#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 -0.24 -0.86 3.17 2.01 0.29 -4.91 115.64 115.10 1fd6 s THR 2 Ca 0.00 -0.02 -0.23 0.00 0.31 0.00 0.00 61.69 61.75 1fd6 s THR 2 Cb 0.00 -0.56 0.07 0.00 0.01 0.00 0.00 72.50 72.02 1fd6 s THR 2 CO 0.00 -0.15 1.22 -0.89 -0.69 0.00 0.00 174.62 174.11 1fd6 s THR 3 N 2.27 4.19 1.02 -0.82 2.01 -1.26 -2.98 115.64 120.07 1fd6 s THR 3 Ca 0.05 -0.66 -0.17 0.00 0.31 0.00 0.00 61.69 61.22 1fd6 s THR 3 Cb -0.15 -4.87 0.22 0.00 0.01 0.00 0.00 72.50 67.71 1fd6 s THR 3 CO -0.10 -1.70 1.27 -0.36 -0.69 0.00 0.00 174.62 173.05 1fd6 s PHE 4 N 4.30 1.34 -0.17 4.92 0.08 -1.26 -4.92 117.98 122.28 1fd6 s PHE 4 Ca 0.35 0.37 -0.04 0.00 0.12 0.00 0.00 56.93 57.72 1fd6 s PHE 4 Cb -0.07 -3.95 0.07 0.00 -0.57 0.00 0.00 43.02 38.50 1fd6 s PHE 4 CO -0.00 -2.95 0.16 0.21 -0.10 0.00 0.00 175.22 172.54 1fd6 s LYS 5 N -5.77 0.11 -0.32 0.44 2.20 -1.09 -4.04 119.74 111.27 1fd6 s LYS 5 Ca 0.73 0.18 -0.17 0.00 -0.36 0.00 0.00 55.97 56.35 1fd6 s LYS 5 Cb -0.05 -1.23 -0.01 0.00 -1.51 0.00 0.00 37.83 35.02 1fd6 s LYS 5 CO 0.54 -0.59 0.47 -1.17 -0.36 0.00 0.00 175.35 174.24 1fd6 s LEU 6 N 2.25 4.24 1.07 5.43 0.20 -0.19 0.11 118.68 131.79 1fd6 s LEU 6 Ca 0.04 0.11 -0.15 0.00 0.69 0.00 0.00 54.13 54.83 1fd6 s LEU 6 Cb -0.15 -2.55 0.23 0.00 -0.43 0.00 0.00 46.19 43.29 1fd6 s LEU 6 CO -0.10 -0.38 1.11 -0.51 -0.29 0.00 0.00 176.35 176.19 1fd6 s ILE 7 N 2.28 1.84 -0.50 6.68 2.07 0.14 -1.09 121.20 132.62 1fd6 s ILE 7 Ca 0.18 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 59.48 1fd6 s ILE 7 Cb -0.16 -2.54 0.21 0.00 0.13 0.00 0.00 42.46 40.10 1fd6 s ILE 7 CO 0.12 0.00 0.50 -0.38 -1.91 0.00 0.00 174.94 173.27 1fd6 n ILE 8 N -4.36 0.13 -1.51 2.00 5.41 0.40 -4.47 119.36 116.97 1fd6 n ILE 8 Ca 0.09 -4.21 -0.33 0.00 1.00 0.00 0.00 62.75 59.30 1fd6 n ILE 8 Cb 0.59 -1.93 0.04 0.00 -0.71 0.00 0.00 39.64 37.62 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 1.86 7.28 -4.84 4.38 3.02 -1.20 -3.48 115.26 122.28 1fd6 n ASN 9 Ca 0.25 -3.61 -0.23 0.00 -0.03 0.00 0.00 54.58 50.96 1fd6 n ASN 9 Cb 0.46 -1.06 -0.04 0.00 -0.61 0.00 0.00 39.78 38.52 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 -0.93 1.45 0.00 7.41 0.00 -1.24 -1.56 107.32 112.45 1fd6 s GLY 10 Ca 0.55 -1.35 0.26 0.00 0.00 0.00 0.00 44.72 44.17 1fd6 s GLY 10 CO -0.19 -1.38 1.88 1.17 0.00 0.00 0.00 173.10 174.58 1fd6 n LYS 11 N -1.03 0.53 -0.10 2.90 4.81 -1.26 -3.35 118.16 120.67 1fd6 n LYS 11 Ca -0.08 0.03 -0.11 0.00 -0.87 0.00 0.00 58.31 57.28 1fd6 n LYS 11 Cb 0.57 -1.50 -0.13 0.00 0.02 0.00 0.00 35.03 33.99 1fd6 n LYS 11 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1fd6 n THR 12 N -1.18 1.29 -4.42 3.15 -1.04 -1.26 -5.03 114.28 105.79 1fd6 n THR 12 Ca 0.15 -0.70 -0.22 0.00 -2.04 0.00 0.00 64.05 61.24 1fd6 n THR 12 Cb 0.16 -0.77 -0.09 0.00 -1.82 0.00 0.00 70.33 67.82 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 -5.67 1.86 -0.27 -4.42 1.43 -1.21 -5.16 118.68 105.24 1fd6 s LEU 13 Ca -0.16 -1.58 -0.19 0.00 -1.03 0.00 0.00 54.13 51.17 1fd6 s LEU 13 Cb 0.06 0.02 0.08 0.00 0.03 0.00 0.00 46.19 46.37 1fd6 s LEU 13 CO 0.69 -0.87 0.69 -0.54 0.23 0.00 0.00 176.35 176.55 1fd6 s LYS 14 N -3.78 0.74 0.00 1.70 1.02 -1.25 -3.71 119.74 114.47 1fd6 s LYS 14 Ca 0.31 1.13 0.00 0.00 0.02 0.00 0.00 55.97 57.44 1fd6 s LYS 14 Cb 0.04 0.23 0.00 0.00 -0.52 0.00 0.00 37.83 37.58 1fd6 s LYS 14 CO 0.16 -0.13 0.00 0.41 -0.92 0.00 0.00 175.35 174.87 1fd6 n GLY 15 N 3.76 0.45 3.34 -3.33 0.00 -1.23 -4.95 105.19 103.24 1fd6 n GLY 15 Ca -0.18 -1.66 -0.19 0.00 0.00 0.00 0.00 46.02 43.98 1fd6 n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fd6 s GLU 16 N -1.25 1.65 -0.15 1.61 2.02 -1.26 -0.45 118.70 120.87 1fd6 s GLU 16 Ca 0.00 -1.95 -0.11 0.00 0.02 0.00 0.00 54.97 52.93 1fd6 s GLU 16 Cb 0.00 -0.07 0.05 0.00 0.10 0.00 0.00 34.13 34.20 1fd6 s GLU 16 CO 0.00 -0.49 0.38 0.99 0.02 0.00 0.00 175.26 176.17 1fd6 s THR 17 N -3.55 -0.02 0.29 3.63 2.01 -0.25 -4.91 115.64 112.84 1fd6 s THR 17 Ca 0.35 0.06 0.10 0.00 0.31 0.00 0.00 61.69 62.51 1fd6 s THR 17 Cb 0.04 -0.56 -0.05 0.00 0.01 0.00 0.00 72.50 71.94 1fd6 s THR 17 CO 0.19 0.02 -0.15 0.42 -0.69 0.00 0.00 174.62 174.41 1fd6 s THR 18 N 0.86 2.22 0.25 -0.82 -4.23 -1.26 -1.03 115.64 111.63 1fd6 s THR 18 Ca -0.05 -2.30 -0.19 0.00 -1.18 0.00 0.00 61.69 57.97 1fd6 s THR 18 Cb -0.06 -2.37 0.07 0.00 1.34 0.00 0.00 72.50 71.48 1fd6 s THR 18 CO -0.07 -0.37 0.92 1.07 -0.54 0.00 0.00 174.62 175.64 1fd6 n THR 19 N -0.63 0.00 -3.84 3.99 5.66 -1.26 -5.03 114.28 113.18 1fd6 n THR 19 Ca -0.05 -0.68 -0.36 0.00 -3.05 0.00 0.00 64.05 59.91 1fd6 n THR 19 Cb 0.61 0.82 -0.13 0.00 -1.55 0.00 0.00 70.33 70.08 1fd6 n THR 19 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1fd6 s GLU 20 N -2.06 3.46 -0.10 1.09 8.01 -1.26 -4.15 118.70 123.69 1fd6 s GLU 20 Ca 0.20 -0.59 -0.09 0.00 0.01 0.00 0.00 54.97 54.51 1fd6 s GLU 20 Cb -0.03 -3.16 0.03 0.00 -4.31 0.00 0.00 34.13 26.65 1fd6 s GLU 20 CO 0.07 -0.21 0.26 0.00 0.01 0.00 0.00 175.26 175.39 1fd6 s ALA 21 N 1.53 -0.63 0.43 5.21 0.00 -1.16 -4.95 121.76 122.19 1fd6 s ALA 21 Ca 0.06 0.75 0.11 0.00 0.00 0.00 0.00 51.96 52.88 1fd6 s ALA 21 Cb -0.15 -0.44 0.97 0.00 0.00 0.00 0.00 23.12 23.50 1fd6 s ALA 21 CO -0.00 -0.13 2.02 -0.39 0.00 0.00 0.00 175.76 177.26 1fd6 h VAL 22 N 4.85 0.99 -1.90 0.00 -1.51 -1.91 0.83 116.25 117.59 1fd6 h VAL 22 Ca -0.27 -0.16 0.09 0.00 -1.23 0.00 0.00 66.70 65.13 1fd6 h VAL 22 Cb 1.19 0.49 -0.02 0.00 -2.13 0.00 0.00 31.29 30.82 1fd6 h VAL 22 CO 0.35 0.08 0.28 -0.90 -1.23 0.00 0.00 177.57 176.15 1fd6 n ASP 23 N -4.47 -0.69 0.16 4.19 5.68 -1.26 -3.83 116.55 116.32 1fd6 n ASP 23 Ca 0.07 -1.33 0.17 0.00 -0.50 0.00 0.00 54.79 53.20 1fd6 n ASP 23 Cb 0.23 1.11 0.77 0.00 -1.14 0.00 0.00 41.12 42.10 1fd6 n ASP 23 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fd6 h ALA 24 N 2.00 2.01 -0.02 2.12 0.00 -1.93 0.22 119.26 123.66 1fd6 h ALA 24 Ca -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1fd6 h ALA 24 Cb 0.51 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1fd6 h ALA 24 CO 0.15 -0.36 0.02 0.00 0.00 0.00 0.00 179.25 179.05 1fd6 h ALA 25 N 1.77 1.67 0.00 0.00 0.00 -1.98 -2.85 119.26 117.87 1fd6 h ALA 25 Ca 0.12 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1fd6 h ALA 25 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1fd6 h ALA 25 CO -0.00 -0.03 -1.64 2.41 0.00 0.00 0.00 179.25 179.99 1fd6 n THR 26 N -4.02 0.51 0.48 0.00 -1.04 -0.11 -4.30 114.28 105.81 1fd6 n THR 26 Ca -0.03 -0.38 -0.19 0.00 -2.04 0.00 0.00 64.05 61.41 1fd6 n THR 26 Cb 0.10 -0.47 -0.09 0.00 -1.82 0.00 0.00 70.33 68.05 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 0.63 -1.33 -0.62 2.41 0.00 -0.87 -1.84 119.26 117.63 1fd6 h ALA 27 Ca -0.20 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.44 1fd6 h ALA 27 Cb 1.33 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 19.60 1fd6 h ALA 27 CO 0.01 -1.24 0.41 1.49 0.00 0.00 0.00 179.25 179.92 1fd6 h GLU 28 N -1.25 0.82 -0.54 0.00 4.81 -1.78 0.76 114.58 117.39 1fd6 h GLU 28 Ca -0.12 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.10 1fd6 h GLU 28 Cb 0.96 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 30.12 1fd6 h GLU 28 CO 0.19 0.54 0.30 -0.22 -0.73 0.00 0.00 179.01 179.09 1fd6 h LYS 29 N 0.84 0.56 0.12 1.92 3.64 -1.70 0.87 116.57 122.82 1fd6 h LYS 29 Ca 0.23 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.38 1fd6 h LYS 29 Cb -0.09 -0.13 0.02 0.00 -0.41 0.00 0.00 32.23 31.63 1fd6 h LYS 29 CO -0.05 0.37 -0.84 0.28 -2.27 0.00 0.00 179.45 176.94 1fd6 h VAL 30 N 0.58 1.47 -0.24 2.00 2.07 -0.84 -3.12 116.25 118.18 1fd6 h VAL 30 Ca 0.23 -2.45 -0.09 0.00 0.82 0.00 0.00 66.70 65.21 1fd6 h VAL 30 Cb 0.10 3.04 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 1fd6 h VAL 30 CO -0.14 0.70 -0.23 -0.26 0.02 0.00 0.00 177.57 177.67 1fd6 h PHE 31 N -0.24 0.48 -0.72 1.57 0.04 -0.72 -2.49 116.94 114.85 1fd6 h PHE 31 Ca -0.14 -0.09 -0.06 0.00 2.80 0.00 0.00 57.97 60.48 1fd6 h PHE 31 Cb 1.63 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 39.63 1fd6 h PHE 31 CO 0.18 0.63 0.23 -0.22 -0.60 0.00 0.00 178.31 178.53 1fd6 h LYS 32 N 0.39 1.11 -0.31 1.51 1.63 0.68 -0.82 116.57 120.76 1fd6 h LYS 32 Ca 0.06 -0.24 -0.04 0.00 -0.85 0.00 0.00 60.65 59.59 1fd6 h LYS 32 Cb 0.61 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 32.06 1fd6 h LYS 32 CO 0.04 0.95 0.02 0.37 -3.45 0.00 0.00 179.45 177.38 1fd6 h GLN 33 N 1.05 0.47 0.63 1.90 5.75 -1.41 0.53 115.11 124.04 1fd6 h GLN 33 Ca 0.23 -0.09 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1fd6 h GLN 33 Cb 0.30 -0.07 0.01 0.00 1.07 0.00 0.00 27.48 28.78 1fd6 h GLN 33 CO -0.01 0.48 -0.30 -0.92 -2.65 0.00 0.00 178.83 175.43 1fd6 h TYR 34 N 0.46 -0.79 -0.33 3.99 3.20 -0.93 -2.12 116.97 120.45 1fd6 h TYR 34 Ca 0.10 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.96 1fd6 h TYR 34 Cb 0.27 0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 1fd6 h TYR 34 CO 0.01 -0.47 0.21 0.00 -1.64 0.00 0.00 178.16 176.28 1fd6 h ALA 35 N -1.12 0.42 -0.32 1.82 0.00 -1.00 -1.85 119.26 117.21 1fd6 h ALA 35 Ca -0.09 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.90 1fd6 h ALA 35 Cb 0.67 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1fd6 h ALA 35 CO 0.14 -0.13 0.27 -0.97 0.00 0.00 0.00 179.25 178.57 1fd6 h ASN 36 N 0.44 0.00 0.18 0.00 -0.73 0.03 0.46 115.58 115.96 1fd6 h ASN 36 Ca 0.12 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.28 1fd6 h ASN 36 Cb -0.04 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.55 1fd6 h ASN 36 CO -0.03 0.00 -0.09 -0.78 -0.37 0.00 0.00 177.43 176.16 1fd6 h ASP 37 N 0.00 -0.21 0.07 1.15 3.58 -0.61 -3.31 116.42 117.09 1fd6 h ASP 37 Ca 0.15 -0.21 -0.15 0.00 0.42 0.00 0.00 57.03 57.24 1fd6 h ASP 37 Cb 0.70 0.05 0.02 0.00 1.72 0.00 0.00 39.33 41.82 1fd6 h ASP 37 CO -0.00 0.11 -0.64 0.78 -2.88 0.00 0.00 179.24 176.60 1fd6 h ASN 38 N -0.54 0.44 0.00 2.28 2.35 -1.36 -3.49 115.58 115.26 1fd6 h ASN 38 Ca -0.03 -0.87 0.00 0.00 -0.55 0.00 0.00 56.30 54.85 1fd6 h ASN 38 Cb 0.41 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1fd6 h ASN 38 CO 0.04 1.27 0.00 0.61 -1.65 0.00 0.00 177.43 177.70 1fd6 n GLY 39 N 1.39 0.60 2.75 2.83 0.00 0.15 -5.05 105.19 107.87 1fd6 n GLY 39 Ca -0.12 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 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 5.42 -1.55 -0.61 5.41 -0.72 -4.86 119.36 122.46 1fd6 n ILE 40 Ca 0.00 -5.90 -0.33 0.00 1.00 0.00 0.00 62.75 57.52 1fd6 n ILE 40 Cb 0.00 -1.69 -0.05 0.00 -0.71 0.00 0.00 39.64 37.19 1fd6 n ILE 40 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1fd6 n ASP 41 N 0.31 7.48 0.00 4.38 8.00 -1.26 -4.81 116.55 130.64 1fd6 n ASP 41 Ca 0.39 -2.89 0.00 0.00 0.71 0.00 0.00 54.79 53.00 1fd6 n ASP 41 Cb 0.30 -1.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.00 1fd6 n ASP 41 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fd6 n GLY 42 N 2.17 1.03 3.09 0.44 0.00 -1.26 -4.87 105.19 105.79 1fd6 n GLY 42 Ca 0.61 -1.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 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 1.08 1.85 0.35 1.61 2.02 -1.19 -4.75 118.70 119.67 1fd6 s GLU 43 Ca 0.00 -1.78 -0.27 0.00 0.02 0.00 0.00 54.97 52.94 1fd6 s GLU 43 Cb 0.00 -3.39 -0.09 0.00 0.10 0.00 0.00 34.13 30.75 1fd6 s GLU 43 CO 0.00 -0.97 1.15 -1.58 0.02 0.00 0.00 175.26 173.88 1fd6 s TRP 44 N 1.06 3.25 -0.16 1.61 0.52 -1.26 -4.08 118.94 119.88 1fd6 s TRP 44 Ca 0.08 1.59 -0.10 0.00 0.02 0.00 0.00 56.10 57.69 1fd6 s TRP 44 Cb -0.21 -3.37 0.05 0.00 -1.15 0.00 0.00 33.47 28.80 1fd6 s TRP 44 CO -0.05 -1.07 0.40 0.95 0.02 0.00 0.00 176.95 177.20 1fd6 s THR 45 N -1.33 -0.02 -0.11 2.01 -4.23 -0.67 -4.92 115.64 106.37 1fd6 s THR 45 Ca 0.52 0.08 -0.05 0.00 -1.18 0.00 0.00 61.69 61.06 1fd6 s THR 45 Cb -0.31 -0.59 -0.04 0.00 1.34 0.00 0.00 72.50 72.90 1fd6 s THR 45 CO 0.40 0.03 0.08 -0.47 -0.54 0.00 0.00 174.62 174.12 1fd6 s TYR 46 N 1.14 3.39 -0.39 3.99 6.14 -1.26 0.21 117.35 130.56 1fd6 s TYR 46 Ca -0.07 0.36 -0.06 0.00 0.64 0.00 0.00 57.07 57.94 1fd6 s TYR 46 Cb -0.07 -1.88 0.08 0.00 0.42 0.00 0.00 41.96 40.50 1fd6 s TYR 46 CO -0.10 0.59 0.18 -0.51 0.64 0.00 0.00 175.55 176.36 1fd6 s ASP 47 N -0.88 5.37 0.62 4.32 1.01 -1.22 -4.93 116.67 120.96 1fd6 s ASP 47 Ca 0.14 -1.59 0.39 0.00 0.71 0.00 0.00 52.55 52.20 1fd6 s ASP 47 Cb -0.12 -1.88 2.02 0.00 1.01 0.00 0.00 42.92 43.95 1fd6 s ASP 47 CO 0.03 -0.47 2.24 -2.24 0.21 0.00 0.00 175.17 174.93 1fd6 h ASP 48 N 8.21 0.00 -1.00 0.27 3.04 -1.96 0.55 116.42 125.53 1fd6 h ASP 48 Ca -0.20 0.00 0.13 0.00 -3.24 0.00 0.00 57.03 53.72 1fd6 h ASP 48 Cb 1.07 0.00 -0.09 0.00 -1.04 0.00 0.00 39.33 39.27 1fd6 h ASP 48 CO 0.69 0.01 0.63 0.00 -2.04 0.00 0.00 179.24 178.53 1fd6 h ALA 49 N 1.99 1.53 0.00 4.15 0.00 -2.01 -3.31 119.26 121.61 1fd6 h ALA 49 Ca -0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1fd6 h ALA 49 Cb 0.17 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 1fd6 h ALA 49 CO 0.00 0.20 -0.38 0.25 0.00 0.00 0.00 179.25 179.32 1fd6 n THR 50 N -4.64 0.00 -2.90 0.00 -2.24 -1.06 -5.08 114.28 98.36 1fd6 n THR 50 Ca 0.19 -0.11 -0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1fd6 n THR 50 Cb 0.38 0.39 -0.00 0.00 -2.10 0.00 0.00 70.33 68.99 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 0.05 -2.30 -3.34 -0.78 4.01 0.19 -4.81 118.16 111.18 1fd6 n LYS 51 Ca -0.01 2.03 -0.12 0.00 -0.51 0.00 0.00 58.31 59.70 1fd6 n LYS 51 Cb 0.68 -3.51 -0.07 0.00 -0.51 0.00 0.00 35.03 31.62 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 -1.24 -0.53 0.15 -0.18 2.01 -1.19 -2.67 115.64 111.99 1fd6 s THR 52 Ca -0.02 -0.44 -0.31 0.00 0.31 0.00 0.00 61.69 61.22 1fd6 s THR 52 Cb 0.00 -0.92 -0.11 0.00 0.01 0.00 0.00 72.50 71.48 1fd6 s THR 52 CO 0.46 -0.38 1.71 -0.36 -0.69 0.00 0.00 174.62 175.37 1fd6 s PHE 53 N 2.33 2.63 -0.26 4.92 0.08 0.30 -3.38 117.98 124.59 1fd6 s PHE 53 Ca 0.11 0.29 0.02 0.00 0.12 0.00 0.00 56.93 57.46 1fd6 s PHE 53 Cb -0.13 -4.08 0.07 0.00 -0.57 0.00 0.00 43.02 38.31 1fd6 s PHE 53 CO -0.27 -4.23 -0.04 0.99 -0.10 0.00 0.00 175.22 171.56 1fd6 s THR 54 N 1.87 1.78 0.37 0.64 2.01 0.13 0.25 115.64 122.69 1fd6 s THR 54 Ca 0.76 -1.53 0.08 0.00 0.31 0.00 0.00 61.69 61.30 1fd6 s THR 54 Cb -0.46 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 69.96 1fd6 s THR 54 CO 0.33 -0.21 0.29 0.54 -0.69 0.00 0.00 174.62 174.89 1fd6 s VAL 55 N 1.25 3.01 -0.30 3.82 0.11 -1.26 -1.66 120.40 125.36 1fd6 s VAL 55 Ca -0.03 -1.44 -0.03 0.00 -2.93 0.00 0.00 61.98 57.56 1fd6 s VAL 55 Cb -0.19 -3.06 0.18 0.00 -1.53 0.00 0.00 36.38 31.78 1fd6 s VAL 55 CO -0.08 -0.09 0.63 -0.89 -3.33 0.00 0.00 175.10 171.34 1fd6 s THR 56 N -2.41 -0.97 -2.39 5.04 2.01 -1.26 -3.23 115.64 112.43 1fd6 s THR 56 Ca 0.43 0.00 0.29 0.00 0.31 0.00 0.00 61.69 62.72 1fd6 s THR 56 Cb -0.03 -1.00 0.63 0.00 0.01 0.00 0.00 72.50 72.10 1fd6 s THR 56 CO 0.26 0.00 1.85 1.21 -0.69 0.00 0.00 174.62 177.25