#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gb1 s THR 2 N 0.00 5.09 -0.01 1.12 2.01 -1.26 -2.78 115.64 119.81 3gb1 s THR 2 Ca 0.00 0.97 0.08 0.00 0.31 0.00 0.00 61.69 63.05 3gb1 s THR 2 Cb 0.00 -3.81 -0.02 0.00 0.01 0.00 0.00 72.50 68.68 3gb1 s THR 2 CO 0.00 0.41 -0.25 -0.31 -0.69 0.00 0.00 174.62 173.78 3gb1 s TYR 3 N 0.03 2.35 0.00 4.92 1.51 -0.96 -4.91 117.35 120.29 3gb1 s TYR 3 Ca 0.26 -0.42 0.05 0.00 -1.01 0.00 0.00 57.07 55.95 3gb1 s TYR 3 Cb -0.16 -1.48 -0.03 0.00 -0.11 0.00 0.00 41.96 40.18 3gb1 s TYR 3 CO 0.12 0.01 -0.13 0.21 -1.11 0.00 0.00 175.55 174.65 3gb1 s LYS 4 N -0.76 2.36 -0.11 -0.62 2.20 -1.14 -2.24 119.74 119.42 3gb1 s LYS 4 Ca 0.11 -0.81 0.03 0.00 -0.36 0.00 0.00 55.97 54.94 3gb1 s LYS 4 Cb -0.10 -2.35 -0.00 0.00 -1.51 0.00 0.00 37.83 33.87 3gb1 s LYS 4 CO -0.00 0.59 -0.22 -1.17 -0.36 0.00 0.00 175.35 174.18 3gb1 s LEU 5 N -1.23 2.18 -0.21 5.43 2.96 -0.58 -0.83 118.68 126.40 3gb1 s LEU 5 Ca 0.15 -0.53 -0.06 0.00 -0.22 0.00 0.00 54.13 53.46 3gb1 s LEU 5 Cb -0.11 -1.44 -0.03 0.00 0.50 0.00 0.00 46.19 45.11 3gb1 s LEU 5 CO 0.05 0.15 0.04 -0.63 -1.32 0.00 0.00 176.35 174.64 3gb1 s ILE 6 N 0.40 4.31 -0.32 6.68 1.01 -0.95 -2.16 121.20 130.17 3gb1 s ILE 6 Ca -0.16 -0.19 -0.11 0.00 0.00 0.00 0.00 60.65 60.19 3gb1 s ILE 6 Cb -0.17 -2.97 -0.02 0.00 0.01 0.00 0.00 42.46 39.31 3gb1 s ILE 6 CO 0.07 0.40 0.19 -0.76 0.00 0.00 0.00 174.94 174.84 3gb1 s LEU 7 N 1.06 4.25 -0.73 2.97 1.43 0.25 -3.05 118.68 124.86 3gb1 s LEU 7 Ca 0.03 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 52.75 3gb1 s LEU 7 Cb -0.14 -2.07 0.29 0.00 0.03 0.00 0.00 46.19 44.29 3gb1 s LEU 7 CO 0.03 -0.19 0.99 0.59 0.23 0.00 0.00 176.35 178.00 3gb1 n ASN 8 N 5.04 4.64 -4.63 2.29 3.02 -1.12 -2.54 115.26 121.96 3gb1 n ASN 8 Ca -0.13 -3.52 -0.28 0.00 -0.03 0.00 0.00 54.58 50.62 3gb1 n ASN 8 Cb 0.50 -0.78 0.12 0.00 -0.61 0.00 0.00 39.78 39.01 3gb1 n ASN 8 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3gb1 s GLY 9 N -2.52 1.68 0.16 7.41 0.00 0.12 -2.75 107.32 111.42 3gb1 s GLY 9 Ca 0.40 -0.94 -0.10 0.00 0.00 0.00 0.00 44.72 44.08 3gb1 s GLY 9 CO -0.03 -0.36 1.55 0.50 0.00 0.00 0.00 173.10 174.76 3gb1 h LYS 10 N -1.15 1.01 0.00 2.90 1.57 -1.97 -3.36 116.57 115.57 3gb1 h LYS 10 Ca -0.45 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 57.91 3gb1 h LYS 10 Cb 1.29 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.56 3gb1 h LYS 10 CO 0.54 1.11 -0.86 2.41 -0.57 0.00 0.00 179.45 182.08 3gb1 n THR 11 N -4.12 0.00 -3.52 -0.16 -1.04 -1.26 -4.99 114.28 99.20 3gb1 n THR 11 Ca 0.00 -0.03 -0.39 0.00 -2.04 0.00 0.00 64.05 61.60 3gb1 n THR 11 Cb 0.45 0.50 -0.10 0.00 -1.82 0.00 0.00 70.33 69.35 3gb1 n THR 11 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 3gb1 s LEU 12 N -2.69 4.07 -0.04 -4.42 2.96 -1.26 -5.06 118.68 112.24 3gb1 s LEU 12 Ca 0.00 0.05 0.01 0.00 -0.22 0.00 0.00 54.13 53.96 3gb1 s LEU 12 Cb 0.00 -2.22 0.02 0.00 0.50 0.00 0.00 46.19 44.49 3gb1 s LEU 12 CO 0.00 -0.11 -0.02 -0.54 -1.32 0.00 0.00 176.35 174.36 3gb1 s LYS 13 N 1.86 0.51 0.00 1.98 1.02 -1.26 0.13 119.74 123.98 3gb1 s LYS 13 Ca 0.10 0.01 0.00 0.00 0.02 0.00 0.00 55.97 56.10 3gb1 s LYS 13 Cb -0.16 -0.64 0.00 0.00 -0.52 0.00 0.00 37.83 36.51 3gb1 s LYS 13 CO 0.11 -0.13 0.00 0.41 -0.92 0.00 0.00 175.35 174.82 3gb1 n GLY 14 N 4.17 -1.32 3.22 -3.33 0.00 -1.05 -5.01 105.19 101.87 3gb1 n GLY 14 Ca -0.25 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.73 3gb1 n GLY 14 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3gb1 s GLU 15 N -0.73 0.81 0.27 1.61 1.03 -1.26 -0.59 118.70 119.85 3gb1 s GLU 15 Ca 0.00 -0.73 -0.13 0.00 0.03 0.00 0.00 54.97 54.14 3gb1 s GLU 15 Cb 0.00 0.34 0.00 0.00 -0.80 0.00 0.00 34.13 33.67 3gb1 s GLU 15 CO 0.00 -0.26 0.53 -0.08 -1.33 0.00 0.00 175.26 174.13 3gb1 s THR 16 N -3.17 0.00 0.07 1.83 -1.32 -0.92 -5.00 115.64 107.14 3gb1 s THR 16 Ca -0.01 -1.34 0.00 0.00 -1.21 0.00 0.00 61.69 59.14 3gb1 s THR 16 Cb 0.02 -2.27 -0.04 0.00 -1.51 0.00 0.00 72.50 68.69 3gb1 s THR 16 CO -0.07 0.00 -0.05 0.42 -2.21 0.00 0.00 174.62 172.71 3gb1 s THR 17 N -3.77 0.47 0.15 5.08 -4.23 -1.26 -1.52 115.64 110.56 3gb1 s THR 17 Ca 0.21 -1.87 -0.19 0.00 -1.18 0.00 0.00 61.69 58.65 3gb1 s THR 17 Cb -0.02 -1.60 0.05 0.00 1.34 0.00 0.00 72.50 72.27 3gb1 s THR 17 CO 0.10 -0.93 0.51 0.28 -0.54 0.00 0.00 174.62 174.04 3gb1 s THR 18 N -3.76 0.03 -0.12 3.99 -1.32 -0.95 -5.02 115.64 108.49 3gb1 s THR 18 Ca 0.09 -0.35 -0.04 0.00 -1.21 0.00 0.00 61.69 60.18 3gb1 s THR 18 Cb 0.07 -1.16 -0.04 0.00 -1.51 0.00 0.00 72.50 69.86 3gb1 s THR 18 CO -0.07 -0.14 0.04 -1.61 -2.21 0.00 0.00 174.62 170.63 3gb1 s GLU 19 N -3.79 3.36 -0.08 7.08 0.41 -1.26 -2.27 118.70 122.14 3gb1 s GLU 19 Ca 0.03 -0.35 -0.10 0.00 -0.41 0.00 0.00 54.97 54.15 3gb1 s GLU 19 Cb 0.00 -2.98 0.02 0.00 -1.78 0.00 0.00 34.13 29.40 3gb1 s GLU 19 CO -0.11 0.58 0.26 0.00 -0.49 0.00 0.00 175.26 175.51 3gb1 s ALA 20 N -0.53 -0.65 0.49 5.21 0.00 -1.12 -5.01 121.76 120.16 3gb1 s ALA 20 Ca 0.10 0.65 0.14 0.00 0.00 0.00 0.00 51.96 52.85 3gb1 s ALA 20 Cb -0.12 -0.35 1.15 0.00 0.00 0.00 0.00 23.12 23.81 3gb1 s ALA 20 CO 0.02 -0.15 2.11 -0.39 0.00 0.00 0.00 175.76 177.36 3gb1 h VAL 21 N 4.60 1.04 -3.27 0.00 -1.51 -1.98 -2.55 116.25 112.58 3gb1 h VAL 21 Ca -0.27 -0.11 -0.03 0.00 -1.23 0.00 0.00 66.70 65.06 3gb1 h VAL 21 Cb 1.19 0.94 -0.04 0.00 -2.13 0.00 0.00 31.29 31.24 3gb1 h VAL 21 CO 0.35 0.04 0.12 1.51 -1.23 0.00 0.00 177.57 178.37 3gb1 s ASP 22 N -6.98 0.03 0.22 4.19 -4.77 -1.26 -4.31 116.67 103.78 3gb1 s ASP 22 Ca -0.06 -0.98 -0.04 0.00 -3.30 0.00 0.00 52.55 48.17 3gb1 s ASP 22 Cb 0.17 0.74 0.20 0.00 -1.09 0.00 0.00 42.92 42.94 3gb1 s ASP 22 CO 0.69 -1.43 1.63 0.00 0.70 0.00 0.00 175.17 176.76 3gb1 h ALA 23 N 2.06 0.88 -0.83 2.11 0.00 -1.97 -2.84 119.26 118.67 3gb1 h ALA 23 Ca -0.26 -0.38 0.14 0.00 0.00 0.00 0.00 54.91 54.41 3gb1 h ALA 23 Cb 1.25 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 3gb1 h ALA 23 CO 0.34 0.63 0.54 0.00 0.00 0.00 0.00 179.25 180.76 3gb1 h ALA 24 N 1.09 1.92 -0.24 0.00 0.00 -1.99 0.31 119.26 120.34 3gb1 h ALA 24 Ca 0.09 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 3gb1 h ALA 24 Cb 0.75 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3gb1 h ALA 24 CO 0.06 -0.14 -0.55 1.15 0.00 0.00 0.00 179.25 179.77 3gb1 h THR 25 N 0.60 1.29 -1.00 0.00 2.02 -1.92 -3.04 112.91 110.87 3gb1 h THR 25 Ca 0.41 -1.76 0.02 0.00 0.77 0.00 0.00 66.41 65.85 3gb1 h THR 25 Cb 0.73 1.69 -0.05 0.00 -1.74 0.00 0.00 68.15 68.78 3gb1 h THR 25 CO -0.17 0.56 0.66 0.00 0.37 0.00 0.00 175.52 176.95 3gb1 h ALA 26 N 0.82 1.30 -0.78 6.16 0.00 -0.85 -1.22 119.26 124.69 3gb1 h ALA 26 Ca 0.01 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.88 3gb1 h ALA 26 Cb 1.13 -0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 3gb1 h ALA 26 CO 0.11 0.63 0.50 0.93 0.00 0.00 0.00 179.25 181.43 3gb1 h GLU 27 N 1.33 0.97 -0.35 0.00 5.08 -1.21 0.19 114.58 120.59 3gb1 h GLU 27 Ca 0.38 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.61 3gb1 h GLU 27 Cb -0.11 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 28.91 3gb1 h GLU 27 CO -0.09 0.64 -0.06 0.87 -1.00 0.00 0.00 179.01 179.37 3gb1 h LYS 28 N 1.00 0.65 0.16 2.33 1.57 -1.27 -1.89 116.57 119.12 3gb1 h LYS 28 Ca 0.31 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 3gb1 h LYS 28 Cb -0.02 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.24 3gb1 h LYS 28 CO -0.10 0.80 -0.08 0.28 -0.57 0.00 0.00 179.45 179.78 3gb1 h VAL 29 N 0.45 0.95 -0.59 0.50 2.07 -0.78 -2.98 116.25 115.87 3gb1 h VAL 29 Ca 0.09 -0.97 -0.10 0.00 0.82 0.00 0.00 66.70 66.54 3gb1 h VAL 29 Cb 0.54 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 3gb1 h VAL 29 CO 0.03 0.21 -0.04 -0.26 0.02 0.00 0.00 177.57 177.53 3gb1 h PHE 30 N -0.72 1.17 -0.84 1.57 0.04 -0.73 -1.89 116.94 115.54 3gb1 h PHE 30 Ca -0.02 -0.22 -0.03 0.00 2.80 0.00 0.00 57.97 60.50 3gb1 h PHE 30 Cb 0.51 -0.30 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 3gb1 h PHE 30 CO 0.07 1.05 0.39 0.87 -0.60 0.00 0.00 178.31 180.09 3gb1 h LYS 31 N 0.96 1.21 -0.36 1.51 1.57 -1.44 0.31 116.57 120.33 3gb1 h LYS 31 Ca 0.16 -0.19 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 3gb1 h LYS 31 Cb 0.60 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 3gb1 h LYS 31 CO 0.04 0.94 -0.37 0.37 -0.57 0.00 0.00 179.45 179.85 3gb1 h GLN 32 N 1.19 0.88 -0.55 3.15 4.15 -1.42 -1.32 115.11 121.19 3gb1 h GLN 32 Ca 0.29 -0.47 0.01 0.00 0.77 0.00 0.00 58.65 59.24 3gb1 h GLN 32 Cb 0.14 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 3gb1 h GLN 32 CO -0.03 1.12 0.36 -0.92 -1.93 0.00 0.00 178.83 177.43 3gb1 h TYR 33 N 0.68 0.69 -0.49 3.99 3.20 -0.92 0.12 116.97 124.25 3gb1 h TYR 33 Ca 0.05 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 3gb1 h TYR 33 Cb 0.96 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 3gb1 h TYR 33 CO 0.07 0.44 0.23 0.00 -1.64 0.00 0.00 178.16 177.25 3gb1 h ALA 34 N 1.20 0.63 -0.60 1.82 0.00 -0.82 -1.82 119.26 119.67 3gb1 h ALA 34 Ca 0.20 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3gb1 h ALA 34 Cb -0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3gb1 h ALA 34 CO -0.04 0.20 0.40 -0.97 0.00 0.00 0.00 179.25 178.83 3gb1 h ASN 35 N 0.64 0.69 0.17 0.00 -0.73 -0.55 0.36 115.58 116.15 3gb1 h ASN 35 Ca 0.17 -0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.31 3gb1 h ASN 35 Cb 0.13 -0.17 -0.00 0.00 0.27 0.00 0.00 38.32 38.55 3gb1 h ASN 35 CO -0.02 0.50 -0.04 0.44 -0.37 0.00 0.00 177.43 177.93 3gb1 h ASP 36 N 0.81 0.00 -0.69 1.15 3.32 -0.36 0.62 116.42 121.27 3gb1 h ASP 36 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3gb1 h ASP 36 Cb -0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3gb1 h ASP 36 CO -0.05 0.04 0.00 0.59 -1.72 0.00 0.00 179.24 178.11 3gb1 n ASN 37 N -3.64 3.78 -2.94 6.45 3.02 -0.10 -4.93 115.26 116.91 3gb1 n ASN 37 Ca -0.02 -2.00 -0.21 0.00 -0.03 0.00 0.00 54.58 52.32 3gb1 n ASN 37 Cb 0.15 -0.46 0.05 0.00 -0.61 0.00 0.00 39.78 38.90 3gb1 n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gb1 n GLY 38 N 1.62 -0.41 3.39 7.41 0.00 0.21 -4.98 105.19 112.43 3gb1 n GLY 38 Ca 0.24 0.09 -0.34 0.00 0.00 0.00 0.00 46.02 46.00 3gb1 n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gb1 s VAL 39 N -3.18 3.50 0.00 1.61 1.01 0.11 -4.99 120.40 118.46 3gb1 s VAL 39 Ca 0.36 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.86 3gb1 s VAL 39 Cb -0.16 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.68 3gb1 s VAL 39 CO 0.45 0.47 0.00 0.47 0.00 0.00 0.00 175.10 176.49 3gb1 n ASP 40 N 4.05 0.00 -0.76 3.32 8.00 -1.26 -3.99 116.55 125.92 3gb1 n ASP 40 Ca -0.18 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.42 3gb1 n ASP 40 Cb 0.52 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.58 3gb1 n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gb1 n GLY 41 N 4.48 -2.66 3.74 0.44 0.00 -1.26 -4.70 105.19 105.22 3gb1 n GLY 41 Ca 0.00 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.35 3gb1 n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gb1 s GLU 42 N -3.16 4.60 -0.15 1.61 2.02 -0.45 -4.71 118.70 118.46 3gb1 s GLU 42 Ca 0.00 1.69 -0.11 0.00 0.02 0.00 0.00 54.97 56.57 3gb1 s GLU 42 Cb 0.00 -3.29 -0.05 0.00 0.10 0.00 0.00 34.13 30.89 3gb1 s GLU 42 CO 0.00 0.08 0.21 -1.58 0.02 0.00 0.00 175.26 173.99 3gb1 s TRP 43 N -0.17 3.50 0.05 1.61 0.52 -1.26 -2.57 118.94 120.62 3gb1 s TRP 43 Ca 0.49 0.53 0.04 0.00 0.02 0.00 0.00 56.10 57.18 3gb1 s TRP 43 Cb -0.29 -2.18 -0.02 0.00 -1.15 0.00 0.00 33.47 29.83 3gb1 s TRP 43 CO 0.34 0.41 -0.11 0.95 0.02 0.00 0.00 176.95 178.56 3gb1 s THR 44 N -0.07 0.84 -0.04 2.01 -4.23 -0.64 -5.01 115.64 108.50 3gb1 s THR 44 Ca 0.14 -1.07 0.02 0.00 -1.18 0.00 0.00 61.69 59.60 3gb1 s THR 44 Cb -0.12 -0.82 0.01 0.00 1.34 0.00 0.00 72.50 72.91 3gb1 s THR 44 CO 0.03 -0.21 -0.07 -0.47 -0.54 0.00 0.00 174.62 173.36 3gb1 s TYR 45 N -1.13 0.88 -0.31 3.99 5.04 -1.26 -1.57 117.35 122.98 3gb1 s TYR 45 Ca -0.04 -0.25 -0.03 0.00 -2.44 0.00 0.00 57.07 54.31 3gb1 s TYR 45 Cb -0.09 -0.69 0.05 0.00 0.35 0.00 0.00 41.96 41.58 3gb1 s TYR 45 CO 0.01 -0.16 0.03 0.34 -1.34 0.00 0.00 175.55 174.43 3gb1 s ASP 46 N 0.58 5.00 0.36 4.32 -1.08 -0.85 -4.97 116.67 120.03 3gb1 s ASP 46 Ca -0.09 -1.23 0.13 0.00 -0.52 0.00 0.00 52.55 50.85 3gb1 s ASP 46 Cb -0.12 -1.75 0.69 0.00 -1.46 0.00 0.00 42.92 40.28 3gb1 s ASP 46 CO 0.01 -0.28 1.80 -0.78 0.52 0.00 0.00 175.17 176.44 3gb1 h ASP 47 N 8.06 0.00 -0.59 -0.34 1.82 -1.96 0.53 116.42 123.93 3gb1 h ASP 47 Ca -0.22 0.00 -0.10 0.00 -0.39 0.00 0.00 57.03 56.32 3gb1 h ASP 47 Cb 1.07 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.06 3gb1 h ASP 47 CO 0.55 0.40 -0.03 0.00 -1.61 0.00 0.00 179.24 178.55 3gb1 h ALA 48 N 1.60 0.82 -0.02 -0.78 0.00 -1.98 -3.10 119.26 115.80 3gb1 h ALA 48 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3gb1 h ALA 48 Cb 0.73 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3gb1 h ALA 48 CO 0.05 0.67 -0.01 0.25 0.00 0.00 0.00 179.25 180.21 3gb1 n THR 49 N -4.17 0.00 -4.05 0.00 -2.24 -1.15 -4.96 114.28 97.71 3gb1 n THR 49 Ca 0.03 -0.49 -0.33 0.00 -2.27 0.00 0.00 64.05 60.99 3gb1 n THR 49 Cb 0.37 1.37 -0.00 0.00 -2.10 0.00 0.00 70.33 69.97 3gb1 n THR 49 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3gb1 n LYS 50 N 0.98 -4.31 -5.23 -0.78 5.02 0.18 -4.81 118.16 109.22 3gb1 n LYS 50 Ca 0.10 0.48 -0.32 0.00 -2.02 0.00 0.00 58.31 56.56 3gb1 n LYS 50 Cb 0.45 -5.25 -0.17 0.00 -0.02 0.00 0.00 35.03 30.04 3gb1 n LYS 50 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3gb1 s THR 51 N -3.34 2.05 -0.10 -0.18 2.01 -1.03 -2.90 115.64 112.16 3gb1 s THR 51 Ca 0.65 -1.03 -0.09 0.00 0.31 0.00 0.00 61.69 61.53 3gb1 s THR 51 Cb -0.34 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 3gb1 s THR 51 CO 0.88 0.56 0.21 -0.36 -0.69 0.00 0.00 174.62 175.21 3gb1 s PHE 52 N 0.26 3.61 -0.04 4.92 0.08 -0.01 -2.00 117.98 124.80 3gb1 s PHE 52 Ca -0.16 0.63 0.02 0.00 0.12 0.00 0.00 56.93 57.53 3gb1 s PHE 52 Cb -0.17 -2.05 0.01 0.00 -0.57 0.00 0.00 43.02 40.25 3gb1 s PHE 52 CO 0.08 0.68 -0.08 0.99 -0.10 0.00 0.00 175.22 176.79 3gb1 s THR 53 N -0.91 0.79 -0.10 0.64 2.01 -0.61 -2.23 115.64 115.22 3gb1 s THR 53 Ca 0.17 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.89 3gb1 s THR 53 Cb -0.13 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.64 3gb1 s THR 53 CO 0.06 0.27 -0.21 0.54 -0.69 0.00 0.00 174.62 174.59 3gb1 s VAL 54 N 0.59 1.87 -0.11 3.82 0.11 -1.17 -1.62 120.40 123.90 3gb1 s VAL 54 Ca -0.10 -0.90 0.03 0.00 -2.93 0.00 0.00 61.98 58.09 3gb1 s VAL 54 Cb -0.13 -1.64 0.01 0.00 -1.53 0.00 0.00 36.38 33.08 3gb1 s VAL 54 CO 0.01 0.52 -0.21 -0.89 -3.33 0.00 0.00 175.10 171.20 3gb1 s THR 55 N 0.56 1.91 -2.45 5.04 2.01 -1.06 -2.80 115.64 118.84 3gb1 s THR 55 Ca -0.14 -0.92 0.28 0.00 0.31 0.00 0.00 61.69 61.22 3gb1 s THR 55 Cb -0.17 -1.67 0.58 0.00 0.01 0.00 0.00 72.50 71.25 3gb1 s THR 55 CO 0.05 0.52 1.79 -0.62 -0.69 0.00 0.00 174.62 175.67