#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 4.33 0.09 3.17 0.74 -1.26 -0.38 119.66 126.34 2k39 s GLN 2 Ca 0.00 1.05 -0.03 0.00 0.05 0.00 0.00 55.36 56.43 2k39 s GLN 2 Cb 0.00 -2.64 -0.03 0.00 1.10 0.00 0.00 33.01 31.45 2k39 s GLN 2 CO 0.00 0.23 0.07 0.96 -0.55 0.00 0.00 175.29 176.00 2k39 s ILE 3 N -1.76 0.16 -0.04 -2.34 -4.36 -0.06 -2.40 121.20 110.40 2k39 s ILE 3 Ca 0.51 -1.66 -0.04 0.00 -0.26 0.00 0.00 60.65 59.21 2k39 s ILE 3 Cb -0.15 -1.63 -0.04 0.00 1.25 0.00 0.00 42.46 41.89 2k39 s ILE 3 CO 0.20 -0.74 0.15 -0.36 0.24 0.00 0.00 174.94 174.43 2k39 s PHE 4 N -3.94 3.51 -0.28 1.37 0.08 -0.15 -0.97 117.98 117.60 2k39 s PHE 4 Ca 0.11 0.38 -0.05 0.00 0.12 0.00 0.00 56.93 57.49 2k39 s PHE 4 Cb 0.07 -1.85 0.01 0.00 -0.57 0.00 0.00 43.02 40.68 2k39 s PHE 4 CO -0.07 0.65 0.04 0.08 -0.10 0.00 0.00 175.22 175.83 2k39 s VAL 5 N -1.21 3.67 0.02 -0.44 1.01 0.41 -2.00 120.40 121.86 2k39 s VAL 5 Ca 0.23 -0.75 -0.20 0.00 0.00 0.00 0.00 61.98 61.26 2k39 s VAL 5 Cb -0.12 -2.87 -0.06 0.00 0.00 0.00 0.00 36.38 33.33 2k39 s VAL 5 CO 0.13 0.13 0.57 -0.75 0.00 0.00 0.00 175.10 175.19 2k39 s LYS 6 N 1.46 4.25 0.24 2.72 2.20 -0.87 0.27 119.74 130.01 2k39 s LYS 6 Ca 0.02 0.71 -0.17 0.00 -0.36 0.00 0.00 55.97 56.18 2k39 s LYS 6 Cb -0.17 -3.30 -0.08 0.00 -1.51 0.00 0.00 37.83 32.77 2k39 s LYS 6 CO 0.00 0.48 0.68 0.95 -0.36 0.00 0.00 175.35 177.11 2k39 s THR 7 N -0.57 4.68 -2.00 3.43 -4.23 -0.18 -0.21 115.64 116.56 2k39 s THR 7 Ca 0.30 1.04 0.02 0.00 -1.18 0.00 0.00 61.69 61.87 2k39 s THR 7 Cb -0.19 -3.74 0.05 0.00 1.34 0.00 0.00 72.50 69.96 2k39 s THR 7 CO 0.17 0.07 0.42 0.18 -0.54 0.00 0.00 174.62 174.93 2k39 n LEU 8 N 0.34 0.00 -1.01 4.79 7.99 -1.26 -2.23 117.00 125.62 2k39 n LEU 8 Ca -0.01 0.00 0.08 0.00 -0.01 0.00 0.00 56.01 56.07 2k39 n LEU 8 Cb 0.52 0.00 0.24 0.00 -0.11 0.00 0.00 43.42 44.07 2k39 n LEU 8 CO 0.43 0.00 0.71 0.35 -1.51 0.00 0.00 177.39 177.36 2k39 n THR 9 N -0.77 1.31 0.00 -5.08 -2.24 -1.26 -5.00 114.28 101.25 2k39 n THR 9 Ca 0.01 -1.14 0.00 0.00 -2.27 0.00 0.00 64.05 60.65 2k39 n THR 9 Cb 0.01 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 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 0.77 3.07 3.71 3.38 0.00 -0.95 -5.04 105.19 110.13 2k39 n GLY 10 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.67 4.09 -0.20 1.61 2.20 -1.25 -4.91 119.74 120.61 2k39 s LYS 11 Ca 0.00 -0.25 -0.05 0.00 -0.36 0.00 0.00 55.97 55.31 2k39 s LYS 11 Cb 0.00 -3.35 -0.03 0.00 -1.51 0.00 0.00 37.83 32.94 2k39 s LYS 11 CO 0.00 0.32 0.01 0.99 -0.36 0.00 0.00 175.35 176.31 2k39 s THR 12 N 0.28 4.06 -0.22 3.43 2.01 -1.26 -1.01 115.64 122.92 2k39 s THR 12 Ca 0.07 -0.28 -0.05 0.00 0.31 0.00 0.00 61.69 61.75 2k39 s THR 12 Cb -0.11 -2.83 -0.01 0.00 0.01 0.00 0.00 72.50 69.55 2k39 s THR 12 CO -0.01 0.43 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.70 2k39 s ILE 13 N 0.93 3.64 -0.16 1.82 1.01 0.14 -4.98 121.20 123.60 2k39 s ILE 13 Ca 0.02 -0.40 -0.12 0.00 0.00 0.00 0.00 60.65 60.14 2k39 s ILE 13 Cb -0.14 -2.66 -0.05 0.00 0.01 0.00 0.00 42.46 39.62 2k39 s ILE 13 CO 0.02 0.41 0.25 -0.89 0.00 0.00 0.00 174.94 174.73 2k39 s THR 14 N 1.43 5.33 0.19 2.92 2.01 -1.26 -0.44 115.64 125.82 2k39 s THR 14 Ca 0.05 0.46 0.11 0.00 0.31 0.00 0.00 61.69 62.62 2k39 s THR 14 Cb -0.14 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.74 2k39 s THR 14 CO -0.01 0.43 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.89 2k39 s LEU 15 N 0.26 2.43 -0.09 4.42 2.96 -0.14 -4.99 118.68 123.52 2k39 s LEU 15 Ca 0.15 -0.86 -0.01 0.00 -0.22 0.00 0.00 54.13 53.19 2k39 s LEU 15 Cb -0.13 -1.15 -0.03 0.00 0.50 0.00 0.00 46.19 45.38 2k39 s LEU 15 CO 0.03 0.12 -0.05 -0.70 -1.32 0.00 0.00 176.35 174.43 2k39 s GLU 16 N -2.65 3.00 0.08 1.98 2.56 -1.26 -0.88 118.70 121.53 2k39 s GLU 16 Ca 0.20 -0.51 0.07 0.00 0.00 0.00 0.00 54.97 54.73 2k39 s GLU 16 Cb -0.08 -2.70 -0.03 0.00 2.00 0.00 0.00 34.13 33.32 2k39 s GLU 16 CO 0.09 0.58 -0.17 0.14 -0.56 0.00 0.00 175.26 175.34 2k39 s VAL 17 N -0.58 1.39 0.46 3.70 -7.23 0.49 -4.95 120.40 113.68 2k39 s VAL 17 Ca 0.09 -1.40 -0.10 0.00 -1.81 0.00 0.00 61.98 58.76 2k39 s VAL 17 Cb -0.12 -1.30 -0.06 0.00 0.56 0.00 0.00 36.38 35.47 2k39 s VAL 17 CO 0.02 -0.14 0.82 -1.61 -0.31 0.00 0.00 175.10 173.88 2k39 s GLU 18 N -1.79 3.72 0.25 4.82 8.01 -1.26 0.12 118.70 132.56 2k39 s GLU 18 Ca 0.02 0.48 0.03 0.00 0.01 0.00 0.00 54.97 55.50 2k39 s GLU 18 Cb -0.10 -2.33 0.29 0.00 -4.31 0.00 0.00 34.13 27.68 2k39 s GLU 18 CO 0.03 -0.15 1.61 -1.00 0.01 0.00 0.00 175.26 175.76 2k39 h PRO 19 N 0.81 0.37 -0.13 0.39 0.13 -2.00 -3.29 132.00 128.27 2k39 h PRO 19 Ca -0.47 -0.20 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 2k39 h PRO 19 Cb 1.19 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k39 h PRO 19 CO 0.63 0.77 0.00 0.43 -0.23 0.00 0.00 178.00 179.60 2k39 n SER 20 N -3.98 2.92 -4.89 1.44 7.64 -1.26 -2.53 113.62 112.95 2k39 n SER 20 Ca -0.02 -2.79 -0.29 0.00 1.01 0.00 0.00 58.87 56.79 2k39 n SER 20 Cb 0.54 -0.39 0.01 0.00 -1.01 0.00 0.00 64.21 63.37 2k39 n SER 20 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k39 s ASP 21 N -2.06 6.05 0.14 6.43 2.15 -1.24 -4.70 116.67 123.44 2k39 s ASP 21 Ca 0.30 1.07 -0.08 0.00 0.43 0.00 0.00 52.55 54.27 2k39 s ASP 21 Cb 0.24 -2.19 -0.06 0.00 -0.30 0.00 0.00 42.92 40.61 2k39 s ASP 21 CO 0.06 -0.83 0.44 0.42 -0.17 0.00 0.00 175.17 175.08 2k39 s THR 22 N -2.99 5.07 0.30 1.71 -4.23 -1.26 -1.68 115.64 112.56 2k39 s THR 22 Ca 0.52 0.34 0.05 0.00 -1.18 0.00 0.00 61.69 61.42 2k39 s THR 22 Cb -0.11 -3.64 0.33 0.00 1.34 0.00 0.00 72.50 70.42 2k39 s THR 22 CO 0.49 0.12 1.64 0.40 -0.54 0.00 0.00 174.62 176.72 2k39 h ILE 23 N 2.39 0.26 0.00 2.99 1.08 -1.68 -2.24 117.51 120.30 2k39 h ILE 23 Ca -0.47 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 63.93 2k39 h ILE 23 Cb 1.18 0.06 0.00 0.00 -3.07 0.00 0.00 36.82 34.98 2k39 h ILE 23 CO 0.69 0.03 0.00 1.05 -0.69 0.00 0.00 178.15 179.23 2k39 h GLU 24 N 0.19 0.00 -0.03 2.37 9.09 -1.88 -2.76 114.58 121.55 2k39 h GLU 24 Ca 0.60 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.83 2k39 h GLU 24 Cb 1.27 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.36 2k39 h GLU 24 CO -0.69 0.00 -0.78 -0.97 0.05 0.00 0.00 179.01 176.63 2k39 h ASN 25 N 0.00 0.30 -0.58 3.06 -1.24 -1.81 -2.78 115.58 112.52 2k39 h ASN 25 Ca 0.00 -0.21 0.12 0.00 0.71 0.00 0.00 56.30 56.92 2k39 h ASN 25 Cb 0.79 -0.09 -0.10 0.00 0.73 0.00 0.00 38.32 39.65 2k39 h ASN 25 CO 0.00 0.96 -0.01 0.58 -1.29 0.00 0.00 177.43 177.67 2k39 h VAL 26 N 0.15 0.52 -0.53 2.57 2.07 -1.48 -2.98 116.25 116.58 2k39 h VAL 26 Ca -0.03 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 2k39 h VAL 26 Cb 1.36 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 2k39 h VAL 26 CO 0.12 0.02 0.08 0.11 0.02 0.00 0.00 177.57 177.92 2k39 h LYS 27 N 0.11 0.85 -0.95 1.57 1.57 -1.55 -1.44 116.57 116.72 2k39 h LYS 27 Ca 0.30 -0.20 0.10 0.00 -1.87 0.00 0.00 60.65 58.98 2k39 h LYS 27 Cb 0.48 -0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.60 2k39 h LYS 27 CO -0.50 0.80 0.61 0.00 -0.57 0.00 0.00 179.45 179.79 2k39 h ALA 28 N 1.28 1.55 0.00 3.86 0.00 -1.50 -1.28 119.26 123.17 2k39 h ALA 28 Ca 0.17 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 2k39 h ALA 28 Cb 0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2k39 h ALA 28 CO 0.01 0.25 -0.63 0.87 0.00 0.00 0.00 179.25 179.75 2k39 h LYS 29 N 0.98 0.00 -0.29 0.00 1.79 -1.22 -2.06 116.57 115.78 2k39 h LYS 29 Ca 0.44 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.87 2k39 h LYS 29 Cb 0.38 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.02 2k39 h LYS 29 CO -0.20 0.55 0.01 0.82 -1.08 0.00 0.00 179.45 179.55 2k39 h ILE 30 N 0.00 1.25 0.05 1.86 1.08 -1.16 -3.25 117.51 117.33 2k39 h ILE 30 Ca -0.02 -0.89 -0.00 0.00 -0.39 0.00 0.00 64.86 63.56 2k39 h ILE 30 Cb 1.45 1.28 0.00 0.00 -3.07 0.00 0.00 36.82 36.47 2k39 h ILE 30 CO 0.07 0.29 -0.02 -0.61 -0.69 0.00 0.00 178.15 177.19 2k39 h GLN 31 N 0.29 -0.06 -1.02 2.37 4.15 -0.62 -0.39 115.11 119.83 2k39 h GLN 31 Ca 0.08 0.00 0.42 0.00 0.77 0.00 0.00 58.65 59.93 2k39 h GLN 31 Cb 0.40 0.01 -0.17 0.00 0.21 0.00 0.00 27.48 27.93 2k39 h GLN 31 CO 0.01 0.07 0.56 -3.47 -1.93 0.00 0.00 178.83 174.07 2k39 n ASP 32 N -5.06 0.33 -0.11 -0.69 2.03 -0.83 -1.61 116.55 110.61 2k39 n ASP 32 Ca -0.08 1.62 -0.20 0.00 0.52 0.00 0.00 54.79 56.65 2k39 n ASP 32 Cb 0.10 -0.79 -0.12 0.00 -0.72 0.00 0.00 41.12 39.59 2k39 n ASP 32 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2k39 n LYS 33 N -5.19 0.66 -0.01 -0.67 4.81 -1.11 -4.82 118.16 111.83 2k39 n LYS 33 Ca 0.38 0.19 0.02 0.00 -0.87 0.00 0.00 58.31 58.03 2k39 n LYS 33 Cb 1.30 -1.56 -0.06 0.00 0.02 0.00 0.00 35.03 34.74 2k39 n LYS 33 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k39 n GLU 34 N -3.45 1.02 -0.50 1.64 -0.58 -0.17 -5.02 120.64 113.58 2k39 n GLU 34 Ca -0.44 -0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.25 2k39 n GLU 34 Cb 0.98 -1.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.67 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 2.22 0.96 3.65 0.62 0.00 -0.63 -5.02 105.19 107.00 2k39 n GLY 35 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 -3.11 4.55 1.03 -0.61 -1.09 -1.26 -5.00 121.20 115.71 2k39 s ILE 36 Ca 0.00 1.84 -0.12 0.00 -2.23 0.00 0.00 60.65 60.15 2k39 s ILE 36 Cb 0.00 -4.27 0.21 0.00 -1.58 0.00 0.00 42.46 36.81 2k39 s ILE 36 CO 0.00 -0.26 1.08 -2.16 -1.23 0.00 0.00 174.94 172.37 2k39 s PRO 37 N 3.41 0.16 0.43 2.79 0.04 -1.26 -4.01 135.00 136.55 2k39 s PRO 37 Ca 0.47 1.07 0.19 0.00 0.04 0.00 0.00 61.00 62.77 2k39 s PRO 37 Cb -0.16 -1.66 0.97 0.00 0.04 0.00 0.00 34.50 33.69 2k39 s PRO 37 CO 0.10 -3.07 1.90 -1.00 0.04 0.00 0.00 177.00 174.97 2k39 h PRO 38 N -2.16 0.00 0.00 0.56 0.13 -1.95 -2.81 132.00 125.77 2k39 h PRO 38 Ca -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2k39 h PRO 38 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2k39 h PRO 38 CO 0.48 0.27 0.00 -3.47 -0.23 0.00 0.00 178.00 175.06 2k39 n ASP 39 N -3.82 0.00 0.00 1.44 2.03 -1.26 -2.27 116.55 112.67 2k39 n ASP 39 Ca -0.01 -0.56 0.00 0.00 0.52 0.00 0.00 54.79 54.74 2k39 n ASP 39 Cb 0.36 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.76 2k39 n ASP 39 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2k39 n GLN 40 N -0.93 3.53 -3.70 -0.67 -0.06 -1.06 -4.95 117.38 109.54 2k39 n GLN 40 Ca 0.10 0.00 -0.38 0.00 -2.00 0.00 0.00 57.00 54.72 2k39 n GLN 40 Cb 0.05 -0.72 -0.12 0.00 -4.06 0.00 0.00 30.24 25.39 2k39 n GLN 40 CO 0.00 0.00 0.00 -0.65 -0.20 0.00 0.00 177.06 176.21 2k39 s GLN 41 N -1.41 3.10 -0.06 3.69 -0.21 -0.96 -4.08 119.66 119.73 2k39 s GLN 41 Ca 0.00 -0.87 0.00 0.00 0.02 0.00 0.00 55.36 54.52 2k39 s GLN 41 Cb 0.00 -3.50 -0.03 0.00 1.00 0.00 0.00 33.01 30.48 2k39 s GLN 41 CO 0.00 -0.49 -0.03 0.50 -2.12 0.00 0.00 175.29 173.15 2k39 s ARG 42 N 1.54 2.81 -0.04 2.91 3.52 -0.57 -5.00 118.95 124.12 2k39 s ARG 42 Ca 0.03 -0.53 0.05 0.00 -0.13 0.00 0.00 55.73 55.15 2k39 s ARG 42 Cb -0.18 -2.66 -0.02 0.00 -1.56 0.00 0.00 34.95 30.53 2k39 s ARG 42 CO 0.04 0.66 -0.18 -0.51 -0.81 0.00 0.00 175.30 174.51 2k39 s LEU 43 N -1.02 2.51 0.13 -0.88 1.02 -1.26 0.10 118.68 119.27 2k39 s LEU 43 Ca 0.14 -0.29 0.07 0.00 0.02 0.00 0.00 54.13 54.08 2k39 s LEU 43 Cb -0.11 -1.48 -0.04 0.00 0.02 0.00 0.00 46.19 44.57 2k39 s LEU 43 CO 0.04 0.34 -0.07 -0.63 0.02 0.00 0.00 176.35 176.05 2k39 s ILE 44 N -0.69 3.49 -0.10 -0.59 1.01 -0.54 -0.04 121.20 123.73 2k39 s ILE 44 Ca 0.11 -1.33 0.01 0.00 0.00 0.00 0.00 60.65 59.44 2k39 s ILE 44 Cb -0.10 -2.68 0.02 0.00 0.01 0.00 0.00 42.46 39.71 2k39 s ILE 44 CO -0.00 0.03 -0.11 0.12 0.00 0.00 0.00 174.94 174.98 2k39 s PHE 45 N -1.40 1.61 0.00 3.97 5.36 0.80 -1.56 117.98 126.75 2k39 s PHE 45 Ca 0.24 -0.74 0.00 0.00 -0.96 0.00 0.00 56.93 55.47 2k39 s PHE 45 Cb -0.10 -1.23 0.00 0.00 -0.34 0.00 0.00 43.02 41.34 2k39 s PHE 45 CO 0.15 -0.44 0.00 0.00 -1.46 0.00 0.00 175.22 173.48 2k39 n ALA 46 N 4.41 0.00 -0.68 11.12 0.00 -1.26 -1.01 120.51 133.08 2k39 n ALA 46 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2k39 n ALA 46 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 0.00 0.03 3.35 0.00 0.00 -1.26 -5.06 105.19 102.26 2k39 n GLY 47 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2k39 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k39 s LYS 48 N -0.04 1.31 0.26 1.61 -2.85 -0.18 -5.10 119.74 114.74 2k39 s LYS 48 Ca 0.00 -1.32 -0.30 0.00 -1.00 0.00 0.00 55.97 53.35 2k39 s LYS 48 Cb 0.00 -1.65 -0.09 0.00 -2.06 0.00 0.00 37.83 34.03 2k39 s LYS 48 CO 0.00 0.38 1.17 -0.65 0.10 0.00 0.00 175.35 176.34 2k39 s GLN 49 N -2.20 4.54 -0.26 1.78 -0.21 -1.26 -0.14 119.66 121.91 2k39 s GLN 49 Ca 0.13 1.90 -0.15 0.00 0.02 0.00 0.00 55.36 57.26 2k39 s GLN 49 Cb -0.09 -3.19 -0.04 0.00 1.00 0.00 0.00 33.01 30.69 2k39 s GLN 49 CO 0.06 0.05 0.36 -0.51 -2.12 0.00 0.00 175.29 173.12 2k39 s LEU 50 N -1.10 4.05 0.27 2.90 1.43 0.94 -4.79 118.68 122.38 2k39 s LEU 50 Ca 0.48 0.29 -0.05 0.00 -1.03 0.00 0.00 54.13 53.82 2k39 s LEU 50 Cb -0.33 -2.40 -0.05 0.00 0.03 0.00 0.00 46.19 43.43 2k39 s LEU 50 CO 0.42 -0.15 0.53 -1.61 0.23 0.00 0.00 176.35 175.77 2k39 s GLU 51 N 1.91 3.64 0.54 1.70 0.41 -1.26 -4.44 118.70 121.19 2k39 s GLU 51 Ca 0.15 -0.00 -0.16 0.00 -0.41 0.00 0.00 54.97 54.55 2k39 s GLU 51 Cb -0.16 -2.67 -0.07 0.00 -1.78 0.00 0.00 34.13 29.46 2k39 s GLU 51 CO 0.09 0.25 1.00 -0.51 -0.49 0.00 0.00 175.26 175.61 2k39 s ASP 52 N -3.06 6.43 0.00 -0.19 1.11 -1.26 -4.36 116.67 115.34 2k39 s ASP 52 Ca 0.44 1.61 0.00 0.00 0.18 0.00 0.00 52.55 54.77 2k39 s ASP 52 Cb -0.11 -2.51 0.00 0.00 1.07 0.00 0.00 42.92 41.37 2k39 s ASP 52 CO 0.29 -0.72 0.00 0.61 1.18 0.00 0.00 175.17 176.53 2k39 n GLY 53 N -1.55 0.80 3.26 0.21 0.00 -1.26 -4.97 105.19 101.67 2k39 n GLY 53 Ca 0.07 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 -0.39 1.34 0.61 1.61 0.52 -1.26 -4.99 118.95 116.38 2k39 s ARG 54 Ca 0.00 -0.98 -0.12 0.00 -0.52 0.00 0.00 55.73 54.11 2k39 s ARG 54 Cb 0.00 -1.48 -0.04 0.00 0.52 0.00 0.00 34.95 33.95 2k39 s ARG 54 CO 0.00 0.37 1.03 0.95 0.02 0.00 0.00 175.30 177.67 2k39 s THR 55 N -0.87 4.69 -0.07 0.02 -4.23 -1.26 -1.98 115.64 111.94 2k39 s THR 55 Ca 0.07 0.91 -0.24 0.00 -1.18 0.00 0.00 61.69 61.25 2k39 s THR 55 Cb -0.09 -3.85 -0.20 0.00 1.34 0.00 0.00 72.50 69.70 2k39 s THR 55 CO 0.02 -1.10 0.94 0.25 -0.54 0.00 0.00 174.62 174.19 2k39 h LEU 56 N -0.21 -0.06 0.00 4.79 5.85 -1.41 -3.29 115.31 120.97 2k39 h LEU 56 Ca -0.44 -0.57 0.00 0.00 0.84 0.00 0.00 57.88 57.71 2k39 h LEU 56 Cb 1.19 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2k39 h LEU 56 CO 0.62 0.59 0.00 -1.20 -0.34 0.00 0.00 178.44 178.11 2k39 n SER 57 N -4.81 0.00 0.15 1.25 7.64 -1.05 -2.59 113.62 114.21 2k39 n SER 57 Ca -0.08 -0.85 0.01 0.00 1.01 0.00 0.00 58.87 58.96 2k39 n SER 57 Cb 0.31 -0.02 0.32 0.00 -1.01 0.00 0.00 64.21 63.82 2k39 n SER 57 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2k39 h ASP 58 N 0.00 0.11 -5.93 6.43 3.58 -1.86 -3.44 116.42 115.31 2k39 h ASP 58 Ca 0.00 -0.04 -0.54 0.00 0.42 0.00 0.00 57.03 56.87 2k39 h ASP 58 Cb 0.02 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 2k39 h ASP 58 CO 0.00 0.45 -0.23 -1.22 -2.88 0.00 0.00 179.24 175.37 2k39 n TYR 59 N -4.10 -0.95 -1.35 0.28 4.01 -1.07 -5.03 117.16 108.94 2k39 n TYR 59 Ca -0.02 -2.22 -0.27 0.00 -0.16 0.00 0.00 57.90 55.23 2k39 n TYR 59 Cb 0.41 -0.46 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 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 -1.94 6.79 -4.75 7.72 6.94 -1.26 -4.95 115.26 123.81 2k39 n ASN 60 Ca 0.02 -3.33 -0.40 0.00 -0.02 0.00 0.00 54.58 50.84 2k39 n ASN 60 Cb 0.60 -1.12 -0.05 0.00 -2.36 0.00 0.00 39.78 36.85 2k39 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2k39 s ILE 61 N -3.00 3.74 0.32 1.53 1.01 -1.26 -5.03 121.20 118.51 2k39 s ILE 61 Ca 0.51 1.68 -0.07 0.00 0.00 0.00 0.00 60.65 62.76 2k39 s ILE 61 Cb 0.37 -4.07 0.03 0.00 0.01 0.00 0.00 42.46 38.80 2k39 s ILE 61 CO -0.16 0.37 0.55 0.00 0.00 0.00 0.00 174.94 175.70 2k39 n GLN 62 N 1.59 0.79 -1.58 2.79 10.64 -1.26 -4.83 117.38 125.52 2k39 n GLN 62 Ca -0.00 -2.19 -0.53 0.00 -1.83 0.00 0.00 57.00 52.44 2k39 n GLN 62 Cb 0.46 2.38 -0.07 0.00 -0.86 0.00 0.00 30.24 32.15 2k39 n GLN 62 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 2k39 n LYS 63 N -0.48 1.28 -2.91 2.61 0.00 -1.25 -1.44 118.16 115.95 2k39 n LYS 63 Ca -0.03 0.42 -0.21 0.00 0.00 0.00 0.00 58.31 58.49 2k39 n LYS 63 Cb 0.51 -2.34 0.01 0.00 0.00 0.00 0.00 35.03 33.22 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 6.86 -3.57 -2.14 1.64 1.02 -1.01 -5.01 120.64 118.44 2k39 n GLU 64 Ca 0.33 0.76 -0.41 0.00 -0.02 0.00 0.00 57.16 57.82 2k39 n GLU 64 Cb 0.20 -5.51 -0.02 0.00 -0.02 0.00 0.00 31.44 26.08 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 -2.49 6.81 -0.13 1.62 0.01 -0.52 -4.71 113.70 114.29 2k39 s SER 65 Ca 0.23 2.63 -0.05 0.00 1.31 0.00 0.00 55.95 60.06 2k39 s SER 65 Cb -0.11 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 2k39 s SER 65 CO 0.28 -0.52 0.06 -0.89 0.41 0.00 0.00 173.24 172.58 2k39 s THR 66 N -0.87 4.80 -0.08 1.44 2.01 -1.26 -0.98 115.64 120.70 2k39 s THR 66 Ca 0.51 -0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.45 2k39 s THR 66 Cb -0.39 -3.09 -0.03 0.00 0.01 0.00 0.00 72.50 69.00 2k39 s THR 66 CO 0.49 0.56 -0.02 -0.76 -0.69 0.00 0.00 174.62 174.21 2k39 s LEU 67 N -0.51 3.45 -0.23 4.42 2.01 -0.85 -4.70 118.68 122.28 2k39 s LEU 67 Ca 0.10 0.09 -0.13 0.00 0.01 0.00 0.00 54.13 54.20 2k39 s LEU 67 Cb -0.12 -1.78 -0.04 0.00 0.01 0.00 0.00 46.19 44.26 2k39 s LEU 67 CO 0.02 0.36 0.28 -1.00 1.01 0.00 0.00 176.35 177.02 2k39 s HIS 68 N -0.81 3.32 -0.21 0.29 3.76 -0.60 -2.05 115.29 118.99 2k39 s HIS 68 Ca 0.12 0.39 -0.16 0.00 -0.15 0.00 0.00 55.06 55.26 2k39 s HIS 68 Cb -0.11 -2.41 -0.04 0.00 1.11 0.00 0.00 32.58 31.13 2k39 s HIS 68 CO 0.02 -0.01 0.43 -1.17 -0.85 0.00 0.00 174.74 173.16 2k39 s LEU 69 N 1.31 4.13 -0.32 0.89 2.96 0.71 -1.47 118.68 126.89 2k39 s LEU 69 Ca 0.13 0.52 -0.12 0.00 -0.22 0.00 0.00 54.13 54.44 2k39 s LEU 69 Cb -0.14 -2.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.97 2k39 s LEU 69 CO 0.07 -0.12 0.20 -0.69 -1.32 0.00 0.00 176.35 174.49 2k39 s VAL 70 N 1.52 5.10 -0.80 1.68 1.01 0.28 -4.07 120.40 125.12 2k39 s VAL 70 Ca 0.20 -0.18 0.23 0.00 0.00 0.00 0.00 61.98 62.22 2k39 s VAL 70 Cb -0.15 -3.57 -0.15 0.00 0.00 0.00 0.00 36.38 32.52 2k39 s VAL 70 CO 0.09 0.07 1.03 0.18 0.00 0.00 0.00 175.10 176.47 2k39 n LEU 71 N 5.06 0.69 0.00 3.92 4.77 -1.26 -1.51 117.00 128.68 2k39 n LEU 71 Ca -0.13 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2k39 n LEU 71 Cb 0.50 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2k39 n LEU 71 CO 0.35 0.14 0.00 -1.14 -1.33 0.00 0.00 177.39 175.41 2k39 n ARG 72 N -1.71 0.00 -4.02 3.23 0.00 -1.26 -4.74 116.66 108.17 2k39 n ARG 72 Ca 0.03 0.00 -0.34 0.00 -0.00 0.00 0.00 57.85 57.54 2k39 n ARG 72 Cb 0.38 -0.18 -0.15 0.00 0.00 0.00 0.00 32.46 32.51 2k39 n ARG 72 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2k39 s LEU 73 N 0.00 2.56 0.15 6.15 0.20 -1.26 -5.06 118.68 121.41 2k39 s LEU 73 Ca 0.00 -0.50 -0.16 0.00 0.69 0.00 0.00 54.13 54.15 2k39 s LEU 73 Cb 0.00 -1.62 0.03 0.00 -0.43 0.00 0.00 46.19 44.17 2k39 s LEU 73 CO 0.00 -0.01 0.44 -0.60 -0.29 0.00 0.00 176.35 175.89 2k39 s ARG 74 N 1.38 1.16 -0.30 1.98 3.52 -1.26 -5.04 118.95 120.38 2k39 s ARG 74 Ca 0.05 -0.75 0.08 0.00 -0.13 0.00 0.00 55.73 54.98 2k39 s ARG 74 Cb -0.14 0.48 0.46 0.00 -1.56 0.00 0.00 34.95 34.20 2k39 s ARG 74 CO -0.07 -0.47 1.33 0.41 -0.81 0.00 0.00 175.30 175.69 2k39 n GLY 75 N -0.26 5.71 0.00 8.12 0.00 -1.26 -5.20 105.19 112.31 2k39 n GLY 75 Ca -0.14 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2k39 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93