca 0.23 1.90 0.00 0.00 -0.96 0.00 0.00 56.93 58.10 2k39 s PHE 45 Cb -0.15 0.57 0.00 0.00 -0.34 0.00 0.00 43.02 43.10 2k39 s PHE 45 CO 0.09 -0.65 0.00 0.00 -1.46 0.00 0.00 175.22 173.20 2k39 n ALA 46 N 5.42 -0.60 0.00 11.12 0.00 -1.26 -1.57 120.51 133.62 2k39 n ALA 46 Ca -0.09 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2k39 n ALA 46 Cb 0.50 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 -0.91 3.21 3.78 0.00 0.00 -1.26 -5.04 105.19 104.96 2k39 n GLY 47 Ca -0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 2k39 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k39 s LYS 48 N -0.43 4.14 -0.12 1.61 2.20 -0.61 -4.98 119.74 121.55 2k39 s LYS 48 Ca 0.00 0.43 -0.29 0.00 -0.36 0.00 0.00 55.97 55.74 2k39 s LYS 48 Cb 0.00 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 2k39 s LYS 48 CO 0.00 0.43 1.49 -1.14 -0.36 0.00 0.00 175.35 175.76 2k39 s GLN 49 N -0.24 4.17 -0.15 4.03 -0.44 -1.26 -1.23 119.66 124.53 2k39 s GLN 49 Ca 0.24 1.92 -0.28 0.00 -2.50 0.00 0.00 55.36 54.74 2k39 s GLN 49 Cb -0.16 -3.90 -0.01 0.00 -1.64 0.00 0.00 33.01 27.30 2k39 s GLN 49 CO 0.12 -0.83 0.96 -0.51 0.50 0.00 0.00 175.29 175.53 2k39 s LEU 50 N 3.92 4.20 0.16 3.68 1.43 0.56 -4.99 118.68 127.63 2k39 s LEU 50 Ca 0.65 1.39 -0.29 0.00 -1.03 0.00 0.00 54.13 54.86 2k39 s LEU 50 Cb -0.28 -3.45 -0.07 0.00 0.03 0.00 0.00 46.19 42.42 2k39 s LEU 50 CO 0.23 -0.48 0.90 -1.61 0.23 0.00 0.00 176.35 175.62 2k39 s GLU 51 N 2.29 4.71 -0.17 1.70 0.41 -1.26 -4.73 118.70 121.65 2k39 s GLU 51 Ca 0.44 1.37 -0.29 0.00 -0.41 0.00 0.00 54.97 56.08 2k39 s GLU 51 Cb -0.17 -3.32 -0.04 0.00 -1.78 0.00 0.00 34.13 28.82 2k39 s GLU 51 CO 0.14 0.40 1.82 -0.51 -0.49 0.00 0.00 175.26 176.62 2k39 s ASP 52 N -0.66 6.18 0.00 -0.19 1.11 -1.26 -3.11 116.67 118.74 2k39 s ASP 52 Ca 0.42 1.87 0.00 0.00 0.18 0.00 0.00 52.55 55.02 2k39 s ASP 52 Cb -0.24 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.22 2k39 s ASP 52 CO 0.29 -1.38 0.00 0.61 1.18 0.00 0.00 175.17 175.87 2k39 n GLY 53 N 4.90 1.10 3.93 0.21 0.00 -1.26 -5.03 105.19 109.04 2k39 n GLY 53 Ca 0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 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 3.50 0.54 1.61 0.52 -1.18 -4.98 118.95 118.96 2k39 s ARG 54 Ca 0.00 -0.42 0.03 0.00 -0.52 0.00 0.00 55.73 54.82 2k39 s ARG 54 Cb 0.00 -2.84 0.04 0.00 0.52 0.00 0.00 34.95 32.67 2k39 s ARG 54 CO 0.00 0.39 0.76 0.95 0.02 0.00 0.00 175.30 177.42 2k39 s THR 55 N -1.91 2.66 0.08 0.02 -4.23 -1.26 -3.16 115.64 107.84 2k39 s THR 55 Ca 0.38 -0.74 -0.20 0.00 -1.18 0.00 0.00 61.69 59.95 2k39 s THR 55 Cb -0.11 -2.92 -0.10 0.00 1.34 0.00 0.00 72.50 70.71 2k39 s THR 55 CO 0.30 0.00 1.55 -0.07 -0.54 0.00 0.00 174.62 175.85 2k39 h LEU 56 N 0.13 0.30 -1.00 4.79 3.38 -1.78 -2.27 115.31 118.86 2k39 h LEU 56 Ca -0.41 -0.26 0.32 0.00 0.09 0.00 0.00 57.88 57.62 2k39 h LEU 56 Cb 1.29 -0.08 -0.15 0.00 0.09 0.00 0.00 40.66 41.81 2k39 h LEU 56 CO 0.49 0.48 0.55 0.77 0.09 0.00 0.00 178.44 180.82 2k39 h SER 57 N 0.11 0.49 -0.33 -0.43 4.64 -1.80 -0.32 113.55 115.90 2k39 h SER 57 Ca 0.06 0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.55 2k39 h SER 57 Cb 0.31 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 2k39 h SER 57 CO 0.00 -0.13 0.16 0.44 -0.87 0.00 0.00 176.83 176.44 2k39 h ASP 58 N 0.33 0.47 -0.36 4.97 3.32 -1.77 -2.20 116.42 121.17 2k39 h ASP 58 Ca 0.72 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.73 2k39 h ASP 58 Cb 1.63 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 41.06 2k39 h ASP 58 CO -0.61 0.42 0.00 -1.22 -1.72 0.00 0.00 179.24 176.12 2k39 n TYR 59 N -4.40 0.56 -3.74 4.55 4.01 -0.71 -4.93 117.16 112.51 2k39 n TYR 59 Ca 0.02 -0.26 -0.24 0.00 -0.16 0.00 0.00 57.90 57.26 2k39 n TYR 59 Cb 0.13 -0.04 0.04 0.00 -0.31 0.00 0.00 39.34 39.16 2k39 n TYR 59 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2k39 n ASN 60 N 0.56 -2.53 -4.36 7.72 0.23 -0.68 -4.96 115.26 111.23 2k39 n ASN 60 Ca 0.13 -0.78 -0.41 0.00 -0.53 0.00 0.00 54.58 52.98 2k39 n ASN 60 Cb 0.36 -4.11 -0.10 0.00 -2.08 0.00 0.00 39.78 33.85 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2k39 s ILE 61 N -3.53 4.66 0.41 1.53 1.01 -0.22 -4.96 121.20 120.10 2k39 s ILE 61 Ca 0.22 -0.99 0.08 0.00 0.00 0.00 0.00 60.65 59.96 2k39 s ILE 61 Cb -0.11 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 2k39 s ILE 61 CO 0.81 -0.35 0.41 -1.10 0.00 0.00 0.00 174.94 174.70 2k39 s GLN 62 N 1.55 2.63 0.00 2.79 -1.52 -1.26 -3.30 119.66 120.55 2k39 s GLN 62 Ca 0.03 -1.44 0.00 0.00 -1.95 0.00 0.00 55.36 52.00 2k39 s GLN 62 Cb -0.21 -2.47 0.00 0.00 -0.22 0.00 0.00 33.01 30.11 2k39 s GLN 62 CO 0.06 -0.17 0.00 1.17 -0.25 0.00 0.00 175.29 176.10 2k39 n LYS 63 N -1.59 0.00 -1.08 2.91 4.81 -1.26 -2.46 118.16 119.48 2k39 n LYS 63 Ca 0.04 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.45 2k39 n LYS 63 Cb 0.61 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.65 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 0.00 -0.28 -2.16 1.64 4.71 0.76 -5.01 120.64 120.30 2k39 n GLU 64 Ca 0.00 0.51 -0.41 0.00 -0.01 0.00 0.00 57.16 57.26 2k39 n GLU 64 Cb 0.00 -4.09 -0.02 0.00 -1.01 0.00 0.00 31.44 26.32 2k39 n GLU 64 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2k39 s SER 65 N -2.76 6.83 -0.39 1.62 0.01 -1.03 -4.62 113.70 113.37 2k39 s SER 65 Ca 0.00 2.61 -0.16 0.00 1.31 0.00 0.00 55.95 59.72 2k39 s SER 65 Cb 0.00 -2.64 0.01 0.00 0.21 0.00 0.00 66.02 63.60 2k39 s SER 65 CO 0.00 -0.50 0.36 -0.89 0.41 0.00 0.00 173.24 172.62 2k39 s THR 66 N -0.95 5.18 0.51 1.44 2.01 -1.26 -0.99 115.64 121.59 2k39 s THR 66 Ca 0.50 -0.31 -0.05 0.00 0.31 0.00 0.00 61.69 62.14 2k39 s THR 66 Cb -0.39 -3.91 -0.02 0.00 0.01 0.00 0.00 72.50 68.19 2k39 s THR 66 CO 0.49 -0.26 0.82 -0.76 -0.69 0.00 0.00 174.62 174.23 2k39 s LEU 67 N 1.94 3.51 -0.17 4.42 1.43 -0.60 -4.93 118.68 124.28 2k39 s LEU 67 Ca 0.09 0.85 0.01 0.00 -1.03 0.00 0.00 54.13 54.05 2k39 s LEU 67 Cb -0.17 -3.77 0.03 0.00 0.03 0.00 0.00 46.19 42.30 2k39 s LEU 67 CO 0.12 -0.72 -0.15 -1.00 0.23 0.00 0.00 176.35 174.82 2k39 s HIS 68 N -2.81 2.41 -0.42 0.29 3.76 -1.26 -0.90 115.29 116.35 2k39 s HIS 68 Ca 0.49 -1.44 -0.22 0.00 -0.15 0.00 0.00 55.06 53.75 2k39 s HIS 68 Cb -0.10 -1.70 0.02 0.00 1.11 0.00 0.00 32.58 31.91 2k39 s HIS 68 CO 0.45 -0.73 0.72 -1.17 -0.85 0.00 0.00 174.74 173.16 2k39 s LEU 69 N 1.41 4.32 0.34 0.89 2.96 -0.25 -4.19 118.68 124.17 2k39 s LEU 69 Ca 0.03 -0.11 0.08 0.00 -0.22 0.00 0.00 54.13 53.92 2k39 s LEU 69 Cb -0.14 -2.87 -0.03 0.00 0.50 0.00 0.00 46.19 43.65 2k39 s LEU 69 CO -0.11 -0.81 0.25 -0.69 -1.32 0.00 0.00 176.35 173.68 2k39 s VAL 70 N 3.04 3.30 0.30 1.68 1.01 -0.81 -4.17 120.40 124.76 2k39 s VAL 70 Ca 0.27 -1.47 0.09 0.00 0.00 0.00 0.00 61.98 60.87 2k39 s VAL 70 Cb -0.13 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 2k39 s VAL 70 CO 0.20 -0.16 0.07 -0.22 0.00 0.00 0.00 175.10 174.98 2k39 s LEU 71 N -3.96 3.23 -0.17 3.92 2.96 -1.26 0.53 118.68 123.94 2k39 s LEU 71 Ca 0.40 -0.71 -0.24 0.00 -0.22 0.00 0.00 54.13 53.36 2k39 s LEU 71 Cb -0.04 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 2k39 s LEU 71 CO 0.25 -0.15 0.78 -0.60 -1.32 0.00 0.00 176.35 175.32 2k39 s ARG 72 N -3.76 4.29 0.39 1.98 3.52 -0.70 -4.70 118.95 119.98 2k39 s ARG 72 Ca 0.34 0.93 0.02 0.00 -0.13 0.00 0.00 55.73 56.89 2k39 s ARG 72 Cb -0.04 -3.56 -0.01 0.00 -1.56 0.00 0.00 34.95 29.77 2k39 s ARG 72 CO 0.21 -0.28 0.59 -0.51 -0.81 0.00 0.00 175.30 174.51 2k39 s LEU 73 N 1.98 3.83 0.02 -0.88 2.01 -1.26 -5.05 118.68 119.33 2k39 s LEU 73 Ca 0.36 0.24 -0.11 0.00 0.01 0.00 0.00 54.13 54.64 2k39 s LEU 73 Cb -0.17 -3.12 0.01 0.00 0.01 0.00 0.00 46.19 42.92 2k39 s LEU 73 CO 0.13 -0.52 0.22 0.00 1.01 0.00 0.00 176.35 177.19 2k39 s ARG 74 N -4.40 0.65 0.00 1.70 1.70 -1.26 -5.15 118.95 112.19 2k39 s ARG 74 Ca 0.45 -0.46 0.00 0.00 -0.47 0.00 0.00 55.73 55.25 2k39 s ARG 74 Cb -0.10 0.28 0.00 0.00 -0.57 0.00 0.00 34.95 34.56 2k39 s ARG 74 CO 0.36 -0.18 0.00 0.41 -1.08 0.00 0.00 175.30 174.80 2k39 n GLY 75 N 0.98 1.83 0.00 3.88 0.00 -1.26 -5.35 105.19 105.27 2k39 n GLY 75 Ca -0.20 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93