#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pgb s THR 2 N 0.00 5.25 0.13 1.12 2.01 -1.26 -1.22 115.64 121.67 1pgb s THR 2 Ca 0.00 0.74 0.10 0.00 0.31 0.00 0.00 61.69 62.84 1pgb s THR 2 Cb 0.00 -3.72 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 1pgb s THR 2 CO 0.00 0.36 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.74 1pgb s TYR 3 N 0.52 2.38 0.19 4.92 2.02 -0.52 -4.92 117.35 121.94 1pgb s TYR 3 Ca 0.21 -0.34 0.11 0.00 -0.37 0.00 0.00 57.07 56.68 1pgb s TYR 3 Cb -0.14 -1.27 -0.04 0.00 -0.40 0.00 0.00 41.96 40.11 1pgb s TYR 3 CO 0.07 0.36 -0.22 0.21 -1.57 0.00 0.00 175.55 174.40 1pgb s LYS 4 N -2.13 1.60 -0.08 -0.62 2.20 -0.68 -1.33 119.74 118.70 1pgb s LYS 4 Ca 0.16 -1.48 0.01 0.00 -0.36 0.00 0.00 55.97 54.30 1pgb s LYS 4 Cb -0.10 -1.90 0.02 0.00 -1.51 0.00 0.00 37.83 34.34 1pgb s LYS 4 CO 0.07 0.41 -0.09 -1.17 -0.36 0.00 0.00 175.35 174.21 1pgb s LEU 5 N -2.67 1.41 -0.25 5.43 2.96 0.08 -0.18 118.68 125.47 1pgb s LEU 5 Ca 0.21 -0.26 -0.09 0.00 -0.22 0.00 0.00 54.13 53.77 1pgb s LEU 5 Cb -0.08 -0.75 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 1pgb s LEU 5 CO 0.10 -0.04 0.12 -0.63 -1.32 0.00 0.00 176.35 174.59 1pgb s ILE 6 N 1.07 4.86 -0.25 6.68 1.01 -0.29 -1.75 121.20 132.53 1pgb s ILE 6 Ca -0.07 0.01 -0.09 0.00 0.00 0.00 0.00 60.65 60.50 1pgb s ILE 6 Cb -0.14 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 1pgb s ILE 6 CO -0.01 0.33 0.12 -0.76 0.00 0.00 0.00 174.94 174.62 1pgb s LEU 7 N 1.40 3.77 -0.47 2.97 1.43 -0.07 -1.81 118.68 125.89 1pgb s LEU 7 Ca 0.06 -0.05 0.08 0.00 -1.03 0.00 0.00 54.13 53.19 1pgb s LEU 7 Cb -0.15 -2.02 0.33 0.00 0.03 0.00 0.00 46.19 44.39 1pgb s LEU 7 CO 0.06 0.01 0.81 -3.20 0.23 0.00 0.00 176.35 174.26 1pgb n ASN 8 N 4.64 2.49 -4.24 2.29 5.15 -0.14 -2.30 115.26 123.16 1pgb n ASN 8 Ca -0.15 -3.30 -0.27 0.00 -0.60 0.00 0.00 54.58 50.26 1pgb n ASN 8 Cb 0.52 -0.60 0.17 0.00 -0.53 0.00 0.00 39.78 39.34 1pgb n ASN 8 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1pgb s GLY 9 N -2.79 1.79 0.16 8.20 0.00 -0.48 -1.28 107.32 112.92 1pgb s GLY 9 Ca 0.43 -1.57 -0.05 0.00 0.00 0.00 0.00 44.72 43.53 1pgb s GLY 9 CO -0.10 -0.83 1.41 0.50 0.00 0.00 0.00 173.10 174.08 1pgb h LYS 10 N -1.27 0.55 0.00 2.90 1.57 -1.98 -3.39 116.57 114.94 1pgb h LYS 10 Ca -0.40 -0.42 -0.22 0.00 -1.87 0.00 0.00 60.65 57.73 1pgb h LYS 10 Cb 1.23 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.58 1pgb h LYS 10 CO 0.34 1.05 -1.85 2.41 -0.57 0.00 0.00 179.45 180.82 1pgb n THR 11 N -3.89 0.86 -4.29 -0.16 -1.04 -1.26 -4.98 114.28 99.51 1pgb n THR 11 Ca -0.05 -0.37 -0.34 0.00 -2.04 0.00 0.00 64.05 61.25 1pgb n THR 11 Cb 0.70 -0.96 -0.13 0.00 -1.82 0.00 0.00 70.33 68.12 1pgb n THR 11 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1pgb s LEU 12 N -5.67 3.19 0.04 -4.42 0.20 -1.26 -5.11 118.68 105.64 1pgb s LEU 12 Ca -0.17 -0.18 0.04 0.00 0.69 0.00 0.00 54.13 54.50 1pgb s LEU 12 Cb 0.05 -1.78 -0.02 0.00 -0.43 0.00 0.00 46.19 44.01 1pgb s LEU 12 CO 0.38 0.12 -0.11 -0.54 -0.29 0.00 0.00 176.35 175.91 1pgb s LYS 13 N 0.63 0.76 0.00 1.98 1.02 -1.26 -1.38 119.74 121.49 1pgb s LYS 13 Ca -0.02 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.27 1pgb s LYS 13 Cb -0.14 -0.70 0.00 0.00 -0.52 0.00 0.00 37.83 36.46 1pgb s LYS 13 CO 0.02 0.17 0.00 0.41 -0.92 0.00 0.00 175.35 175.03 1pgb n GLY 14 N 1.88 0.70 3.02 -3.33 0.00 -0.97 -4.96 105.19 101.52 1pgb n GLY 14 Ca -0.19 -1.70 -0.12 0.00 0.00 0.00 0.00 46.02 44.02 1pgb n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pgb s GLU 15 N -2.00 0.23 0.10 1.61 2.02 -1.26 -0.89 118.70 118.52 1pgb s GLU 15 Ca 0.00 -0.04 -0.01 0.00 0.02 0.00 0.00 54.97 54.93 1pgb s GLU 15 Cb 0.00 0.10 -0.04 0.00 0.10 0.00 0.00 34.13 34.29 1pgb s GLU 15 CO 0.00 -0.04 0.04 0.95 0.02 0.00 0.00 175.26 176.23 1pgb s THR 16 N -0.42 0.14 0.31 3.63 -4.23 -0.71 -4.99 115.64 109.36 1pgb s THR 16 Ca -0.05 -1.84 0.03 0.00 -1.18 0.00 0.00 61.69 58.64 1pgb s THR 16 Cb -0.03 -1.85 -0.05 0.00 1.34 0.00 0.00 72.50 71.91 1pgb s THR 16 CO 0.00 -0.63 0.10 0.42 -0.54 0.00 0.00 174.62 173.97 1pgb s THR 17 N -4.00 0.72 0.08 3.99 -4.23 -1.26 -0.74 115.64 110.20 1pgb s THR 17 Ca 0.18 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.45 1pgb s THR 17 Cb 0.07 -2.62 0.06 0.00 1.34 0.00 0.00 72.50 71.36 1pgb s THR 17 CO -0.02 0.00 0.59 0.28 -0.54 0.00 0.00 174.62 174.92 1pgb s THR 18 N -3.50 0.01 -0.15 3.99 -1.32 -0.44 -4.98 115.64 109.25 1pgb s THR 18 Ca 0.35 -0.10 -0.08 0.00 -1.21 0.00 0.00 61.69 60.65 1pgb s THR 18 Cb 0.07 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 70.01 1pgb s THR 18 CO 0.15 -0.06 0.13 -1.61 -2.21 0.00 0.00 174.62 171.03 1pgb s GLU 19 N -2.77 3.74 0.05 7.08 0.41 -1.26 -1.43 118.70 124.52 1pgb s GLU 19 Ca -0.04 -0.17 -0.17 0.00 -0.41 0.00 0.00 54.97 54.18 1pgb s GLU 19 Cb -0.01 -3.28 0.03 0.00 -1.78 0.00 0.00 34.13 29.10 1pgb s GLU 19 CO -0.04 0.58 0.39 0.00 -0.49 0.00 0.00 175.26 175.70 1pgb s ALA 20 N -0.46 -0.92 0.16 5.21 0.00 -0.36 -4.93 121.76 120.45 1pgb s ALA 20 Ca 0.12 0.19 -0.09 0.00 0.00 0.00 0.00 51.96 52.18 1pgb s ALA 20 Cb -0.12 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.40 1pgb s ALA 20 CO 0.02 -0.47 1.51 -0.39 0.00 0.00 0.00 175.76 176.42 1pgb h VAL 21 N 2.96 1.27 -4.11 0.00 -1.51 -1.97 -1.35 116.25 111.55 1pgb h VAL 21 Ca -0.32 -1.53 -0.31 0.00 -1.23 0.00 0.00 66.70 63.32 1pgb h VAL 21 Cb 1.21 1.35 -0.08 0.00 -2.13 0.00 0.00 31.29 31.64 1pgb h VAL 21 CO 0.45 0.51 -0.21 -0.90 -1.23 0.00 0.00 177.57 176.19 1pgb n ASP 22 N -4.06 -1.18 0.10 4.19 5.75 -1.26 -4.67 116.55 115.42 1pgb n ASP 22 Ca -0.02 -2.88 -0.02 0.00 -0.01 0.00 0.00 54.79 51.86 1pgb n ASP 22 Cb 0.53 2.27 0.22 0.00 -1.03 0.00 0.00 41.12 43.11 1pgb n ASP 22 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1pgb h ALA 23 N 2.01 1.10 0.00 2.12 0.00 -2.00 -2.51 119.26 119.98 1pgb h ALA 23 Ca -0.25 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.13 1pgb h ALA 23 Cb 1.15 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1pgb h ALA 23 CO 0.35 0.60 -0.52 0.00 0.00 0.00 0.00 179.25 179.68 1pgb h ALA 24 N 1.38 0.91 0.00 0.00 0.00 -1.99 -2.09 119.26 117.47 1pgb h ALA 24 Ca 0.01 -0.47 -0.26 0.00 0.00 0.00 0.00 54.91 54.19 1pgb h ALA 24 Cb 0.84 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.56 1pgb h ALA 24 CO 0.07 0.65 -1.01 1.15 0.00 0.00 0.00 179.25 180.11 1pgb h THR 25 N 0.00 1.29 -0.37 0.00 2.02 -1.93 -2.76 112.91 111.16 1pgb h THR 25 Ca -0.01 -2.23 -0.08 0.00 0.77 0.00 0.00 66.41 64.86 1pgb h THR 25 Cb 1.08 2.41 -0.02 0.00 -1.74 0.00 0.00 68.15 69.87 1pgb h THR 25 CO 0.07 0.69 -0.10 0.00 0.37 0.00 0.00 175.52 176.54 1pgb h ALA 26 N 0.39 1.12 -0.29 6.16 0.00 -1.31 -2.51 119.26 122.83 1pgb h ALA 26 Ca -0.13 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1pgb h ALA 26 Cb 1.67 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1pgb h ALA 26 CO 0.20 0.55 -0.05 1.49 0.00 0.00 0.00 179.25 181.43 1pgb h GLU 27 N 0.60 0.46 0.52 0.00 4.81 -1.41 -0.24 114.58 119.31 1pgb h GLU 27 Ca 0.11 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1pgb h GLU 27 Cb 0.53 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.85 1pgb h GLU 27 CO 0.03 0.53 -0.25 -0.22 -0.73 0.00 0.00 179.01 178.37 1pgb h LYS 28 N 0.44 -0.68 -0.38 1.92 3.64 -1.16 -0.54 116.57 119.80 1pgb h LYS 28 Ca 0.09 0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 1pgb h LYS 28 Cb 0.37 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 1pgb h LYS 28 CO 0.02 -0.38 -0.05 0.28 -2.27 0.00 0.00 179.45 177.05 1pgb h VAL 29 N -0.93 1.23 -0.53 2.00 2.07 -1.28 -2.55 116.25 116.25 1pgb h VAL 29 Ca -0.07 -0.97 -0.10 0.00 0.82 0.00 0.00 66.70 66.38 1pgb h VAL 29 Cb 0.62 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1pgb h VAL 29 CO 0.12 0.33 -0.04 -0.26 0.02 0.00 0.00 177.57 177.74 1pgb h PHE 30 N 0.59 1.07 -0.46 1.57 0.04 -0.94 -1.32 116.94 117.48 1pgb h PHE 30 Ca 0.12 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.68 1pgb h PHE 30 Cb 0.45 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.30 1pgb h PHE 30 CO 0.02 0.99 0.25 0.87 -0.60 0.00 0.00 178.31 179.84 1pgb h LYS 31 N 0.84 0.65 -0.70 1.51 1.79 -1.03 -0.12 116.57 119.50 1pgb h LYS 31 Ca 0.15 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.52 1pgb h LYS 31 Cb 0.59 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 31.08 1pgb h LYS 31 CO 0.04 0.51 0.35 1.96 -1.08 0.00 0.00 179.45 181.22 1pgb h GLN 32 N 0.61 0.99 -0.76 3.15 4.20 -1.32 -0.38 115.11 121.59 1pgb h GLN 32 Ca 0.16 -0.14 -0.06 0.00 0.06 0.00 0.00 58.65 58.68 1pgb h GLN 32 Cb 0.05 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 1pgb h GLN 32 CO -0.03 0.77 0.25 -0.92 -0.67 0.00 0.00 178.83 178.24 1pgb h TYR 33 N 0.97 1.22 -0.27 2.96 3.20 -0.89 0.26 116.97 124.41 1pgb h TYR 33 Ca 0.24 -0.12 -0.07 0.00 3.14 0.00 0.00 58.73 61.92 1pgb h TYR 33 Cb 0.10 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.00 1pgb h TYR 33 CO 0.00 0.95 -0.11 0.00 -1.64 0.00 0.00 178.16 177.36 1pgb h ALA 34 N 1.14 0.38 -0.07 1.82 0.00 -0.73 -2.63 119.26 119.16 1pgb h ALA 34 Ca 0.25 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1pgb h ALA 34 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1pgb h ALA 34 CO -0.01 0.23 -0.29 -0.97 0.00 0.00 0.00 179.25 178.21 1pgb h ASN 35 N 0.29 0.13 0.82 0.00 -1.24 -0.87 -0.75 115.58 113.97 1pgb h ASN 35 Ca 0.06 -0.04 -0.10 0.00 0.71 0.00 0.00 56.30 56.93 1pgb h ASN 35 Cb 0.61 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.61 1pgb h ASN 35 CO 0.04 0.43 -0.48 0.44 -1.29 0.00 0.00 177.43 176.57 1pgb h ASP 36 N 0.12 0.00 -0.56 1.15 3.32 -0.78 -2.81 116.42 116.86 1pgb h ASP 36 Ca 0.02 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1pgb h ASP 36 Cb 0.59 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1pgb h ASP 36 CO 0.04 0.48 0.02 0.59 -1.72 0.00 0.00 179.24 178.65 1pgb n ASN 37 N -3.59 5.45 -0.81 6.45 3.02 -0.82 -4.97 115.26 119.99 1pgb n ASN 37 Ca -0.00 -2.91 -0.11 0.00 -0.03 0.00 0.00 54.58 51.53 1pgb n ASN 37 Cb 0.57 -0.68 -0.05 0.00 -0.61 0.00 0.00 39.78 39.01 1pgb n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pgb n GLY 38 N 0.53 1.04 3.74 7.41 0.00 -0.94 -4.94 105.19 112.03 1pgb n GLY 38 Ca 0.28 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1pgb n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pgb s VAL 39 N -1.99 4.75 -0.33 1.61 1.01 -0.35 -4.98 120.40 120.12 1pgb s VAL 39 Ca 0.00 1.69 -0.01 0.00 0.00 0.00 0.00 61.98 63.66 1pgb s VAL 39 Cb 0.00 -4.15 0.13 0.00 0.00 0.00 0.00 36.38 32.36 1pgb s VAL 39 CO 0.00 0.33 0.22 -0.62 0.00 0.00 0.00 175.10 175.03 1pgb s ASP 40 N 0.14 2.70 0.00 3.32 2.15 -1.26 -4.08 116.67 119.64 1pgb s ASP 40 Ca 0.40 -1.67 0.00 0.00 0.43 0.00 0.00 52.55 51.71 1pgb s ASP 40 Cb -0.21 -0.13 0.00 0.00 -0.30 0.00 0.00 42.92 42.29 1pgb s ASP 40 CO 0.24 -0.35 0.00 0.61 -0.17 0.00 0.00 175.17 175.50 1pgb n GLY 41 N 4.56 5.18 3.86 2.66 0.00 -1.26 -4.69 105.19 115.50 1pgb n GLY 41 Ca 0.05 -1.33 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 1pgb n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pgb s GLU 42 N 1.25 3.83 0.02 1.61 0.41 -0.54 -4.81 118.70 120.47 1pgb s GLU 42 Ca 0.00 0.28 0.08 0.00 -0.41 0.00 0.00 54.97 54.92 1pgb s GLU 42 Cb 0.00 -2.91 -0.03 0.00 -1.78 0.00 0.00 34.13 29.41 1pgb s GLU 42 CO 0.00 0.49 -0.24 -1.58 -0.49 0.00 0.00 175.26 173.44 1pgb s TRP 43 N -1.50 2.38 0.08 1.61 0.52 -1.26 -1.27 118.94 119.51 1pgb s TRP 43 Ca 0.37 -0.38 0.03 0.00 0.02 0.00 0.00 56.10 56.14 1pgb s TRP 43 Cb -0.14 -1.45 -0.03 0.00 -1.15 0.00 0.00 33.47 30.70 1pgb s TRP 43 CO 0.19 0.10 -0.09 0.95 0.02 0.00 0.00 176.95 178.12 1pgb s THR 44 N -0.76 0.80 -0.03 2.01 -4.23 -0.41 -4.96 115.64 108.06 1pgb s THR 44 Ca 0.12 -1.56 -0.00 0.00 -1.18 0.00 0.00 61.69 59.06 1pgb s THR 44 Cb -0.10 -1.24 0.03 0.00 1.34 0.00 0.00 72.50 72.52 1pgb s THR 44 CO 0.01 -0.58 0.02 -0.47 -0.54 0.00 0.00 174.62 173.07 1pgb s TYR 45 N -2.41 0.20 -0.27 3.99 5.04 -1.26 -0.85 117.35 121.78 1pgb s TYR 45 Ca 0.03 0.07 0.02 0.00 -2.44 0.00 0.00 57.07 54.75 1pgb s TYR 45 Cb -0.03 -0.38 0.06 0.00 0.35 0.00 0.00 41.96 41.96 1pgb s TYR 45 CO -0.01 -0.14 -0.08 0.34 -1.34 0.00 0.00 175.55 174.33 1pgb s ASP 46 N 1.26 4.59 0.06 4.32 -1.08 -0.57 -5.01 116.67 120.24 1pgb s ASP 46 Ca -0.07 -1.36 0.23 0.00 -0.52 0.00 0.00 52.55 50.83 1pgb s ASP 46 Cb -0.13 -1.60 0.92 0.00 -1.46 0.00 0.00 42.92 40.65 1pgb s ASP 46 CO -0.03 -0.21 1.71 -0.67 0.52 0.00 0.00 175.17 176.50 1pgb n ASP 47 N 4.49 0.20 0.14 -0.34 2.03 -1.26 -0.41 116.55 121.40 1pgb n ASP 47 Ca -0.14 0.53 0.12 0.00 0.52 0.00 0.00 54.79 55.83 1pgb n ASP 47 Cb 0.42 -0.58 0.27 0.00 -0.72 0.00 0.00 41.12 40.51 1pgb n ASP 47 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1pgb h ALA 48 N 2.66 0.92 0.00 -1.67 0.00 -1.96 -3.34 119.26 115.86 1pgb h ALA 48 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pgb h ALA 48 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1pgb h ALA 48 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.50 1pgb n THR 49 N -2.58 0.00 -3.66 0.00 -2.24 -1.05 -5.01 114.28 99.75 1pgb n THR 49 Ca 0.04 -0.19 -0.24 0.00 -2.27 0.00 0.00 64.05 61.39 1pgb n THR 49 Cb 0.48 1.55 0.06 0.00 -2.10 0.00 0.00 70.33 70.32 1pgb n THR 49 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1pgb n LYS 50 N -0.04 -6.90 -5.16 -0.78 4.01 0.45 -4.82 118.16 104.91 1pgb n LYS 50 Ca 0.00 0.76 -0.31 0.00 -0.51 0.00 0.00 58.31 58.25 1pgb n LYS 50 Cb 0.14 -5.73 -0.17 0.00 -0.51 0.00 0.00 35.03 28.76 1pgb n LYS 50 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1pgb s THR 51 N -3.35 1.96 0.09 -0.18 2.01 -0.96 -1.69 115.64 113.52 1pgb s THR 51 Ca 0.46 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 61.50 1pgb s THR 51 Cb -0.21 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 1pgb s THR 51 CO 0.76 0.54 0.20 -0.36 -0.69 0.00 0.00 174.62 175.08 1pgb s PHE 52 N 0.29 3.44 0.01 4.92 0.40 0.75 -1.51 117.98 126.28 1pgb s PHE 52 Ca -0.16 0.18 0.01 0.00 -0.60 0.00 0.00 56.93 56.35 1pgb s PHE 52 Cb -0.17 -1.70 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 1pgb s PHE 52 CO 0.08 0.56 -0.03 0.95 0.70 0.00 0.00 175.22 177.48 1pgb s THR 53 N -1.56 0.21 -0.10 0.64 -4.23 -0.03 -1.14 115.64 109.43 1pgb s THR 53 Ca 0.34 -0.39 0.02 0.00 -1.18 0.00 0.00 61.69 60.48 1pgb s THR 53 Cb -0.12 -0.23 0.01 0.00 1.34 0.00 0.00 72.50 73.50 1pgb s THR 53 CO 0.27 -0.12 -0.15 0.54 -0.54 0.00 0.00 174.62 174.62 1pgb s VAL 54 N -0.52 1.46 -0.12 2.29 0.11 -0.75 -1.29 120.40 121.58 1pgb s VAL 54 Ca -0.04 -0.63 0.02 0.00 -2.93 0.00 0.00 61.98 58.40 1pgb s VAL 54 Cb -0.04 -1.32 0.01 0.00 -1.53 0.00 0.00 36.38 33.50 1pgb s VAL 54 CO -0.00 0.43 -0.18 -0.89 -3.33 0.00 0.00 175.10 171.13 1pgb s THR 55 N 0.88 1.71 -2.75 5.04 2.01 -0.40 -0.96 115.64 121.17 1pgb s THR 55 Ca -0.09 -0.77 0.26 0.00 0.31 0.00 0.00 61.69 61.40 1pgb s THR 55 Cb -0.15 -1.54 0.37 0.00 0.01 0.00 0.00 72.50 71.19 1pgb s THR 55 CO 0.00 0.48 1.50 -0.62 -0.69 0.00 0.00 174.62 175.30