#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 5.01 0.00 2.03 2.01 -1.26 -2.84 115.64 120.59 3gb1 s THR 2 Ca 0.00 1.28 0.05 0.00 0.31 0.00 0.00 61.69 63.33 3gb1 s THR 2 Cb 0.00 -3.96 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 3gb1 s THR 2 CO 0.00 0.34 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.80 3gb1 s TYR 3 N 0.33 2.65 -0.04 4.92 2.02 -0.89 -4.90 117.35 121.45 3gb1 s TYR 3 Ca 0.33 -0.20 0.05 0.00 -0.37 0.00 0.00 57.07 56.88 3gb1 s TYR 3 Cb -0.18 -1.54 -0.02 0.00 -0.40 0.00 0.00 41.96 39.82 3gb1 s TYR 3 CO 0.16 0.24 -0.17 0.21 -1.57 0.00 0.00 175.55 174.42 3gb1 s LYS 4 N -1.17 2.38 -0.13 -0.62 2.20 -1.09 -2.03 119.74 119.28 3gb1 s LYS 4 Ca 0.14 -0.77 0.02 0.00 -0.36 0.00 0.00 55.97 55.00 3gb1 s LYS 4 Cb -0.11 -2.28 -0.00 0.00 -1.51 0.00 0.00 37.83 33.93 3gb1 s LYS 4 CO 0.04 0.60 -0.19 -1.17 -0.36 0.00 0.00 175.35 174.27 3gb1 s LEU 5 N -0.75 2.34 -0.25 5.43 2.96 -0.42 -0.54 118.68 127.44 3gb1 s LEU 5 Ca 0.11 -0.49 -0.09 0.00 -0.22 0.00 0.00 54.13 53.44 3gb1 s LEU 5 Cb -0.10 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 3gb1 s LEU 5 CO 0.00 0.13 0.13 -0.63 -1.32 0.00 0.00 176.35 174.66 3gb1 s ILE 6 N 0.56 4.95 -0.40 6.68 1.01 -0.87 -2.11 121.20 131.02 3gb1 s ILE 6 Ca -0.11 0.04 -0.15 0.00 0.00 0.00 0.00 60.65 60.43 3gb1 s ILE 6 Cb -0.16 -3.33 0.02 0.00 0.01 0.00 0.00 42.46 39.00 3gb1 s ILE 6 CO 0.04 0.31 0.29 -0.76 0.00 0.00 0.00 174.94 174.83 3gb1 s LEU 7 N 1.46 5.05 -0.76 2.97 1.43 -0.05 -3.14 118.68 125.63 3gb1 s LEU 7 Ca 0.06 -0.85 0.03 0.00 -1.03 0.00 0.00 54.13 52.34 3gb1 s LEU 7 Cb -0.15 -2.16 0.28 0.00 0.03 0.00 0.00 46.19 44.19 3gb1 s LEU 7 CO 0.07 -0.43 1.01 -3.20 0.23 0.00 0.00 176.35 174.03 3gb1 n ASN 8 N 5.15 4.70 -4.79 2.29 5.15 -1.18 -2.39 115.26 124.19 3gb1 n ASN 8 Ca -0.11 -3.48 -0.29 0.00 -0.60 0.00 0.00 54.58 50.09 3gb1 n ASN 8 Cb 0.47 -0.83 0.11 0.00 -0.53 0.00 0.00 39.78 39.00 3gb1 n ASN 8 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3gb1 s GLY 9 N -2.38 1.61 0.22 8.20 0.00 0.22 -3.38 107.32 111.80 3gb1 s GLY 9 Ca 0.39 -0.71 -0.07 0.00 0.00 0.00 0.00 44.72 44.34 3gb1 s GLY 9 CO -0.00 -0.17 1.77 0.50 0.00 0.00 0.00 173.10 175.20 3gb1 h LYS 10 N -1.19 1.12 0.00 2.90 1.57 -1.97 -3.32 116.57 115.68 3gb1 h LYS 10 Ca -0.46 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.09 3gb1 h LYS 10 Cb 1.32 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.46 3gb1 h LYS 10 CO 0.62 0.94 -0.30 0.25 -0.57 0.00 0.00 179.45 180.39 3gb1 n THR 11 N -4.26 0.00 -3.50 -0.16 -2.24 -1.26 -5.00 114.28 97.86 3gb1 n THR 11 Ca 0.06 -0.23 -0.38 0.00 -2.27 0.00 0.00 64.05 61.23 3gb1 n THR 11 Cb 0.21 0.75 -0.10 0.00 -2.10 0.00 0.00 70.33 69.09 3gb1 n THR 11 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3gb1 s LEU 12 N -1.79 4.03 -0.06 3.22 2.96 -1.25 -5.06 118.68 120.73 3gb1 s LEU 12 Ca 0.00 0.12 0.01 0.00 -0.22 0.00 0.00 54.13 54.03 3gb1 s LEU 12 Cb 0.00 -2.25 0.02 0.00 0.50 0.00 0.00 46.19 44.46 3gb1 s LEU 12 CO 0.00 -0.11 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.33 3gb1 s LYS 13 N 1.90 0.98 0.00 1.98 1.02 -1.26 0.69 119.74 125.04 3gb1 s LYS 13 Ca 0.10 -0.12 0.00 0.00 0.02 0.00 0.00 55.97 55.97 3gb1 s LYS 13 Cb -0.16 -1.03 0.00 0.00 -0.52 0.00 0.00 37.83 36.12 3gb1 s LYS 13 CO 0.11 -0.13 0.00 0.41 -0.92 0.00 0.00 175.35 174.81 3gb1 n GLY 14 N 4.35 -1.25 3.20 -3.33 0.00 -1.01 -5.02 105.19 102.14 3gb1 n GLY 14 Ca -0.19 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.76 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 -1.31 0.76 0.27 1.61 -1.05 -1.26 -0.87 118.70 116.85 3gb1 s GLU 15 Ca 0.00 -0.70 -0.15 0.00 -0.15 0.00 0.00 54.97 53.96 3gb1 s GLU 15 Cb 0.00 0.32 0.01 0.00 -0.44 0.00 0.00 34.13 34.02 3gb1 s GLU 15 CO 0.00 -0.23 0.58 -0.08 0.95 0.00 0.00 175.26 176.47 3gb1 s THR 16 N -2.96 0.00 0.08 1.83 -1.32 -0.90 -5.00 115.64 107.38 3gb1 s THR 16 Ca -0.02 -1.25 0.01 0.00 -1.21 0.00 0.00 61.69 59.22 3gb1 s THR 16 Cb 0.01 -2.18 -0.04 0.00 -1.51 0.00 0.00 72.50 68.78 3gb1 s THR 16 CO -0.06 0.00 -0.06 0.42 -2.21 0.00 0.00 174.62 172.71 3gb1 s THR 17 N -3.87 0.57 0.13 5.08 -4.23 -1.26 -1.30 115.64 110.76 3gb1 s THR 17 Ca 0.18 -1.81 -0.17 0.00 -1.18 0.00 0.00 61.69 58.71 3gb1 s THR 17 Cb -0.03 -1.52 0.04 0.00 1.34 0.00 0.00 72.50 72.33 3gb1 s THR 17 CO 0.09 -0.85 0.44 0.28 -0.54 0.00 0.00 174.62 174.04 3gb1 s THR 18 N -3.44 0.06 -0.15 3.99 -1.32 -0.86 -5.01 115.64 108.91 3gb1 s THR 18 Ca 0.08 -0.50 -0.06 0.00 -1.21 0.00 0.00 61.69 60.01 3gb1 s THR 18 Cb 0.04 -1.16 -0.04 0.00 -1.51 0.00 0.00 72.50 69.83 3gb1 s THR 18 CO -0.05 -0.26 0.06 -1.61 -2.21 0.00 0.00 174.62 170.55 3gb1 s GLU 19 N -3.80 3.69 -0.09 7.08 2.02 -1.26 -2.09 118.70 124.25 3gb1 s GLU 19 Ca 0.03 -0.33 -0.12 0.00 0.02 0.00 0.00 54.97 54.57 3gb1 s GLU 19 Cb 0.01 -3.12 0.03 0.00 0.10 0.00 0.00 34.13 31.16 3gb1 s GLU 19 CO -0.12 0.44 0.32 0.00 0.02 0.00 0.00 175.26 175.92 3gb1 s ALA 20 N -0.11 -0.78 0.49 5.21 0.00 -1.13 -5.00 121.76 120.43 3gb1 s ALA 20 Ca 0.07 0.72 0.24 0.00 0.00 0.00 0.00 51.96 52.98 3gb1 s ALA 20 Cb -0.12 -0.34 1.44 0.00 0.00 0.00 0.00 23.12 24.10 3gb1 s ALA 20 CO 0.01 -0.19 2.12 -0.39 0.00 0.00 0.00 175.76 177.32 3gb1 h VAL 21 N 4.40 0.73 -3.05 0.00 -1.51 -1.98 -3.22 116.25 111.63 3gb1 h VAL 21 Ca -0.27 -0.34 -0.00 0.00 -1.23 0.00 0.00 66.70 64.86 3gb1 h VAL 21 Cb 1.18 1.20 -0.02 0.00 -2.13 0.00 0.00 31.29 31.53 3gb1 h VAL 21 CO 0.33 0.08 0.24 1.51 -1.23 0.00 0.00 177.57 178.51 3gb1 s ASP 22 N -6.45 -0.04 0.21 4.19 -4.77 -1.26 -4.65 116.67 103.90 3gb1 s ASP 22 Ca -0.04 -1.01 -0.04 0.00 -3.30 0.00 0.00 52.55 48.16 3gb1 s ASP 22 Cb 0.15 0.81 0.17 0.00 -1.09 0.00 0.00 42.92 42.96 3gb1 s ASP 22 CO 0.61 -1.58 1.60 0.00 0.70 0.00 0.00 175.17 176.50 3gb1 h ALA 23 N 2.01 0.84 -0.95 2.11 0.00 -1.96 -2.97 119.26 118.34 3gb1 h ALA 23 Ca -0.28 -0.40 0.15 0.00 0.00 0.00 0.00 54.91 54.38 3gb1 h ALA 23 Cb 1.25 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 3gb1 h ALA 23 CO 0.36 0.64 0.60 0.00 0.00 0.00 0.00 179.25 180.85 3gb1 h ALA 24 N 1.05 1.75 -0.14 0.00 0.00 -1.99 0.23 119.26 120.16 3gb1 h ALA 24 Ca 0.08 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 3gb1 h ALA 24 Cb 0.80 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3gb1 h ALA 24 CO 0.07 -0.03 -0.64 1.79 0.00 0.00 0.00 179.25 180.44 3gb1 h THR 25 N 0.76 1.34 -0.96 0.00 1.35 -1.94 -3.08 112.91 110.38 3gb1 h THR 25 Ca 0.49 -1.94 -0.00 0.00 -0.55 0.00 0.00 66.41 64.41 3gb1 h THR 25 Cb 0.74 1.91 -0.05 0.00 -1.73 0.00 0.00 68.15 69.03 3gb1 h THR 25 CO -0.26 0.60 0.59 0.00 -0.25 0.00 0.00 175.52 176.20 3gb1 h ALA 26 N 0.92 1.22 -0.19 6.62 0.00 -0.89 -1.91 119.26 125.02 3gb1 h ALA 26 Ca -0.01 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3gb1 h ALA 26 Cb 1.20 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 3gb1 h ALA 26 CO 0.12 0.66 -0.05 0.93 0.00 0.00 0.00 179.25 180.91 3gb1 h GLU 27 N 1.32 -0.00 -0.67 0.00 5.08 -1.19 0.16 114.58 119.28 3gb1 h GLU 27 Ca 0.34 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.63 3gb1 h GLU 27 Cb -0.07 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 3gb1 h GLU 27 CO -0.07 -0.00 0.11 0.87 -1.00 0.00 0.00 179.01 178.92 3gb1 h LYS 28 N -0.00 1.11 0.21 2.33 1.57 -1.52 -1.85 116.57 118.42 3gb1 h LYS 28 Ca 0.09 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 3gb1 h LYS 28 Cb 0.14 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3gb1 h LYS 28 CO -0.20 1.02 -0.10 0.28 -0.57 0.00 0.00 179.45 179.88 3gb1 h VAL 29 N 1.04 0.83 -0.72 0.50 2.07 -0.86 -2.81 116.25 116.30 3gb1 h VAL 29 Ca 0.20 -0.90 -0.06 0.00 0.82 0.00 0.00 66.70 66.77 3gb1 h VAL 29 Cb 0.44 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 3gb1 h VAL 29 CO 0.01 0.18 0.21 -0.26 0.02 0.00 0.00 177.57 177.74 3gb1 h PHE 30 N -0.78 1.16 -0.83 1.57 0.04 -0.75 -1.18 116.94 116.17 3gb1 h PHE 30 Ca -0.03 -0.12 -0.04 0.00 2.80 0.00 0.00 57.97 60.59 3gb1 h PHE 30 Cb 0.51 -0.33 -0.04 0.00 2.20 0.00 0.00 35.95 38.29 3gb1 h PHE 30 CO 0.06 0.92 0.37 0.87 -0.60 0.00 0.00 178.31 179.93 3gb1 h LYS 31 N 1.07 1.22 -0.30 1.51 1.57 -1.41 0.99 116.57 121.21 3gb1 h LYS 31 Ca 0.23 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 3gb1 h LYS 31 Cb 0.31 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3gb1 h LYS 31 CO -0.01 0.95 -0.25 0.37 -0.57 0.00 0.00 179.45 179.94 3gb1 h GLN 32 N 1.19 0.71 -0.40 3.15 4.15 -1.23 -0.20 115.11 122.47 3gb1 h GLN 32 Ca 0.28 -0.36 0.00 0.00 0.77 0.00 0.00 58.65 59.35 3gb1 h GLN 32 Cb 0.16 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 3gb1 h GLN 32 CO -0.03 0.97 0.27 -0.92 -1.93 0.00 0.00 178.83 177.18 3gb1 h TYR 33 N 0.46 0.51 -0.53 3.99 3.20 -0.85 0.22 116.97 123.96 3gb1 h TYR 33 Ca 0.05 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 3gb1 h TYR 33 Cb 0.82 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 3gb1 h TYR 33 CO 0.07 0.32 0.27 0.00 -1.64 0.00 0.00 178.16 177.17 3gb1 h ALA 34 N 1.15 0.69 -0.52 1.82 0.00 -0.72 -1.88 119.26 119.80 3gb1 h ALA 34 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3gb1 h ALA 34 Cb -0.06 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3gb1 h ALA 34 CO -0.03 0.24 0.34 -0.97 0.00 0.00 0.00 179.25 178.83 3gb1 h ASN 35 N 0.71 0.60 0.27 0.00 -0.73 -0.34 0.20 115.58 116.28 3gb1 h ASN 35 Ca 0.18 -0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.32 3gb1 h ASN 35 Cb 0.10 -0.15 -0.00 0.00 0.27 0.00 0.00 38.32 38.54 3gb1 h ASN 35 CO -0.03 0.44 -0.07 0.44 -0.37 0.00 0.00 177.43 177.85 3gb1 h ASP 36 N 0.70 0.00 -0.47 1.15 3.32 -0.21 -0.65 116.42 120.27 3gb1 h ASP 36 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3gb1 h ASP 36 Cb -0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3gb1 h ASP 36 CO -0.04 0.07 0.00 0.59 -1.72 0.00 0.00 179.24 178.14 3gb1 n ASN 37 N -3.58 3.08 -1.52 6.45 5.03 -0.44 -4.92 115.26 119.36 3gb1 n ASN 37 Ca -0.02 -1.96 -0.12 0.00 0.87 0.00 0.00 54.58 53.35 3gb1 n ASN 37 Cb 0.18 -0.31 0.00 0.00 -1.02 0.00 0.00 39.78 38.64 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 1.43 -0.08 3.47 7.41 0.00 -0.25 -5.00 105.19 112.16 3gb1 n GLY 38 Ca 0.19 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.70 3.97 0.01 1.61 1.01 0.56 -5.00 120.40 119.86 3gb1 s VAL 39 Ca 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 3gb1 s VAL 39 Cb -0.03 -2.78 -0.01 0.00 0.00 0.00 0.00 36.38 33.56 3gb1 s VAL 39 CO 0.07 0.44 0.01 -0.62 0.00 0.00 0.00 175.10 175.00 3gb1 s ASP 40 N 0.84 0.12 0.00 3.32 -1.08 -1.26 -3.96 116.67 114.65 3gb1 s ASP 40 Ca 0.00 -0.28 0.00 0.00 -0.52 0.00 0.00 52.55 51.76 3gb1 s ASP 40 Cb -0.14 0.10 0.00 0.00 -1.46 0.00 0.00 42.92 41.41 3gb1 s ASP 40 CO 0.02 -0.21 0.00 0.61 0.52 0.00 0.00 175.17 176.11 3gb1 n GLY 41 N 2.09 -0.66 3.76 2.66 0.00 -1.26 -4.34 105.19 107.44 3gb1 n GLY 41 Ca -0.20 -0.52 -0.38 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.64 4.25 -0.14 1.61 2.02 -0.95 -4.88 118.70 119.97 3gb1 s GLU 42 Ca 0.00 0.59 -0.07 0.00 0.02 0.00 0.00 54.97 55.51 3gb1 s GLU 42 Cb 0.00 -3.35 -0.04 0.00 0.10 0.00 0.00 34.13 30.84 3gb1 s GLU 42 CO 0.00 0.36 0.11 -1.58 0.02 0.00 0.00 175.26 174.17 3gb1 s TRP 43 N -0.10 3.44 0.04 1.61 0.52 -1.26 -2.69 118.94 120.50 3gb1 s TRP 43 Ca 0.28 0.37 0.03 0.00 0.02 0.00 0.00 56.10 56.79 3gb1 s TRP 43 Cb -0.17 -2.00 -0.02 0.00 -1.15 0.00 0.00 33.47 30.13 3gb1 s TRP 43 CO 0.14 0.50 -0.09 0.95 0.02 0.00 0.00 176.95 178.48 3gb1 s THR 44 N -0.45 0.64 -0.02 2.01 -4.23 -0.65 -5.00 115.64 107.94 3gb1 s THR 44 Ca 0.11 -1.05 0.02 0.00 -1.18 0.00 0.00 61.69 59.59 3gb1 s THR 44 Cb -0.12 -0.67 0.01 0.00 1.34 0.00 0.00 72.50 73.06 3gb1 s THR 44 CO 0.02 -0.31 -0.05 -0.47 -0.54 0.00 0.00 174.62 173.27 3gb1 s TYR 45 N -1.25 0.57 -0.31 3.99 5.04 -1.26 -1.30 117.35 122.82 3gb1 s TYR 45 Ca -0.08 -0.12 -0.04 0.00 -2.44 0.00 0.00 57.07 54.40 3gb1 s TYR 45 Cb -0.09 -0.44 0.05 0.00 0.35 0.00 0.00 41.96 41.83 3gb1 s TYR 45 CO 0.01 -0.07 0.04 0.34 -1.34 0.00 0.00 175.55 174.53 3gb1 s ASP 46 N 0.26 5.05 0.38 4.32 -1.08 -0.74 -4.97 116.67 119.88 3gb1 s ASP 46 Ca -0.03 -1.22 0.10 0.00 -0.52 0.00 0.00 52.55 50.88 3gb1 s ASP 46 Cb -0.07 -1.77 0.75 0.00 -1.46 0.00 0.00 42.92 40.37 3gb1 s ASP 46 CO -0.00 -0.28 1.87 -0.78 0.52 0.00 0.00 175.17 176.50 3gb1 h ASP 47 N 8.08 0.14 -0.72 -0.34 1.82 -1.96 0.71 116.42 124.16 3gb1 h ASP 47 Ca -0.22 -0.04 -0.07 0.00 -0.39 0.00 0.00 57.03 56.31 3gb1 h ASP 47 Cb 1.07 -0.04 -0.03 0.00 0.68 0.00 0.00 39.33 41.01 3gb1 h ASP 47 CO 0.56 0.39 0.17 0.00 -1.61 0.00 0.00 179.24 178.75 3gb1 h ALA 48 N 1.63 0.94 -0.02 -0.78 0.00 -1.98 -3.12 119.26 115.94 3gb1 h ALA 48 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3gb1 h ALA 48 Cb 0.50 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3gb1 h ALA 48 CO 0.03 0.67 -0.01 0.25 0.00 0.00 0.00 179.25 180.20 3gb1 n THR 49 N -4.23 0.00 -4.05 0.00 -2.24 -1.08 -4.97 114.28 97.71 3gb1 n THR 49 Ca 0.05 -0.50 -0.32 0.00 -2.27 0.00 0.00 64.05 61.01 3gb1 n THR 49 Cb 0.26 1.33 -0.00 0.00 -2.10 0.00 0.00 70.33 69.82 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 0.88 -4.29 -5.23 -0.78 5.02 0.25 -4.78 118.16 109.23 3gb1 n LYS 50 Ca 0.09 0.48 -0.32 0.00 -2.02 0.00 0.00 58.31 56.55 3gb1 n LYS 50 Cb 0.40 -5.23 -0.17 0.00 -0.02 0.00 0.00 35.03 30.01 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 2.06 -0.11 -0.18 2.01 -1.08 -2.68 115.64 112.30 3gb1 s THR 51 Ca 0.63 -1.03 -0.07 0.00 0.31 0.00 0.00 61.69 61.52 3gb1 s THR 51 Cb -0.33 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.37 3gb1 s THR 51 CO 0.88 0.56 0.16 -0.36 -0.69 0.00 0.00 174.62 175.16 3gb1 s PHE 52 N 0.25 3.61 -0.05 4.92 0.40 0.29 -1.80 117.98 125.60 3gb1 s PHE 52 Ca -0.16 0.56 0.02 0.00 -0.60 0.00 0.00 56.93 56.75 3gb1 s PHE 52 Cb -0.17 -1.96 0.01 0.00 0.51 0.00 0.00 43.02 41.41 3gb1 s PHE 52 CO 0.08 0.73 -0.10 0.99 0.70 0.00 0.00 175.22 177.62 3gb1 s THR 53 N -1.03 0.96 -0.10 0.64 2.01 -0.42 -2.04 115.64 115.66 3gb1 s THR 53 Ca 0.15 -0.40 0.03 0.00 0.31 0.00 0.00 61.69 61.79 3gb1 s THR 53 Cb -0.12 -0.88 0.01 0.00 0.01 0.00 0.00 72.50 71.51 3gb1 s THR 53 CO 0.05 0.31 -0.21 0.54 -0.69 0.00 0.00 174.62 174.62 3gb1 s VAL 54 N 0.57 1.83 -0.12 3.82 0.11 -1.19 -1.63 120.40 123.79 3gb1 s VAL 54 Ca -0.11 -0.87 0.03 0.00 -2.93 0.00 0.00 61.98 58.10 3gb1 s VAL 54 Cb -0.14 -1.60 0.00 0.00 -1.53 0.00 0.00 36.38 33.12 3gb1 s VAL 54 CO 0.02 0.51 -0.23 -0.89 -3.33 0.00 0.00 175.10 171.18 3gb1 s THR 55 N 0.52 2.07 -2.13 5.04 2.01 -1.09 -3.13 115.64 118.92 3gb1 s THR 55 Ca -0.16 -1.00 0.31 0.00 0.31 0.00 0.00 61.69 61.15 3gb1 s THR 55 Cb -0.17 -1.80 0.81 0.00 0.01 0.00 0.00 72.50 71.35 3gb1 s THR 55 CO 0.06 0.56 2.10 -0.62 -0.69 0.00 0.00 174.62 176.02