#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 5.06 0.06 2.03 2.01 -1.26 -2.78 115.64 120.75 3gb1 s THR 2 Ca 0.00 1.04 0.08 0.00 0.31 0.00 0.00 61.69 63.12 3gb1 s THR 2 Cb 0.00 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 3gb1 s THR 2 CO 0.00 0.41 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.81 3gb1 s TYR 3 N -0.00 2.46 0.02 4.92 2.02 -0.82 -4.89 117.35 121.06 3gb1 s TYR 3 Ca 0.27 -0.32 0.06 0.00 -0.37 0.00 0.00 57.07 56.72 3gb1 s TYR 3 Cb -0.17 -1.41 -0.03 0.00 -0.40 0.00 0.00 41.96 39.95 3gb1 s TYR 3 CO 0.13 0.24 -0.15 0.21 -1.57 0.00 0.00 175.55 174.41 3gb1 s LYS 4 N -1.50 2.24 -0.10 -0.62 2.20 -0.66 -2.11 119.74 119.19 3gb1 s LYS 4 Ca 0.14 -0.88 0.03 0.00 -0.36 0.00 0.00 55.97 54.90 3gb1 s LYS 4 Cb -0.10 -2.28 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 3gb1 s LYS 4 CO 0.05 0.57 -0.21 -1.17 -0.36 0.00 0.00 175.35 174.22 3gb1 s LEU 5 N -1.32 1.99 -0.23 5.43 2.96 -0.19 0.83 118.68 128.15 3gb1 s LEU 5 Ca 0.15 -0.51 -0.06 0.00 -0.22 0.00 0.00 54.13 53.48 3gb1 s LEU 5 Cb -0.11 -1.30 -0.03 0.00 0.50 0.00 0.00 46.19 45.26 3gb1 s LEU 5 CO 0.05 0.12 0.04 -0.63 -1.32 0.00 0.00 176.35 174.61 3gb1 s ILE 6 N 0.51 4.20 -0.36 6.68 1.01 -0.40 -1.82 121.20 131.02 3gb1 s ILE 6 Ca -0.16 -0.22 -0.13 0.00 0.00 0.00 0.00 60.65 60.15 3gb1 s ILE 6 Cb -0.17 -2.94 -0.00 0.00 0.01 0.00 0.00 42.46 39.36 3gb1 s ILE 6 CO 0.06 0.38 0.24 -0.76 0.00 0.00 0.00 174.94 174.86 3gb1 s LEU 7 N 1.31 4.63 -0.71 2.97 1.43 0.11 -2.71 118.68 125.72 3gb1 s LEU 7 Ca 0.05 -0.58 0.04 0.00 -1.03 0.00 0.00 54.13 52.61 3gb1 s LEU 7 Cb -0.15 -2.12 0.27 0.00 0.03 0.00 0.00 46.19 44.22 3gb1 s LEU 7 CO 0.03 -0.29 0.91 0.59 0.23 0.00 0.00 176.35 177.82 3gb1 n ASN 8 N 5.10 4.36 -4.90 2.29 3.02 -1.09 -2.22 115.26 121.82 3gb1 n ASN 8 Ca -0.12 -3.48 -0.29 0.00 -0.03 0.00 0.00 54.58 50.66 3gb1 n ASN 8 Cb 0.49 -0.77 0.08 0.00 -0.61 0.00 0.00 39.78 38.98 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 -2.46 1.59 0.29 7.41 0.00 0.33 -3.34 107.32 111.15 3gb1 s GLY 9 Ca 0.39 -0.61 0.01 0.00 0.00 0.00 0.00 44.72 44.52 3gb1 s GLY 9 CO -0.01 -0.14 1.81 0.07 0.00 0.00 0.00 173.10 174.83 3gb1 h LYS 10 N -1.01 0.66 0.00 2.90 2.10 -1.98 -3.32 116.57 115.92 3gb1 h LYS 10 Ca -0.46 -0.16 0.00 0.00 -2.00 0.00 0.00 60.65 58.03 3gb1 h LYS 10 Cb 1.32 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 3gb1 h LYS 10 CO 0.66 0.69 -0.69 -2.37 -2.00 0.00 0.00 179.45 175.73 3gb1 n THR 11 N -4.24 0.00 -3.41 0.07 5.66 -1.26 -5.00 114.28 106.11 3gb1 n THR 11 Ca 0.02 -0.03 -0.39 0.00 -3.05 0.00 0.00 64.05 60.60 3gb1 n THR 11 Cb 0.28 0.43 -0.09 0.00 -1.55 0.00 0.00 70.33 69.40 3gb1 n THR 11 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 3gb1 s LEU 12 N -2.20 4.04 -0.06 1.09 2.96 -1.25 -5.05 118.68 118.21 3gb1 s LEU 12 Ca 0.00 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.17 3gb1 s LEU 12 Cb 0.00 -2.40 0.02 0.00 0.50 0.00 0.00 46.19 44.32 3gb1 s LEU 12 CO 0.00 -0.17 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.29 3gb1 s LYS 13 N 2.04 0.78 -0.09 1.98 1.02 -1.26 0.12 119.74 124.34 3gb1 s LYS 13 Ca 0.14 -0.04 -0.27 0.00 0.02 0.00 0.00 55.97 55.82 3gb1 s LYS 13 Cb -0.16 -0.92 0.09 0.00 -0.52 0.00 0.00 37.83 36.32 3gb1 s LYS 13 CO 0.10 -0.17 1.20 0.41 -0.92 0.00 0.00 175.35 175.97 3gb1 n GLY 14 N 4.47 0.11 3.23 -3.33 0.00 -0.94 -5.01 105.19 103.72 3gb1 n GLY 14 Ca -0.18 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.00 0.82 0.25 1.61 -1.05 -1.26 0.06 118.70 117.14 3gb1 s GLU 15 Ca 0.29 -0.72 -0.14 0.00 -0.15 0.00 0.00 54.97 54.25 3gb1 s GLU 15 Cb -0.00 0.35 -0.00 0.00 -0.44 0.00 0.00 34.13 34.04 3gb1 s GLU 15 CO -0.03 -0.27 0.51 -0.08 0.95 0.00 0.00 175.26 176.35 3gb1 s THR 16 N -3.17 0.00 0.09 1.83 -1.32 -0.76 -4.99 115.64 107.33 3gb1 s THR 16 Ca -0.01 -1.35 0.02 0.00 -1.21 0.00 0.00 61.69 59.14 3gb1 s THR 16 Cb 0.01 -2.18 -0.04 0.00 -1.51 0.00 0.00 72.50 68.79 3gb1 s THR 16 CO -0.07 0.00 -0.07 0.42 -2.21 0.00 0.00 174.62 172.69 3gb1 s THR 17 N -4.00 0.68 0.17 5.08 -4.23 -1.26 -1.02 115.64 111.05 3gb1 s THR 17 Ca 0.21 -1.86 -0.20 0.00 -1.18 0.00 0.00 61.69 58.65 3gb1 s THR 17 Cb -0.01 -1.59 0.05 0.00 1.34 0.00 0.00 72.50 72.28 3gb1 s THR 17 CO 0.09 -0.83 0.55 0.28 -0.54 0.00 0.00 174.62 174.16 3gb1 s THR 18 N -3.44 0.02 -0.12 3.99 -1.32 -0.90 -5.00 115.64 108.87 3gb1 s THR 18 Ca 0.10 -0.37 -0.04 0.00 -1.21 0.00 0.00 61.69 60.17 3gb1 s THR 18 Cb 0.04 -1.23 -0.03 0.00 -1.51 0.00 0.00 72.50 69.77 3gb1 s THR 18 CO -0.04 -0.10 0.02 -1.61 -2.21 0.00 0.00 174.62 170.68 3gb1 s GLU 19 N -3.80 3.39 -0.06 7.08 8.01 -1.26 -1.95 118.70 130.11 3gb1 s GLU 19 Ca 0.04 -0.39 -0.15 0.00 0.01 0.00 0.00 54.97 54.48 3gb1 s GLU 19 Cb -0.01 -2.95 0.03 0.00 -4.31 0.00 0.00 34.13 26.89 3gb1 s GLU 19 CO -0.09 0.52 0.35 0.00 0.01 0.00 0.00 175.26 176.05 3gb1 s ALA 20 N -0.37 -0.87 0.49 5.21 0.00 -1.12 -5.01 121.76 120.09 3gb1 s ALA 20 Ca 0.08 0.62 0.15 0.00 0.00 0.00 0.00 51.96 52.81 3gb1 s ALA 20 Cb -0.12 -0.17 1.16 0.00 0.00 0.00 0.00 23.12 23.99 3gb1 s ALA 20 CO 0.02 -0.23 2.09 -0.39 0.00 0.00 0.00 175.76 177.24 3gb1 h VAL 21 N 4.08 1.05 -3.05 0.00 -1.51 -1.98 -2.72 116.25 112.12 3gb1 h VAL 21 Ca -0.28 -0.24 -0.01 0.00 -1.23 0.00 0.00 66.70 64.94 3gb1 h VAL 21 Cb 1.18 1.12 -0.01 0.00 -2.13 0.00 0.00 31.29 31.44 3gb1 h VAL 21 CO 0.35 0.07 0.24 1.51 -1.23 0.00 0.00 177.57 178.52 3gb1 s ASP 22 N -7.04 -0.02 0.25 4.19 -4.77 -1.26 -4.58 116.67 103.45 3gb1 s ASP 22 Ca -0.05 -1.05 0.00 0.00 -3.30 0.00 0.00 52.55 48.16 3gb1 s ASP 22 Cb 0.17 0.82 0.32 0.00 -1.09 0.00 0.00 42.92 43.13 3gb1 s ASP 22 CO 0.68 -1.60 1.67 0.00 0.70 0.00 0.00 175.17 176.62 3gb1 h ALA 23 N 2.01 0.99 -0.98 2.11 0.00 -1.97 -2.98 119.26 118.43 3gb1 h ALA 23 Ca -0.29 -0.38 0.18 0.00 0.00 0.00 0.00 54.91 54.41 3gb1 h ALA 23 Cb 1.25 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.82 3gb1 h ALA 23 CO 0.37 0.60 0.61 0.00 0.00 0.00 0.00 179.25 180.83 3gb1 h ALA 24 N 1.21 1.74 -0.01 0.00 0.00 -1.99 0.19 119.26 120.39 3gb1 h ALA 24 Ca 0.06 0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 3gb1 h ALA 24 Cb 0.76 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3gb1 h ALA 24 CO 0.06 -0.06 -0.80 1.79 0.00 0.00 0.00 179.25 180.24 3gb1 h THR 25 N 0.75 1.49 -0.61 0.00 1.35 -1.94 -3.15 112.91 110.80 3gb1 h THR 25 Ca 0.54 -2.49 -0.03 0.00 -0.55 0.00 0.00 66.41 63.88 3gb1 h THR 25 Cb 0.85 2.36 -0.03 0.00 -1.73 0.00 0.00 68.15 69.61 3gb1 h THR 25 CO -0.32 0.72 0.27 0.00 -0.25 0.00 0.00 175.52 175.94 3gb1 h ALA 26 N 1.08 0.79 -0.19 6.62 0.00 -0.61 0.43 119.26 127.37 3gb1 h ALA 26 Ca -0.03 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.76 3gb1 h ALA 26 Cb 1.39 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 3gb1 h ALA 26 CO 0.12 0.38 -0.01 0.93 0.00 0.00 0.00 179.25 180.67 3gb1 h GLU 27 N 0.84 0.05 -0.47 0.00 5.08 -1.10 0.32 114.58 119.30 3gb1 h GLU 27 Ca 0.21 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 3gb1 h GLU 27 Cb 0.16 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3gb1 h GLU 27 CO -0.02 0.04 0.17 -0.22 -1.00 0.00 0.00 179.01 177.98 3gb1 h LYS 28 N 0.06 0.71 0.14 2.33 3.64 -1.46 -0.97 116.57 121.02 3gb1 h LYS 28 Ca 0.09 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 3gb1 h LYS 28 Cb 0.12 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3gb1 h LYS 28 CO -0.16 0.66 -0.07 0.28 -2.27 0.00 0.00 179.45 177.89 3gb1 h VAL 29 N 0.62 1.01 -0.72 2.00 2.07 -0.46 -2.60 116.25 118.16 3gb1 h VAL 29 Ca 0.15 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 3gb1 h VAL 29 Cb 0.22 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 3gb1 h VAL 29 CO -0.01 0.20 0.37 -0.26 0.02 0.00 0.00 177.57 177.90 3gb1 h PHE 30 N -0.65 0.99 -0.64 1.57 0.04 -0.41 -0.61 116.94 117.24 3gb1 h PHE 30 Ca -0.02 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 3gb1 h PHE 30 Cb 0.48 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.29 3gb1 h PHE 30 CO 0.06 0.70 0.36 -0.22 -0.60 0.00 0.00 178.31 178.61 3gb1 h LYS 31 N 1.00 0.89 -0.28 1.51 3.64 -1.17 0.31 116.57 122.47 3gb1 h LYS 31 Ca 0.25 -0.10 -0.08 0.00 -1.27 0.00 0.00 60.65 59.45 3gb1 h LYS 31 Cb 0.06 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3gb1 h LYS 31 CO -0.04 0.66 -0.16 0.37 -2.27 0.00 0.00 179.45 178.02 3gb1 h GLN 32 N 0.87 0.60 -0.22 1.90 4.15 -1.03 0.12 115.11 121.50 3gb1 h GLN 32 Ca 0.23 -0.27 0.00 0.00 0.77 0.00 0.00 58.65 59.38 3gb1 h GLN 32 Cb 0.03 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 3gb1 h GLN 32 CO -0.04 0.85 0.14 -0.92 -1.93 0.00 0.00 178.83 176.94 3gb1 h TYR 33 N 0.34 0.27 -0.75 3.99 5.03 -0.80 0.55 116.97 125.60 3gb1 h TYR 33 Ca 0.06 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.34 3gb1 h TYR 33 Cb 0.68 -0.09 -0.03 0.00 1.55 0.00 0.00 36.73 38.84 3gb1 h TYR 33 CO 0.06 0.17 0.33 0.00 -1.32 0.00 0.00 178.16 177.40 3gb1 h ALA 34 N 1.08 0.97 -0.82 1.82 0.00 -0.30 -1.90 119.26 120.10 3gb1 h ALA 34 Ca 0.08 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3gb1 h ALA 34 Cb -0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.42 3gb1 h ALA 34 CO -0.02 0.56 0.54 -0.97 0.00 0.00 0.00 179.25 179.37 3gb1 h ASN 35 N 1.06 0.94 0.57 0.00 -0.73 -0.14 0.18 115.58 117.46 3gb1 h ASN 35 Ca 0.25 -0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.40 3gb1 h ASN 35 Cb 0.17 -0.23 0.00 0.00 0.27 0.00 0.00 38.32 38.53 3gb1 h ASN 35 CO -0.03 0.68 0.00 0.44 -0.37 0.00 0.00 177.43 178.15 3gb1 h ASP 36 N 1.11 0.00 -0.26 1.15 3.32 -0.30 -1.37 116.42 120.08 3gb1 h ASP 36 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 3gb1 h ASP 36 Cb -0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3gb1 h ASP 36 CO -0.07 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.04 3gb1 n ASN 37 N -3.05 2.59 -1.31 6.45 5.03 0.55 -4.93 115.26 120.59 3gb1 n ASN 37 Ca -0.01 -1.86 -0.10 0.00 0.87 0.00 0.00 54.58 53.48 3gb1 n ASN 37 Cb 0.20 -0.16 0.01 0.00 -1.02 0.00 0.00 39.78 38.80 3gb1 n ASN 37 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3gb1 n GLY 38 N 1.32 0.07 3.39 7.41 0.00 -0.51 -5.01 105.19 111.85 3gb1 n GLY 38 Ca 0.17 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.67 3.66 -0.31 1.61 1.01 -0.65 -5.03 120.40 118.03 3gb1 s VAL 39 Ca 0.08 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.66 3gb1 s VAL 39 Cb -0.03 -2.66 0.15 0.00 0.00 0.00 0.00 36.38 33.84 3gb1 s VAL 39 CO 0.09 0.43 0.35 1.51 0.00 0.00 0.00 175.10 177.48 3gb1 s ASP 40 N 1.17 1.15 0.00 3.32 -4.77 -1.26 -4.20 116.67 112.08 3gb1 s ASP 40 Ca 0.02 -0.84 0.00 0.00 -3.30 0.00 0.00 52.55 48.43 3gb1 s ASP 40 Cb -0.14 0.71 0.00 0.00 -1.09 0.00 0.00 42.92 42.39 3gb1 s ASP 40 CO 0.00 -0.35 0.00 0.61 0.70 0.00 0.00 175.17 176.14 3gb1 n GLY 41 N 5.07 3.55 3.75 2.12 0.00 -1.26 -4.91 105.19 113.51 3gb1 n GLY 41 Ca 0.02 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 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 4.07 4.19 -0.09 1.61 0.41 -1.05 -4.95 118.70 122.90 3gb1 s GLU 42 Ca 0.00 0.28 -0.01 0.00 -0.41 0.00 0.00 54.97 54.83 3gb1 s GLU 42 Cb 0.00 -3.38 -0.03 0.00 -1.78 0.00 0.00 34.13 28.94 3gb1 s GLU 42 CO 0.00 0.32 -0.02 -1.58 -0.49 0.00 0.00 175.26 173.49 3gb1 s TRP 43 N 0.16 3.11 0.04 1.61 0.52 -1.26 -2.39 118.94 120.72 3gb1 s TRP 43 Ca 0.21 0.14 0.02 0.00 0.02 0.00 0.00 56.10 56.49 3gb1 s TRP 43 Cb -0.14 -1.78 -0.02 0.00 -1.15 0.00 0.00 33.47 30.37 3gb1 s TRP 43 CO 0.08 0.42 -0.07 0.95 0.02 0.00 0.00 176.95 178.35 3gb1 s THR 44 N -0.80 0.45 -0.02 2.01 -4.23 -0.57 -5.01 115.64 107.47 3gb1 s THR 44 Ca 0.12 -1.07 0.02 0.00 -1.18 0.00 0.00 61.69 59.58 3gb1 s THR 44 Cb -0.11 -0.56 0.01 0.00 1.34 0.00 0.00 72.50 73.17 3gb1 s THR 44 CO 0.02 -0.42 -0.06 -0.47 -0.54 0.00 0.00 174.62 173.15 3gb1 s TYR 45 N -1.46 0.69 -0.34 3.99 5.04 -1.26 -1.37 117.35 122.64 3gb1 s TYR 45 Ca -0.11 -0.16 -0.04 0.00 -2.44 0.00 0.00 57.07 54.32 3gb1 s TYR 45 Cb -0.10 -0.52 0.06 0.00 0.35 0.00 0.00 41.96 41.75 3gb1 s TYR 45 CO -0.00 -0.08 0.09 0.34 -1.34 0.00 0.00 175.55 174.55 3gb1 s ASP 46 N 0.26 5.16 0.37 4.32 -1.08 -0.77 -4.96 116.67 119.96 3gb1 s ASP 46 Ca -0.03 -1.34 0.13 0.00 -0.52 0.00 0.00 52.55 50.79 3gb1 s ASP 46 Cb -0.08 -1.81 0.71 0.00 -1.46 0.00 0.00 42.92 40.28 3gb1 s ASP 46 CO -0.00 -0.34 1.82 -0.78 0.52 0.00 0.00 175.17 176.39 3gb1 h ASP 47 N 8.12 0.00 -0.67 -0.34 1.82 -1.96 0.57 116.42 123.96 3gb1 h ASP 47 Ca -0.21 0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 56.35 3gb1 h ASP 47 Cb 1.07 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.05 3gb1 h ASP 47 CO 0.60 0.38 0.09 0.00 -1.61 0.00 0.00 179.24 178.70 3gb1 h ALA 48 N 1.62 0.89 -0.02 -0.78 0.00 -1.97 -3.10 119.26 115.89 3gb1 h ALA 48 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3gb1 h ALA 48 Cb 0.67 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3gb1 h ALA 48 CO 0.05 0.67 0.00 0.25 0.00 0.00 0.00 179.25 180.22 3gb1 n THR 49 N -4.21 0.00 -4.03 0.00 -2.24 -1.12 -4.96 114.28 97.72 3gb1 n THR 49 Ca 0.04 -0.50 -0.32 0.00 -2.27 0.00 0.00 64.05 61.00 3gb1 n THR 49 Cb 0.30 1.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.89 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 0.96 -4.40 -5.21 -0.78 5.02 0.20 -4.74 118.16 109.20 3gb1 n LYS 50 Ca 0.10 0.49 -0.32 0.00 -2.02 0.00 0.00 58.31 56.56 3gb1 n LYS 50 Cb 0.43 -5.25 -0.17 0.00 -0.02 0.00 0.00 35.03 30.02 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 -3.36 2.07 -0.10 -0.18 2.01 -1.04 -1.65 115.64 113.38 3gb1 s THR 51 Ca 0.62 -1.02 -0.08 0.00 0.31 0.00 0.00 61.69 61.52 3gb1 s THR 51 Cb -0.32 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 3gb1 s THR 51 CO 0.87 0.56 0.18 -0.36 -0.69 0.00 0.00 174.62 175.19 3gb1 s PHE 52 N 0.34 3.61 -0.06 4.92 0.08 0.24 -1.84 117.98 125.28 3gb1 s PHE 52 Ca -0.19 0.60 0.02 0.00 0.12 0.00 0.00 56.93 57.49 3gb1 s PHE 52 Cb -0.18 -2.01 0.01 0.00 -0.57 0.00 0.00 43.02 40.28 3gb1 s PHE 52 CO 0.09 0.71 -0.12 0.99 -0.10 0.00 0.00 175.22 176.78 3gb1 s THR 53 N -0.99 1.14 -0.09 0.64 2.01 -0.47 -1.28 115.64 116.60 3gb1 s THR 53 Ca 0.16 -0.49 0.03 0.00 0.31 0.00 0.00 61.69 61.71 3gb1 s THR 53 Cb -0.13 -1.04 0.01 0.00 0.01 0.00 0.00 72.50 71.35 3gb1 s THR 53 CO 0.05 0.35 -0.20 0.54 -0.69 0.00 0.00 174.62 174.68 3gb1 s VAL 54 N 0.62 1.73 -0.13 3.82 0.11 -1.10 -1.50 120.40 123.95 3gb1 s VAL 54 Ca -0.14 -0.82 0.03 0.00 -2.93 0.00 0.00 61.98 58.11 3gb1 s VAL 54 Cb -0.15 -1.52 0.01 0.00 -1.53 0.00 0.00 36.38 33.18 3gb1 s VAL 54 CO 0.04 0.49 -0.21 -0.89 -3.33 0.00 0.00 175.10 171.19 3gb1 s THR 55 N 0.51 1.96 -2.66 5.04 2.01 -1.00 -2.68 115.64 118.82 3gb1 s THR 55 Ca -0.16 -0.93 0.27 0.00 0.31 0.00 0.00 61.69 61.18 3gb1 s THR 55 Cb -0.17 -1.73 0.44 0.00 0.01 0.00 0.00 72.50 71.05 3gb1 s THR 55 CO 0.06 0.53 1.59 1.21 -0.69 0.00 0.00 174.62 177.32