#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 5.18 0.05 2.03 2.01 -1.26 -2.24 115.64 121.41 3gb1 s THR 2 Ca 0.00 0.90 0.06 0.00 0.31 0.00 0.00 61.69 62.95 3gb1 s THR 2 Cb 0.00 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 3gb1 s THR 2 CO 0.00 0.37 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.88 3gb1 s TYR 3 N 0.39 2.76 -0.00 4.92 2.02 -0.72 -4.95 117.35 121.77 3gb1 s TYR 3 Ca 0.25 -0.13 0.06 0.00 -0.37 0.00 0.00 57.07 56.87 3gb1 s TYR 3 Cb -0.15 -1.50 -0.03 0.00 -0.40 0.00 0.00 41.96 39.88 3gb1 s TYR 3 CO 0.10 0.37 -0.17 0.21 -1.57 0.00 0.00 175.55 174.49 3gb1 s LYS 4 N -1.76 2.25 -0.10 -0.62 2.20 -1.05 -2.12 119.74 118.54 3gb1 s LYS 4 Ca 0.19 -0.86 0.03 0.00 -0.36 0.00 0.00 55.97 54.97 3gb1 s LYS 4 Cb -0.11 -2.25 0.01 0.00 -1.51 0.00 0.00 37.83 33.97 3gb1 s LYS 4 CO 0.10 0.58 -0.20 -1.17 -0.36 0.00 0.00 175.35 174.29 3gb1 s LEU 5 N -1.04 1.95 -0.21 5.43 2.96 -0.50 -0.17 118.68 127.09 3gb1 s LEU 5 Ca 0.13 -0.50 -0.06 0.00 -0.22 0.00 0.00 54.13 53.47 3gb1 s LEU 5 Cb -0.10 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.29 3gb1 s LEU 5 CO 0.03 0.10 0.04 -0.63 -1.32 0.00 0.00 176.35 174.56 3gb1 s ILE 6 N 0.61 4.25 -0.34 6.68 1.01 -0.95 -1.94 121.20 130.52 3gb1 s ILE 6 Ca -0.13 -0.21 -0.12 0.00 0.00 0.00 0.00 60.65 60.19 3gb1 s ILE 6 Cb -0.17 -2.94 -0.01 0.00 0.01 0.00 0.00 42.46 39.35 3gb1 s ILE 6 CO 0.04 0.40 0.22 -0.76 0.00 0.00 0.00 174.94 174.84 3gb1 s LEU 7 N 1.08 4.46 -0.69 2.97 1.43 0.50 -3.12 118.68 125.32 3gb1 s LEU 7 Ca 0.03 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.66 3gb1 s LEU 7 Cb -0.14 -2.10 0.28 0.00 0.03 0.00 0.00 46.19 44.26 3gb1 s LEU 7 CO 0.02 -0.25 0.91 0.59 0.23 0.00 0.00 176.35 177.86 3gb1 n ASN 8 N 5.07 4.34 -4.66 2.29 3.02 -1.16 -2.25 115.26 121.91 3gb1 n ASN 8 Ca -0.13 -3.50 -0.29 0.00 -0.03 0.00 0.00 54.58 50.63 3gb1 n ASN 8 Cb 0.49 -0.73 0.12 0.00 -0.61 0.00 0.00 39.78 39.05 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 -2.58 1.65 0.20 7.41 0.00 0.16 -3.50 107.32 110.66 3gb1 s GLY 9 Ca 0.41 -0.82 -0.07 0.00 0.00 0.00 0.00 44.72 44.23 3gb1 s GLY 9 CO -0.03 -0.25 1.67 0.50 0.00 0.00 0.00 173.10 175.00 3gb1 h LYS 10 N -1.24 0.99 0.00 2.90 1.57 -1.97 -3.34 116.57 115.47 3gb1 h LYS 10 Ca -0.45 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.02 3gb1 h LYS 10 Cb 1.30 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.51 3gb1 h LYS 10 CO 0.57 0.98 -0.63 -2.37 -0.57 0.00 0.00 179.45 177.43 3gb1 n THR 11 N -4.18 0.00 -3.52 -0.16 5.66 -1.26 -4.99 114.28 105.83 3gb1 n THR 11 Ca 0.03 -0.10 -0.39 0.00 -3.05 0.00 0.00 64.05 60.53 3gb1 n THR 11 Cb 0.34 0.56 -0.10 0.00 -1.55 0.00 0.00 70.33 69.57 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 -2.30 4.30 -0.06 1.09 2.96 -1.26 -5.06 118.68 118.36 3gb1 s LEU 12 Ca 0.00 -0.20 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 3gb1 s LEU 12 Cb 0.00 -2.18 0.02 0.00 0.50 0.00 0.00 46.19 44.53 3gb1 s LEU 12 CO 0.00 -0.18 -0.08 -0.54 -1.32 0.00 0.00 176.35 174.23 3gb1 s LYS 13 N 1.80 1.25 0.00 1.98 1.02 -1.26 0.39 119.74 124.92 3gb1 s LYS 13 Ca 0.08 -0.24 0.00 0.00 0.02 0.00 0.00 55.97 55.82 3gb1 s LYS 13 Cb -0.17 -1.15 0.00 0.00 -0.52 0.00 0.00 37.83 36.00 3gb1 s LYS 13 CO 0.11 -0.06 0.00 0.41 -0.92 0.00 0.00 175.35 174.89 3gb1 n GLY 14 N 4.05 -1.25 3.23 -3.33 0.00 -0.95 -5.01 105.19 101.92 3gb1 n GLY 14 Ca -0.22 -0.94 -0.11 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.14 0.81 0.27 1.61 -1.05 -1.26 -0.37 118.70 117.57 3gb1 s GLU 15 Ca 0.00 -0.64 -0.14 0.00 -0.15 0.00 0.00 54.97 54.03 3gb1 s GLU 15 Cb 0.00 0.35 0.01 0.00 -0.44 0.00 0.00 34.13 34.04 3gb1 s GLU 15 CO 0.00 -0.26 0.56 -0.08 0.95 0.00 0.00 175.26 176.43 3gb1 s THR 16 N -2.93 0.00 0.08 1.83 -1.32 -0.82 -5.00 115.64 107.48 3gb1 s THR 16 Ca -0.02 -1.29 0.01 0.00 -1.21 0.00 0.00 61.69 59.18 3gb1 s THR 16 Cb 0.01 -2.23 -0.04 0.00 -1.51 0.00 0.00 72.50 68.73 3gb1 s THR 16 CO -0.06 0.00 -0.05 0.42 -2.21 0.00 0.00 174.62 172.72 3gb1 s THR 17 N -3.81 0.55 0.12 5.08 -4.23 -1.26 -1.42 115.64 110.67 3gb1 s THR 17 Ca 0.20 -1.90 -0.18 0.00 -1.18 0.00 0.00 61.69 58.63 3gb1 s THR 17 Cb -0.02 -1.63 0.04 0.00 1.34 0.00 0.00 72.50 72.23 3gb1 s THR 17 CO 0.09 -0.91 0.44 0.28 -0.54 0.00 0.00 174.62 173.98 3gb1 s THR 18 N -3.71 0.06 -0.17 3.99 -1.32 -0.90 -5.00 115.64 108.58 3gb1 s THR 18 Ca 0.10 -0.45 -0.07 0.00 -1.21 0.00 0.00 61.69 60.06 3gb1 s THR 18 Cb 0.06 -1.12 -0.04 0.00 -1.51 0.00 0.00 72.50 69.89 3gb1 s THR 18 CO -0.06 -0.25 0.08 -1.61 -2.21 0.00 0.00 174.62 170.57 3gb1 s GLU 19 N -3.69 3.85 -0.07 7.08 0.41 -1.26 -1.76 118.70 123.26 3gb1 s GLU 19 Ca 0.02 -0.29 -0.11 0.00 -0.41 0.00 0.00 54.97 54.18 3gb1 s GLU 19 Cb 0.01 -3.21 0.02 0.00 -1.78 0.00 0.00 34.13 29.17 3gb1 s GLU 19 CO -0.11 0.40 0.28 0.00 -0.49 0.00 0.00 175.26 175.33 3gb1 s ALA 20 N 0.04 -0.69 0.49 5.21 0.00 -0.95 -5.00 121.76 120.85 3gb1 s ALA 20 Ca 0.07 0.58 0.22 0.00 0.00 0.00 0.00 51.96 52.83 3gb1 s ALA 20 Cb -0.12 -0.26 1.39 0.00 0.00 0.00 0.00 23.12 24.13 3gb1 s ALA 20 CO 0.00 -0.18 2.11 -0.39 0.00 0.00 0.00 175.76 177.31 3gb1 h VAL 21 N 4.42 0.79 -3.17 0.00 -1.51 -1.98 -3.33 116.25 111.46 3gb1 h VAL 21 Ca -0.28 -0.34 0.01 0.00 -1.23 0.00 0.00 66.70 64.87 3gb1 h VAL 21 Cb 1.19 1.20 -0.05 0.00 -2.13 0.00 0.00 31.29 31.50 3gb1 h VAL 21 CO 0.35 0.09 0.16 1.51 -1.23 0.00 0.00 177.57 178.45 3gb1 s ASP 22 N -6.54 -0.12 0.21 4.19 -4.77 -1.26 -4.83 116.67 103.55 3gb1 s ASP 22 Ca -0.04 -0.82 -0.05 0.00 -3.30 0.00 0.00 52.55 48.34 3gb1 s ASP 22 Cb 0.15 0.73 0.19 0.00 -1.09 0.00 0.00 42.92 42.89 3gb1 s ASP 22 CO 0.62 -1.38 1.64 0.00 0.70 0.00 0.00 175.17 176.75 3gb1 h ALA 23 N 2.05 0.88 -0.91 2.11 0.00 -1.97 -2.90 119.26 118.53 3gb1 h ALA 23 Ca -0.23 -0.36 0.16 0.00 0.00 0.00 0.00 54.91 54.47 3gb1 h ALA 23 Cb 1.25 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 3gb1 h ALA 23 CO 0.30 0.63 0.58 0.00 0.00 0.00 0.00 179.25 180.76 3gb1 h ALA 24 N 1.08 1.86 -0.07 0.00 0.00 -1.99 0.72 119.26 120.86 3gb1 h ALA 24 Ca 0.10 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 3gb1 h ALA 24 Cb 0.71 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3gb1 h ALA 24 CO 0.05 -0.13 -0.72 1.79 0.00 0.00 0.00 179.25 180.25 3gb1 h THR 25 N 0.67 1.39 -1.00 0.00 1.35 -1.93 -3.05 112.91 110.33 3gb1 h THR 25 Ca 0.47 -2.15 0.01 0.00 -0.55 0.00 0.00 66.41 64.19 3gb1 h THR 25 Cb 0.80 2.12 -0.05 0.00 -1.73 0.00 0.00 68.15 69.29 3gb1 h THR 25 CO -0.22 0.64 0.66 0.00 -0.25 0.00 0.00 175.52 176.36 3gb1 h ALA 26 N 0.99 1.29 -0.50 6.62 0.00 -0.77 -0.44 119.26 126.44 3gb1 h ALA 26 Ca -0.03 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.85 3gb1 h ALA 26 Cb 1.28 -0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 3gb1 h ALA 26 CO 0.12 0.66 0.26 0.93 0.00 0.00 0.00 179.25 181.23 3gb1 h GLU 27 N 1.36 0.50 -0.40 0.00 5.08 -1.23 0.51 114.58 120.40 3gb1 h GLU 27 Ca 0.37 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.61 3gb1 h GLU 27 Cb -0.16 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 3gb1 h GLU 27 CO -0.08 0.33 -0.08 0.87 -1.00 0.00 0.00 179.01 179.05 3gb1 h LYS 28 N 0.52 0.76 0.25 2.33 1.57 -1.38 -0.92 116.57 119.70 3gb1 h LYS 28 Ca 0.21 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 3gb1 h LYS 28 Cb 0.10 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3gb1 h LYS 28 CO -0.14 0.89 -0.12 0.28 -0.57 0.00 0.00 179.45 179.79 3gb1 h VAL 29 N 0.58 0.76 -0.72 0.50 2.07 -0.57 -2.56 116.25 116.32 3gb1 h VAL 29 Ca 0.10 -0.76 -0.05 0.00 0.82 0.00 0.00 66.70 66.82 3gb1 h VAL 29 Cb 0.60 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 3gb1 h VAL 29 CO 0.04 0.15 0.25 -0.26 0.02 0.00 0.00 177.57 177.77 3gb1 h PHE 30 N -0.77 1.11 -0.73 1.57 0.04 -0.07 -0.43 116.94 117.66 3gb1 h PHE 30 Ca -0.03 -0.09 -0.00 0.00 2.80 0.00 0.00 57.97 60.64 3gb1 h PHE 30 Cb 0.50 -0.33 -0.04 0.00 2.20 0.00 0.00 35.95 38.29 3gb1 h PHE 30 CO 0.04 0.86 0.44 -0.22 -0.60 0.00 0.00 178.31 178.83 3gb1 h LYS 31 N 1.05 0.98 -0.31 1.51 3.64 -1.20 0.36 116.57 122.60 3gb1 h LYS 31 Ca 0.24 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.41 3gb1 h LYS 31 Cb 0.25 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3gb1 h LYS 31 CO -0.01 0.69 -0.28 0.37 -2.27 0.00 0.00 179.45 177.95 3gb1 h GLN 32 N 0.99 0.73 -0.51 1.90 4.15 -1.12 -0.92 115.11 120.33 3gb1 h GLN 32 Ca 0.26 -0.38 0.01 0.00 0.77 0.00 0.00 58.65 59.31 3gb1 h GLN 32 Cb -0.04 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.63 3gb1 h GLN 32 CO -0.05 1.00 0.34 -0.92 -1.93 0.00 0.00 178.83 177.27 3gb1 h TYR 33 N 0.49 0.64 -0.58 3.99 5.03 -0.62 -0.23 116.97 125.69 3gb1 h TYR 33 Ca 0.05 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.35 3gb1 h TYR 33 Cb 0.85 -0.22 -0.03 0.00 1.55 0.00 0.00 36.73 38.89 3gb1 h TYR 33 CO 0.07 0.40 0.24 0.00 -1.32 0.00 0.00 178.16 177.55 3gb1 h ALA 34 N 1.19 0.75 -1.00 1.82 0.00 -0.18 -2.24 119.26 119.60 3gb1 h ALA 34 Ca 0.19 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3gb1 h ALA 34 Cb -0.08 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 3gb1 h ALA 34 CO -0.04 0.35 0.66 -0.91 0.00 0.00 0.00 179.25 179.31 3gb1 h ASN 35 N 0.79 1.15 0.24 0.00 2.35 -0.56 0.54 115.58 120.10 3gb1 h ASN 35 Ca 0.19 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 3gb1 h ASN 35 Cb 0.19 -0.29 -0.00 0.00 0.05 0.00 0.00 38.32 38.27 3gb1 h ASN 35 CO -0.02 0.84 -0.06 0.44 -1.65 0.00 0.00 177.43 176.98 3gb1 h ASP 36 N 1.35 0.00 -0.53 5.81 3.32 -0.49 -1.29 116.42 124.59 3gb1 h ASP 36 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 3gb1 h ASP 36 Cb -0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.40 3gb1 h ASP 36 CO -0.08 0.06 0.00 0.59 -1.72 0.00 0.00 179.24 178.10 3gb1 n ASN 37 N -3.62 3.57 -1.66 6.45 3.02 0.08 -4.95 115.26 118.16 3gb1 n ASN 37 Ca -0.02 -1.99 -0.11 0.00 -0.03 0.00 0.00 54.58 52.43 3gb1 n ASN 37 Cb 0.17 -0.35 0.02 0.00 -0.61 0.00 0.00 39.78 39.01 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 1.56 0.09 3.37 7.41 0.00 -0.49 -5.02 105.19 112.11 3gb1 n GLY 38 Ca 0.21 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.88 3.39 -0.30 1.61 1.01 -0.58 -5.02 120.40 117.64 3gb1 s VAL 39 Ca 0.16 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.64 3gb1 s VAL 39 Cb -0.07 -2.50 0.14 0.00 0.00 0.00 0.00 36.38 33.96 3gb1 s VAL 39 CO 0.20 0.47 0.33 -1.81 0.00 0.00 0.00 175.10 174.29 3gb1 s ASP 40 N 0.90 1.31 0.00 3.32 1.01 -1.26 -4.20 116.67 117.76 3gb1 s ASP 40 Ca -0.01 -0.77 0.00 0.00 0.71 0.00 0.00 52.55 52.47 3gb1 s ASP 40 Cb -0.15 0.66 0.00 0.00 1.01 0.00 0.00 42.92 44.44 3gb1 s ASP 40 CO 0.01 -0.37 0.00 0.61 0.21 0.00 0.00 175.17 175.63 3gb1 n GLY 41 N 5.19 4.22 3.73 0.21 0.00 -1.26 -4.91 105.19 112.36 3gb1 n GLY 41 Ca 0.00 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 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 4.68 4.37 -0.08 1.61 2.02 -0.96 -4.92 118.70 125.43 3gb1 s GLU 42 Ca 0.00 0.71 -0.01 0.00 0.02 0.00 0.00 54.97 55.69 3gb1 s GLU 42 Cb 0.00 -3.41 -0.03 0.00 0.10 0.00 0.00 34.13 30.79 3gb1 s GLU 42 CO 0.00 0.19 -0.02 -1.58 0.02 0.00 0.00 175.26 173.86 3gb1 s TRP 43 N 0.44 3.07 0.04 1.61 0.52 -1.26 -2.17 118.94 121.19 3gb1 s TRP 43 Ca 0.32 0.10 0.02 0.00 0.02 0.00 0.00 56.10 56.56 3gb1 s TRP 43 Cb -0.17 -1.77 -0.02 0.00 -1.15 0.00 0.00 33.47 30.35 3gb1 s TRP 43 CO 0.16 0.39 -0.07 0.95 0.02 0.00 0.00 176.95 178.39 3gb1 s THR 44 N -0.77 0.47 -0.02 2.01 -4.23 -0.23 -4.99 115.64 107.87 3gb1 s THR 44 Ca 0.12 -1.05 0.02 0.00 -1.18 0.00 0.00 61.69 59.60 3gb1 s THR 44 Cb -0.11 -0.55 0.00 0.00 1.34 0.00 0.00 72.50 73.18 3gb1 s THR 44 CO 0.02 -0.40 -0.07 -0.47 -0.54 0.00 0.00 174.62 173.16 3gb1 s TYR 45 N -1.39 0.76 -0.31 3.99 5.04 -1.26 -0.95 117.35 123.23 3gb1 s TYR 45 Ca -0.11 -0.18 -0.02 0.00 -2.44 0.00 0.00 57.07 54.32 3gb1 s TYR 45 Cb -0.10 -0.56 0.05 0.00 0.35 0.00 0.00 41.96 41.70 3gb1 s TYR 45 CO 0.00 -0.08 0.02 0.34 -1.34 0.00 0.00 175.55 174.48 3gb1 s ASP 46 N 0.22 4.95 0.37 4.32 -1.08 -0.61 -4.97 116.67 119.88 3gb1 s ASP 46 Ca -0.03 -1.27 0.14 0.00 -0.52 0.00 0.00 52.55 50.87 3gb1 s ASP 46 Cb -0.08 -1.73 0.74 0.00 -1.46 0.00 0.00 42.92 40.39 3gb1 s ASP 46 CO 0.00 -0.27 1.81 -0.78 0.52 0.00 0.00 175.17 176.45 3gb1 h ASP 47 N 8.03 0.00 -0.72 -0.34 1.82 -1.96 0.72 116.42 123.97 3gb1 h ASP 47 Ca -0.21 0.00 -0.07 0.00 -0.39 0.00 0.00 57.03 56.36 3gb1 h ASP 47 Cb 1.06 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.04 3gb1 h ASP 47 CO 0.54 0.38 0.18 0.00 -1.61 0.00 0.00 179.24 178.74 3gb1 h ALA 48 N 1.62 0.95 -0.05 -0.78 0.00 -1.98 -3.07 119.26 115.96 3gb1 h ALA 48 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3gb1 h ALA 48 Cb 0.70 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.22 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 -4.23 0.07 -4.02 0.00 -2.24 -1.11 -4.97 114.28 97.78 3gb1 n THR 49 Ca 0.05 -0.54 -0.31 0.00 -2.27 0.00 0.00 64.05 60.98 3gb1 n THR 49 Cb 0.26 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 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 -4.44 -5.24 -0.78 5.02 0.25 -4.78 118.16 109.07 3gb1 n LYS 50 Ca 0.10 0.50 -0.32 0.00 -2.02 0.00 0.00 58.31 56.57 3gb1 n LYS 50 Cb 0.40 -5.24 -0.17 0.00 -0.02 0.00 0.00 35.03 30.00 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 -3.38 2.05 -0.13 -0.18 2.01 -0.99 -2.54 115.64 112.49 3gb1 s THR 51 Ca 0.59 -1.04 -0.07 0.00 0.31 0.00 0.00 61.69 61.48 3gb1 s THR 51 Cb -0.31 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 3gb1 s THR 51 CO 0.87 0.56 0.14 -0.36 -0.69 0.00 0.00 174.62 175.14 3gb1 s PHE 52 N 0.09 3.59 -0.05 4.92 0.08 0.76 -1.58 117.98 125.80 3gb1 s PHE 52 Ca -0.11 0.52 0.02 0.00 0.12 0.00 0.00 56.93 57.48 3gb1 s PHE 52 Cb -0.16 -1.95 0.01 0.00 -0.57 0.00 0.00 43.02 40.35 3gb1 s PHE 52 CO 0.06 0.71 -0.10 0.99 -0.10 0.00 0.00 175.22 176.78 3gb1 s THR 53 N -0.94 0.97 -0.08 0.64 2.01 -0.13 -2.25 115.64 115.86 3gb1 s THR 53 Ca 0.15 -0.40 0.03 0.00 0.31 0.00 0.00 61.69 61.77 3gb1 s THR 53 Cb -0.12 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.51 3gb1 s THR 53 CO 0.04 0.31 -0.17 0.54 -0.69 0.00 0.00 174.62 174.64 3gb1 s VAL 54 N 0.57 1.55 -0.08 3.82 0.11 -1.18 -1.06 120.40 124.11 3gb1 s VAL 54 Ca -0.11 -0.72 0.03 0.00 -2.93 0.00 0.00 61.98 58.25 3gb1 s VAL 54 Cb -0.14 -1.37 0.01 0.00 -1.53 0.00 0.00 36.38 33.35 3gb1 s VAL 54 CO 0.02 0.45 -0.16 -0.89 -3.33 0.00 0.00 175.10 171.18 3gb1 s THR 55 N 0.52 1.49 -2.33 5.04 2.01 -0.92 -3.00 115.64 118.44 3gb1 s THR 55 Ca -0.17 -0.68 0.29 0.00 0.31 0.00 0.00 61.69 61.45 3gb1 s THR 55 Cb -0.17 -1.33 0.67 0.00 0.01 0.00 0.00 72.50 71.68 3gb1 s THR 55 CO 0.06 0.43 1.91 -0.62 -0.69 0.00 0.00 174.62 175.71