#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fd6 s THR 2 N 0.00 4.85 -0.44 1.12 2.01 -0.24 -4.95 115.64 117.99 1fd6 s THR 2 Ca 0.00 0.39 -0.11 0.00 0.31 0.00 0.00 61.69 62.28 1fd6 s THR 2 Cb 0.00 -4.14 0.08 0.00 0.01 0.00 0.00 72.50 68.45 1fd6 s THR 2 CO 0.00 -0.45 0.31 -0.89 -0.69 0.00 0.00 174.62 172.90 1fd6 s THR 3 N 2.79 4.52 0.88 -0.82 2.01 -1.26 -0.52 115.64 123.23 1fd6 s THR 3 Ca 0.24 -1.34 -0.10 0.00 0.31 0.00 0.00 61.69 60.80 1fd6 s THR 3 Cb -0.14 -3.77 0.18 0.00 0.01 0.00 0.00 72.50 68.78 1fd6 s THR 3 CO 0.17 -0.56 1.20 -0.36 -0.69 0.00 0.00 174.62 174.39 1fd6 s PHE 4 N 1.48 1.49 -0.23 4.92 0.08 -1.22 -4.93 117.98 119.57 1fd6 s PHE 4 Ca 0.03 0.05 -0.03 0.00 0.12 0.00 0.00 56.93 57.10 1fd6 s PHE 4 Cb -0.24 -3.69 0.12 0.00 -0.57 0.00 0.00 43.02 38.64 1fd6 s PHE 4 CO 0.03 -2.33 0.33 0.21 -0.10 0.00 0.00 175.22 173.36 1fd6 s LYS 5 N -5.61 0.31 -0.24 0.44 2.20 -1.07 -3.80 119.74 111.97 1fd6 s LYS 5 Ca 0.72 0.43 -0.19 0.00 -0.36 0.00 0.00 55.97 56.56 1fd6 s LYS 5 Cb -0.04 -0.68 -0.02 0.00 -1.51 0.00 0.00 37.83 35.58 1fd6 s LYS 5 CO 0.50 -0.66 0.58 -1.17 -0.36 0.00 0.00 175.35 174.24 1fd6 s LEU 6 N 2.48 4.09 0.93 5.43 2.96 -0.38 -0.02 118.68 134.16 1fd6 s LEU 6 Ca 0.11 0.68 -0.12 0.00 -0.22 0.00 0.00 54.13 54.58 1fd6 s LEU 6 Cb -0.15 -2.79 0.15 0.00 0.50 0.00 0.00 46.19 43.90 1fd6 s LEU 6 CO -0.15 -0.30 1.11 -0.51 -1.32 0.00 0.00 176.35 175.17 1fd6 s ILE 7 N 2.19 2.29 -0.53 6.68 1.10 0.85 -0.83 121.20 132.96 1fd6 s ILE 7 Ca 0.25 0.09 0.06 0.00 -0.51 0.00 0.00 60.65 60.55 1fd6 s ILE 7 Cb -0.16 -2.69 0.23 0.00 0.15 0.00 0.00 42.46 39.99 1fd6 s ILE 7 CO 0.09 -0.12 0.57 -0.38 -2.11 0.00 0.00 174.94 172.99 1fd6 n ILE 8 N -3.91 0.65 -1.73 2.00 5.41 -0.86 -4.39 119.36 116.53 1fd6 n ILE 8 Ca 0.06 -4.48 -0.35 0.00 1.00 0.00 0.00 62.75 58.98 1fd6 n ILE 8 Cb 0.57 -2.00 0.01 0.00 -0.71 0.00 0.00 39.64 37.52 1fd6 n ILE 8 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1fd6 n ASN 9 N 1.49 7.20 -4.83 4.38 3.02 -1.21 -3.55 115.26 121.76 1fd6 n ASN 9 Ca 0.25 -3.63 -0.21 0.00 -0.03 0.00 0.00 54.58 50.96 1fd6 n ASN 9 Cb 0.45 -1.11 -0.04 0.00 -0.61 0.00 0.00 39.78 38.47 1fd6 n ASN 9 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1fd6 s GLY 10 N -0.66 1.83 0.00 7.41 0.00 -1.23 -0.41 107.32 114.26 1fd6 s GLY 10 Ca 0.54 -1.70 0.24 0.00 0.00 0.00 0.00 44.72 43.80 1fd6 s GLY 10 CO -0.33 -1.62 1.85 1.17 0.00 0.00 0.00 173.10 174.17 1fd6 n LYS 11 N -1.35 1.14 -0.04 2.90 3.00 -1.26 -3.63 118.16 118.93 1fd6 n LYS 11 Ca -0.02 -0.21 -0.03 0.00 -0.00 0.00 0.00 58.31 58.05 1fd6 n LYS 11 Cb 0.60 -1.38 -0.06 0.00 0.00 0.00 0.00 35.03 34.19 1fd6 n LYS 11 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1fd6 n THR 12 N -0.64 0.52 -4.25 3.15 -1.04 -1.26 -5.06 114.28 105.71 1fd6 n THR 12 Ca 0.18 -0.33 -0.14 0.00 -2.04 0.00 0.00 64.05 61.71 1fd6 n THR 12 Cb 0.13 -0.70 -0.10 0.00 -1.82 0.00 0.00 70.33 67.84 1fd6 n THR 12 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1fd6 s LEU 13 N -4.53 1.90 -0.20 -4.42 1.43 -1.24 -5.15 118.68 106.48 1fd6 s LEU 13 Ca -0.04 -1.24 -0.13 0.00 -1.03 0.00 0.00 54.13 51.69 1fd6 s LEU 13 Cb 0.03 0.03 0.06 0.00 0.03 0.00 0.00 46.19 46.34 1fd6 s LEU 13 CO 0.34 -0.64 0.50 -0.75 0.23 0.00 0.00 176.35 176.02 1fd6 s LYS 14 N -3.97 0.51 0.00 1.70 2.20 -1.25 -3.47 119.74 115.46 1fd6 s LYS 14 Ca 0.28 0.87 0.00 0.00 -0.36 0.00 0.00 55.97 56.76 1fd6 s LYS 14 Cb 0.07 0.08 0.00 0.00 -1.51 0.00 0.00 37.83 36.47 1fd6 s LYS 14 CO 0.07 -0.14 0.00 0.41 -0.36 0.00 0.00 175.35 175.33 1fd6 n GLY 15 N 3.94 0.49 3.48 5.54 0.00 -1.23 -4.96 105.19 112.45 1fd6 n GLY 15 Ca -0.20 -1.08 -0.16 0.00 0.00 0.00 0.00 46.02 44.57 1fd6 n GLY 15 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1fd6 s GLU 16 N 0.00 1.09 0.15 1.61 -1.05 -1.26 -2.04 118.70 117.19 1fd6 s GLU 16 Ca 0.00 0.05 0.08 0.00 -0.15 0.00 0.00 54.97 54.95 1fd6 s GLU 16 Cb 0.00 0.51 -0.04 0.00 -0.44 0.00 0.00 34.13 34.16 1fd6 s GLU 16 CO 0.00 -0.37 -0.18 0.99 0.95 0.00 0.00 175.26 176.64 1fd6 s THR 17 N -1.82 1.75 0.03 1.83 2.01 -0.01 -4.97 115.64 114.44 1fd6 s THR 17 Ca -0.08 -1.82 0.00 0.00 0.31 0.00 0.00 61.69 60.10 1fd6 s THR 17 Cb -0.00 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 1fd6 s THR 17 CO 0.04 -0.28 -0.04 0.42 -0.69 0.00 0.00 174.62 174.08 1fd6 s THR 18 N -1.88 0.17 -0.06 -0.82 -4.23 -1.26 -1.25 115.64 106.31 1fd6 s THR 18 Ca 0.13 -1.01 -0.19 0.00 -1.18 0.00 0.00 61.69 59.44 1fd6 s THR 18 Cb -0.06 -0.41 0.04 0.00 1.34 0.00 0.00 72.50 73.41 1fd6 s THR 18 CO 0.06 -0.53 0.44 0.28 -0.54 0.00 0.00 174.62 174.33 1fd6 s THR 19 N -1.66 0.03 -0.40 3.99 -1.32 -1.25 -5.04 115.64 109.98 1fd6 s THR 19 Ca -0.13 -0.24 -0.25 0.00 -1.21 0.00 0.00 61.69 59.86 1fd6 s THR 19 Cb -0.08 -0.73 0.02 0.00 -1.51 0.00 0.00 72.50 70.20 1fd6 s THR 19 CO -0.02 -0.13 0.90 -1.61 -2.21 0.00 0.00 174.62 171.55 1fd6 s GLU 20 N -0.92 3.70 0.05 7.08 8.01 -1.26 -3.37 118.70 131.99 1fd6 s GLU 20 Ca -0.10 0.37 0.01 0.00 0.01 0.00 0.00 54.97 55.25 1fd6 s GLU 20 Cb -0.03 -3.85 -0.00 0.00 -4.31 0.00 0.00 34.13 25.93 1fd6 s GLU 20 CO 0.05 -1.04 0.02 0.00 0.01 0.00 0.00 175.26 174.30 1fd6 n ALA 21 N 6.87 0.07 -0.04 5.21 0.00 0.32 -4.98 120.51 127.96 1fd6 n ALA 21 Ca 0.06 -0.25 -0.02 0.00 0.00 0.00 0.00 53.44 53.23 1fd6 n ALA 21 Cb 0.48 0.17 -0.09 0.00 0.00 0.00 0.00 19.45 20.02 1fd6 n ALA 21 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1fd6 n VAL 22 N -0.11 0.53 -3.79 0.00 3.14 -1.26 -1.08 118.33 115.76 1fd6 n VAL 22 Ca -0.00 -0.40 -0.02 0.00 -2.96 0.00 0.00 64.34 60.96 1fd6 n VAL 22 Cb 0.07 -0.45 0.00 0.00 -1.06 0.00 0.00 33.84 32.41 1fd6 n VAL 22 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1fd6 s ASP 23 N -4.04 -0.07 0.58 6.55 2.15 -1.26 -4.62 116.67 115.96 1fd6 s ASP 23 Ca -0.05 -0.42 0.27 0.00 0.43 0.00 0.00 52.55 52.79 1fd6 s ASP 23 Cb 0.04 0.39 1.69 0.00 -0.30 0.00 0.00 42.92 44.74 1fd6 s ASP 23 CO 0.45 -0.74 2.20 0.00 -0.17 0.00 0.00 175.17 176.91 1fd6 h ALA 24 N 2.00 1.69 -0.04 3.66 0.00 -1.98 -1.01 119.26 123.58 1fd6 h ALA 24 Ca -0.27 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1fd6 h ALA 24 Cb 1.22 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1fd6 h ALA 24 CO 0.30 -0.08 0.04 0.00 0.00 0.00 0.00 179.25 179.52 1fd6 h ALA 25 N 1.95 1.71 0.00 0.00 0.00 -2.01 -2.57 119.26 118.33 1fd6 h ALA 25 Ca 0.02 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 1fd6 h ALA 25 Cb 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1fd6 h ALA 25 CO -0.00 -0.06 -1.75 2.41 0.00 0.00 0.00 179.25 179.85 1fd6 n THR 26 N -4.02 0.75 0.15 0.00 -1.04 -0.56 -4.34 114.28 105.22 1fd6 n THR 26 Ca -0.02 -0.41 -0.14 0.00 -2.04 0.00 0.00 64.05 61.44 1fd6 n THR 26 Cb 0.13 -0.78 -0.07 0.00 -1.82 0.00 0.00 70.33 67.79 1fd6 n THR 26 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1fd6 h ALA 27 N 0.39 -0.33 -0.70 2.41 0.00 -1.12 -2.10 119.26 117.82 1fd6 h ALA 27 Ca -0.29 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.58 1fd6 h ALA 27 Cb 1.61 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.53 1fd6 h ALA 27 CO -0.00 -0.69 0.45 1.49 0.00 0.00 0.00 179.25 180.50 1fd6 h GLU 28 N -0.34 0.87 -0.61 0.00 4.81 -1.73 0.42 114.58 118.00 1fd6 h GLU 28 Ca -0.02 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.23 1fd6 h GLU 28 Cb 0.29 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 1fd6 h GLU 28 CO 0.01 0.58 0.40 0.87 -0.73 0.00 0.00 179.01 180.14 1fd6 h LYS 29 N 0.90 0.55 0.03 1.92 1.57 -1.69 0.89 116.57 120.74 1fd6 h LYS 29 Ca 0.27 -0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.87 1fd6 h LYS 29 Cb -0.03 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1fd6 h LYS 29 CO -0.09 0.37 -0.81 0.28 -0.57 0.00 0.00 179.45 178.63 1fd6 h VAL 30 N 0.57 1.29 -0.41 0.50 2.07 -0.63 -3.15 116.25 116.50 1fd6 h VAL 30 Ca 0.27 -2.30 -0.07 0.00 0.82 0.00 0.00 66.70 65.41 1fd6 h VAL 30 Cb 0.31 2.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.86 1fd6 h VAL 30 CO -0.08 0.52 -0.05 -0.26 0.02 0.00 0.00 177.57 177.72 1fd6 h PHE 31 N -0.83 0.73 -0.26 1.57 0.04 0.01 -2.33 116.94 115.87 1fd6 h PHE 31 Ca -0.20 -0.11 -0.02 0.00 2.80 0.00 0.00 57.97 60.44 1fd6 h PHE 31 Cb 1.30 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 39.24 1fd6 h PHE 31 CO 0.17 0.72 0.09 -0.22 -0.60 0.00 0.00 178.31 178.47 1fd6 h LYS 32 N 0.63 0.40 -0.08 1.51 3.64 0.67 -1.06 116.57 122.29 1fd6 h LYS 32 Ca 0.12 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1fd6 h LYS 32 Cb 0.47 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1fd6 h LYS 32 CO 0.02 0.46 0.05 0.37 -2.27 0.00 0.00 179.45 178.09 1fd6 h GLN 33 N 0.26 0.09 0.13 1.90 5.75 -1.46 0.28 115.11 122.07 1fd6 h GLN 33 Ca 0.08 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 1fd6 h GLN 33 Cb 0.23 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.76 1fd6 h GLN 33 CO -0.00 0.06 -0.06 -0.92 -2.65 0.00 0.00 178.83 175.25 1fd6 h TYR 34 N 0.10 -0.17 -0.63 3.99 3.20 -0.86 -2.72 116.97 119.88 1fd6 h TYR 34 Ca 0.03 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1fd6 h TYR 34 Cb 0.01 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 1fd6 h TYR 34 CO -0.00 0.27 0.15 0.00 -1.64 0.00 0.00 178.16 176.95 1fd6 h ALA 35 N 0.04 1.08 -0.50 1.82 0.00 -0.71 -1.96 119.26 119.03 1fd6 h ALA 35 Ca -0.02 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.71 1fd6 h ALA 35 Cb 0.51 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1fd6 h ALA 35 CO 0.03 0.61 0.25 -0.97 0.00 0.00 0.00 179.25 179.17 1fd6 h ASN 36 N 0.95 0.35 -0.01 0.00 -1.24 -0.47 0.95 115.58 116.10 1fd6 h ASN 36 Ca 0.20 0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.24 1fd6 h ASN 36 Cb 0.34 -0.03 -0.00 0.00 0.73 0.00 0.00 38.32 39.35 1fd6 h ASN 36 CO 0.00 0.24 -0.00 0.44 -1.29 0.00 0.00 177.43 176.82 1fd6 h ASP 37 N 0.48 0.01 -0.61 1.15 3.32 -1.28 -3.22 116.42 116.28 1fd6 h ASP 37 Ca 0.22 -0.44 -0.02 0.00 0.02 0.00 0.00 57.03 56.81 1fd6 h ASP 37 Cb 0.14 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1fd6 h ASP 37 CO -0.16 0.45 0.28 0.78 -1.72 0.00 0.00 179.24 178.87 1fd6 h ASN 38 N -0.43 0.80 0.00 6.45 2.35 -1.15 -3.47 115.58 120.14 1fd6 h ASN 38 Ca 0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 1fd6 h ASN 38 Cb 0.45 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1fd6 h ASN 38 CO 0.00 0.71 0.00 0.61 -1.65 0.00 0.00 177.43 177.10 1fd6 n GLY 39 N -0.92 0.91 2.66 2.83 0.00 0.29 -4.97 105.19 106.00 1fd6 n GLY 39 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1fd6 n GLY 39 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1fd6 n ILE 40 N 0.00 2.19 -1.23 -0.61 5.41 0.77 -4.84 119.36 121.05 1fd6 n ILE 40 Ca 0.00 -5.10 -0.31 0.00 1.00 0.00 0.00 62.75 58.34 1fd6 n ILE 40 Cb 0.00 -2.15 0.07 0.00 -0.71 0.00 0.00 39.64 36.85 1fd6 n ILE 40 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1fd6 n ASP 41 N 1.37 7.34 0.00 4.38 2.03 -1.26 -4.67 116.55 125.74 1fd6 n ASP 41 Ca 0.25 -3.63 0.00 0.00 0.52 0.00 0.00 54.79 51.93 1fd6 n ASP 41 Cb 0.38 -0.99 0.00 0.00 -0.72 0.00 0.00 41.12 39.79 1fd6 n ASP 41 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1fd6 n GLY 42 N -0.66 -2.30 3.24 0.27 0.00 -1.26 -4.93 105.19 99.56 1fd6 n GLY 42 Ca 0.56 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 1fd6 n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fd6 s GLU 43 N 0.00 2.73 0.27 1.61 2.02 -1.19 -4.74 118.70 119.40 1fd6 s GLU 43 Ca 0.00 -1.08 -0.24 0.00 0.02 0.00 0.00 54.97 53.68 1fd6 s GLU 43 Cb 0.00 -3.23 -0.09 0.00 0.10 0.00 0.00 34.13 30.91 1fd6 s GLU 43 CO 0.00 -0.53 0.85 -1.58 0.02 0.00 0.00 175.26 174.02 1fd6 s TRP 44 N 1.36 3.71 -0.22 1.61 0.52 -1.26 -3.86 118.94 120.81 1fd6 s TRP 44 Ca -0.01 1.64 -0.13 0.00 0.02 0.00 0.00 56.10 57.61 1fd6 s TRP 44 Cb -0.18 -2.80 0.07 0.00 -1.15 0.00 0.00 33.47 29.40 1fd6 s TRP 44 CO -0.00 0.29 0.54 0.95 0.02 0.00 0.00 176.95 178.75 1fd6 s THR 45 N -1.52 -0.01 -0.20 2.01 -4.23 -1.08 -4.93 115.64 105.68 1fd6 s THR 45 Ca 0.46 0.04 -0.09 0.00 -1.18 0.00 0.00 61.69 60.93 1fd6 s THR 45 Cb -0.19 -0.78 -0.04 0.00 1.34 0.00 0.00 72.50 72.83 1fd6 s THR 45 CO 0.23 0.02 0.10 -0.47 -0.54 0.00 0.00 174.62 173.96 1fd6 s TYR 46 N 1.28 3.30 -0.48 3.99 5.04 -1.26 0.01 117.35 129.22 1fd6 s TYR 46 Ca -0.08 0.15 -0.16 0.00 -2.44 0.00 0.00 57.07 54.55 1fd6 s TYR 46 Cb -0.06 -2.14 0.08 0.00 0.35 0.00 0.00 41.96 40.18 1fd6 s TYR 46 CO -0.13 0.16 0.42 0.34 -1.34 0.00 0.00 175.55 174.99 1fd6 s ASP 47 N 0.54 6.16 0.59 4.32 -1.08 -1.20 -4.92 116.67 121.07 1fd6 s ASP 47 Ca 0.05 -1.37 0.36 0.00 -0.52 0.00 0.00 52.55 51.08 1fd6 s ASP 47 Cb -0.12 -2.19 1.82 0.00 -1.46 0.00 0.00 42.92 40.97 1fd6 s ASP 47 CO 0.00 -0.68 2.17 -2.24 0.52 0.00 0.00 175.17 174.94 1fd6 h ASP 48 N 8.78 0.00 -0.95 -0.34 2.03 -1.96 0.38 116.42 124.36 1fd6 h ASP 48 Ca -0.29 0.00 0.15 0.00 -0.73 0.00 0.00 57.03 56.17 1fd6 h ASP 48 Cb 1.11 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 39.53 1fd6 h ASP 48 CO 0.90 0.03 0.60 0.00 -1.03 0.00 0.00 179.24 179.75 1fd6 h ALA 49 N 1.97 1.75 0.00 4.15 0.00 -2.00 -3.28 119.26 121.84 1fd6 h ALA 49 Ca -0.00 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1fd6 h ALA 49 Cb 0.25 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1fd6 h ALA 49 CO 0.00 -0.03 -0.36 0.25 0.00 0.00 0.00 179.25 179.12 1fd6 n THR 50 N -4.62 0.00 -2.94 0.00 -2.24 -1.10 -5.08 114.28 98.30 1fd6 n THR 50 Ca 0.20 -0.07 -0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1fd6 n THR 50 Cb 0.49 0.36 -0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1fd6 n THR 50 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1fd6 n LYS 51 N 0.03 -2.03 -3.25 -0.78 4.01 0.13 -4.81 118.16 111.46 1fd6 n LYS 51 Ca -0.01 1.87 -0.04 0.00 -0.51 0.00 0.00 58.31 59.62 1fd6 n LYS 51 Cb 0.66 -3.24 -0.04 0.00 -0.51 0.00 0.00 35.03 31.91 1fd6 n LYS 51 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1fd6 s THR 52 N -1.25 -0.78 0.24 -0.18 2.01 -1.18 -2.60 115.64 111.90 1fd6 s THR 52 Ca -0.01 -0.13 -0.31 0.00 0.31 0.00 0.00 61.69 61.55 1fd6 s THR 52 Cb 0.00 -0.96 -0.11 0.00 0.01 0.00 0.00 72.50 71.44 1fd6 s THR 52 CO 0.41 -0.13 1.65 -0.36 -0.69 0.00 0.00 174.62 175.49 1fd6 s PHE 53 N 2.67 2.86 -0.35 4.92 0.08 0.96 -3.27 117.98 125.85 1fd6 s PHE 53 Ca 0.12 0.57 0.03 0.00 0.12 0.00 0.00 56.93 57.77 1fd6 s PHE 53 Cb -0.13 -4.08 0.10 0.00 -0.57 0.00 0.00 43.02 38.35 1fd6 s PHE 53 CO -0.25 -3.89 0.08 0.99 -0.10 0.00 0.00 175.22 172.06 1fd6 s THR 54 N 0.67 2.00 0.36 0.64 2.01 0.10 -0.10 115.64 121.32 1fd6 s THR 54 Ca 0.69 -2.25 0.07 0.00 0.31 0.00 0.00 61.69 60.51 1fd6 s THR 54 Cb -0.48 -2.48 -0.01 0.00 0.01 0.00 0.00 72.50 69.54 1fd6 s THR 54 CO 0.39 -0.64 0.42 0.54 -0.69 0.00 0.00 174.62 174.63 1fd6 s VAL 55 N 0.92 3.52 -0.30 3.82 0.11 -1.25 -2.62 120.40 124.60 1fd6 s VAL 55 Ca 0.11 -1.16 -0.02 0.00 -2.93 0.00 0.00 61.98 57.99 1fd6 s VAL 55 Cb -0.19 -3.21 0.19 0.00 -1.53 0.00 0.00 36.38 31.63 1fd6 s VAL 55 CO -0.10 -0.11 0.63 -0.89 -3.33 0.00 0.00 175.10 171.29 1fd6 s THR 56 N -2.29 -0.96 -2.06 5.04 2.01 -1.25 -3.32 115.64 112.82 1fd6 s THR 56 Ca 0.46 0.00 0.31 0.00 0.31 0.00 0.00 61.69 62.77 1fd6 s THR 56 Cb -0.08 -1.00 0.86 0.00 0.01 0.00 0.00 72.50 72.30 1fd6 s THR 56 CO 0.30 0.00 2.17 1.21 -0.69 0.00 0.00 174.62 177.60