#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gbq s GLU 2 N 0.00 2.32 0.03 2.12 2.12 -1.09 -2.62 118.70 121.59 3gbq s GLU 2 Ca 0.00 -0.87 -0.02 0.00 0.36 0.00 0.00 54.97 54.44 3gbq s GLU 2 Cb 0.00 -2.38 -0.02 0.00 0.26 0.00 0.00 34.13 31.99 3gbq s GLU 2 CO 0.00 0.56 0.00 0.00 -0.54 0.00 0.00 175.26 175.28 3gbq s ALA 3 N -1.06 0.19 -0.14 6.30 0.00 -1.08 -1.13 121.76 124.84 3gbq s ALA 3 Ca 0.18 -0.75 -0.05 0.00 0.00 0.00 0.00 51.96 51.34 3gbq s ALA 3 Cb -0.11 0.20 0.07 0.00 0.00 0.00 0.00 23.12 23.28 3gbq s ALA 3 CO 0.09 -0.26 0.26 0.42 0.00 0.00 0.00 175.76 176.28 3gbq s ILE 4 N -2.42 -0.42 0.07 0.00 1.01 -0.37 -2.31 121.20 116.77 3gbq s ILE 4 Ca -0.07 0.23 -0.31 0.00 0.00 0.00 0.00 60.65 60.50 3gbq s ILE 4 Cb -0.03 -0.48 -0.07 0.00 0.01 0.00 0.00 42.46 41.89 3gbq s ILE 4 CO -0.04 0.08 1.45 0.00 0.00 0.00 0.00 174.94 176.43 3gbq s ALA 5 N 2.42 3.62 -0.13 9.38 0.00 -0.54 -1.54 121.76 134.96 3gbq s ALA 5 Ca 0.02 1.08 0.18 0.00 0.00 0.00 0.00 51.96 53.24 3gbq s ALA 5 Cb -0.13 -3.59 -0.23 0.00 0.00 0.00 0.00 23.12 19.17 3gbq s ALA 5 CO -0.09 -0.81 0.45 1.63 0.00 0.00 0.00 175.76 176.94 3gbq n LYS 6 N 4.71 0.66 -4.06 0.00 4.76 0.42 -1.16 118.16 123.49 3gbq n LYS 6 Ca 0.13 0.03 -0.08 0.00 -2.87 0.00 0.00 58.31 55.52 3gbq n LYS 6 Cb 0.42 -1.63 -0.09 0.00 -1.84 0.00 0.00 35.03 31.89 3gbq n LYS 6 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3gbq s TYR 7 N -2.90 0.53 0.49 2.13 1.51 -1.05 -4.83 117.35 113.23 3gbq s TYR 7 Ca -0.07 -1.02 -0.22 0.00 -1.01 0.00 0.00 57.07 54.76 3gbq s TYR 7 Cb 0.09 -0.34 -0.07 0.00 -0.11 0.00 0.00 41.96 41.53 3gbq s TYR 7 CO 0.84 -0.45 1.14 0.16 -1.11 0.00 0.00 175.55 176.13 3gbq s ASP 8 N -2.94 6.07 -0.01 2.29 1.47 -1.26 -3.56 116.67 118.73 3gbq s ASP 8 Ca 0.11 2.22 -0.01 0.00 1.18 0.00 0.00 52.55 56.05 3gbq s ASP 8 Cb 0.07 -2.59 0.00 0.00 -0.34 0.00 0.00 42.92 40.06 3gbq s ASP 8 CO -0.07 -0.98 0.03 0.12 0.68 0.00 0.00 175.17 174.95 3gbq s PHE 9 N -1.66 -0.03 -0.33 2.11 5.36 -0.85 -4.84 117.98 117.74 3gbq s PHE 9 Ca 0.66 0.08 0.03 0.00 -0.96 0.00 0.00 56.93 56.75 3gbq s PHE 9 Cb -0.26 0.01 0.10 0.00 -0.34 0.00 0.00 43.02 42.53 3gbq s PHE 9 CO 0.31 -0.02 0.04 0.15 -1.46 0.00 0.00 175.22 174.24 3gbq s LYS 10 N -0.01 1.45 0.71 10.12 -0.14 -1.26 -2.00 119.74 128.62 3gbq s LYS 10 Ca -0.00 -1.73 -0.16 0.00 -1.36 0.00 0.00 55.97 52.71 3gbq s LYS 10 Cb -0.00 -3.04 -0.04 0.00 -1.68 0.00 0.00 37.83 33.06 3gbq s LYS 10 CO 0.00 -0.91 0.51 0.00 -0.76 0.00 0.00 175.35 174.19 3gbq n ALA 11 N 4.34 -1.53 0.07 5.17 0.00 -1.26 -4.94 120.51 122.36 3gbq n ALA 11 Ca 0.02 -0.23 0.01 0.00 0.00 0.00 0.00 53.44 53.24 3gbq n ALA 11 Cb 0.42 -1.84 -0.01 0.00 0.00 0.00 0.00 19.45 18.02 3gbq n ALA 11 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3gbq n THR 12 N -2.33 0.00 -4.00 0.00 -2.24 -1.26 -5.01 114.28 99.44 3gbq n THR 12 Ca 0.10 -0.33 -0.09 0.00 -2.27 0.00 0.00 64.05 61.46 3gbq n THR 12 Cb 0.50 0.83 -0.05 0.00 -2.10 0.00 0.00 70.33 69.51 3gbq n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gbq s ALA 13 N -1.48 -0.23 0.50 6.98 0.00 -1.26 -5.05 121.76 121.21 3gbq s ALA 13 Ca 0.00 -0.89 0.22 0.00 0.00 0.00 0.00 51.96 51.30 3gbq s ALA 13 Cb 0.02 1.07 1.29 0.00 0.00 0.00 0.00 23.12 25.49 3gbq s ALA 13 CO 0.09 -0.86 1.98 0.22 0.00 0.00 0.00 175.76 177.20 3gbq h ASP 14 N 2.25 0.11 0.13 0.00 3.58 -2.03 -1.83 116.42 118.64 3gbq h ASP 14 Ca -0.26 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.19 3gbq h ASP 14 Cb 1.25 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.28 3gbq h ASP 14 CO 0.35 0.06 -0.19 -0.90 -2.88 0.00 0.00 179.24 175.69 3gbq n ASP 15 N -4.41 1.32 -4.68 2.28 5.68 -1.26 -4.89 116.55 110.58 3gbq n ASP 15 Ca 0.10 -1.16 -0.25 0.00 -0.50 0.00 0.00 54.79 52.99 3gbq n ASP 15 Cb 0.55 0.12 -0.07 0.00 -1.14 0.00 0.00 41.12 40.58 3gbq n ASP 15 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 3gbq s GLU 16 N -2.33 2.44 0.05 0.11 2.02 -0.69 -0.95 118.70 119.35 3gbq s GLU 16 Ca 0.28 -1.20 0.02 0.00 0.02 0.00 0.00 54.97 54.09 3gbq s GLU 16 Cb 0.20 -2.32 -0.03 0.00 0.10 0.00 0.00 34.13 32.08 3gbq s GLU 16 CO 0.46 0.42 -0.08 -0.48 0.02 0.00 0.00 175.26 175.60 3gbq s LEU 17 N -3.31 2.28 0.67 1.80 0.05 -1.07 -4.75 118.68 114.35 3gbq s LEU 17 Ca 0.29 -0.60 -0.09 0.00 0.05 0.00 0.00 54.13 53.78 3gbq s LEU 17 Cb -0.08 -0.16 0.02 0.00 -2.05 0.00 0.00 46.19 43.91 3gbq s LEU 17 CO 0.20 -0.23 1.02 -0.44 -0.55 0.00 0.00 176.35 176.35 3gbq s SER 18 N -1.75 5.45 0.31 1.48 0.01 -1.26 -4.50 113.70 113.44 3gbq s SER 18 Ca -0.07 0.94 -0.18 0.00 1.31 0.00 0.00 55.95 57.94 3gbq s SER 18 Cb -0.08 -1.79 0.06 0.00 0.21 0.00 0.00 66.02 64.41 3gbq s SER 18 CO -0.00 -1.26 0.85 0.72 0.41 0.00 0.00 173.24 173.95 3gbq s PHE 19 N -3.22 0.05 0.04 2.43 -0.71 -0.84 -4.99 117.98 110.74 3gbq s PHE 19 Ca 0.57 -0.62 0.04 0.00 -1.04 0.00 0.00 56.93 55.88 3gbq s PHE 19 Cb -0.11 0.78 -0.02 0.00 -1.21 0.00 0.00 43.02 42.46 3gbq s PHE 19 CO 0.49 -1.34 -0.11 0.15 -1.34 0.00 0.00 175.22 173.07 3gbq s LYS 20 N -2.55 0.71 -0.70 1.99 1.02 -1.26 -2.01 119.74 116.93 3gbq s LYS 20 Ca 0.16 -0.73 -0.31 0.00 0.02 0.00 0.00 55.97 55.11 3gbq s LYS 20 Cb -0.04 -0.63 -0.15 0.00 -0.52 0.00 0.00 37.83 36.48 3gbq s LYS 20 CO 0.09 0.14 2.49 -2.13 -0.92 0.00 0.00 175.35 175.03 3gbq n ARG 21 N 1.74 0.50 0.00 1.68 0.00 -1.23 -1.25 116.66 118.11 3gbq n ARG 21 Ca -0.20 0.05 0.00 0.00 -0.00 0.00 0.00 57.85 57.70 3gbq n ARG 21 Cb 0.55 -2.26 0.00 0.00 0.00 0.00 0.00 32.46 30.75 3gbq n ARG 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3gbq n GLY 22 N 6.42 1.30 3.51 5.14 0.00 -0.31 -4.93 105.19 116.33 3gbq n GLY 22 Ca 0.52 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.13 3gbq n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gbq n ASP 23 N 0.00 -0.15 -4.53 1.61 8.00 -0.38 -4.51 116.55 116.59 3gbq n ASP 23 Ca 0.00 0.92 -0.41 0.00 0.71 0.00 0.00 54.79 56.01 3gbq n ASP 23 Cb 0.00 -1.21 -0.10 0.00 -0.02 0.00 0.00 41.12 39.79 3gbq n ASP 23 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gbq s ILE 24 N -1.45 5.24 0.14 0.53 1.01 -1.26 -1.47 121.20 123.95 3gbq s ILE 24 Ca 0.65 -0.16 0.07 0.00 0.00 0.00 0.00 60.65 61.21 3gbq s ILE 24 Cb -0.56 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 3gbq s ILE 24 CO 0.56 -0.07 -0.04 -0.76 0.00 0.00 0.00 174.94 174.64 3gbq s LEU 25 N 1.83 3.21 -0.36 2.97 1.02 -0.98 -4.87 118.68 121.50 3gbq s LEU 25 Ca 0.08 -0.39 -0.10 0.00 0.02 0.00 0.00 54.13 53.74 3gbq s LEU 25 Cb -0.17 -1.92 0.03 0.00 0.02 0.00 0.00 46.19 44.15 3gbq s LEU 25 CO 0.11 0.13 0.18 -0.54 0.02 0.00 0.00 176.35 176.25 3gbq s LYS 26 N -2.64 2.82 -0.58 1.70 1.02 -0.86 -2.63 119.74 118.58 3gbq s LYS 26 Ca 0.25 -1.07 -0.24 0.00 0.02 0.00 0.00 55.97 54.92 3gbq s LYS 26 Cb -0.10 -3.67 0.04 0.00 -0.52 0.00 0.00 37.83 33.59 3gbq s LYS 26 CO 0.17 -0.67 0.97 0.08 -0.92 0.00 0.00 175.35 174.98 3gbq s VAL 27 N 1.53 4.33 -1.06 3.17 1.01 -1.08 -0.21 120.40 128.09 3gbq s VAL 27 Ca 0.01 0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.15 3gbq s VAL 27 Cb -0.19 -4.59 0.29 0.00 0.00 0.00 0.00 36.38 31.89 3gbq s VAL 27 CO 0.06 -1.22 1.26 -0.11 0.00 0.00 0.00 175.10 175.09 3gbq n LEU 28 N 7.64 5.82 0.00 3.92 -0.00 -0.11 -3.53 117.00 130.73 3gbq n LEU 28 Ca 0.01 -5.15 0.00 0.00 -0.00 0.00 0.00 56.01 50.87 3gbq n LEU 28 Cb 0.47 -1.31 0.00 0.00 -0.00 0.00 0.00 43.42 42.58 3gbq n LEU 28 CO 0.64 1.57 0.00 -3.20 -0.00 0.00 0.00 177.39 176.40 3gbq n ASN 29 N 1.89 0.00 -2.71 1.96 2.85 -1.25 -4.59 115.26 113.41 3gbq n ASN 29 Ca 0.25 0.00 -0.04 0.00 -0.11 0.00 0.00 54.58 54.68 3gbq n ASN 29 Cb 0.36 0.15 0.03 0.00 1.24 0.00 0.00 39.78 41.56 3gbq n ASN 29 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 3gbq n GLU 30 N 1.25 0.33 -2.73 1.20 0.28 -1.26 -3.04 120.64 116.66 3gbq n GLU 30 Ca 0.00 -1.29 -0.04 0.00 -0.16 0.00 0.00 57.16 55.67 3gbq n GLU 30 Cb 0.00 -0.63 0.02 0.00 1.43 0.00 0.00 31.44 32.26 3gbq n GLU 30 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 3gbq n GLU 31 N 2.43 0.45 0.00 3.44 0.28 -1.26 -4.94 120.64 121.03 3gbq n GLU 31 Ca 0.12 -1.66 0.00 0.00 -0.16 0.00 0.00 57.16 55.46 3gbq n GLU 31 Cb 0.63 -1.05 0.00 0.00 1.43 0.00 0.00 31.44 32.45 3gbq n GLU 31 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3gbq s ASP 33 N 0.00 -0.09 -0.72 0.00 1.11 -1.26 -5.06 116.67 110.65 3gbq s ASP 33 Ca 0.00 0.18 -0.27 0.00 0.18 0.00 0.00 52.55 52.64 3gbq s ASP 33 Cb 0.00 1.34 0.02 0.00 1.07 0.00 0.00 42.92 45.35 3gbq s ASP 33 CO 0.00 -0.31 1.45 -1.58 1.18 0.00 0.00 175.17 175.92 3gbq s GLN 34 N 2.61 3.04 0.00 8.23 0.74 -1.26 -1.06 119.66 131.96 3gbq s GLN 34 Ca 0.13 -0.04 0.00 0.00 0.05 0.00 0.00 55.36 55.51 3gbq s GLN 34 Cb -0.14 -4.29 0.00 0.00 1.10 0.00 0.00 33.01 29.68 3gbq s GLN 34 CO -0.21 -2.33 0.00 0.09 -0.55 0.00 0.00 175.29 172.29 3gbq n ASN 35 N 10.36 0.00 -4.10 6.67 3.02 -1.26 -5.09 115.26 124.85 3gbq n ASN 35 Ca 0.09 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.52 3gbq n ASN 35 Cb 0.50 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.56 3gbq n ASN 35 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3gbq s TRP 36 N 0.00 0.73 0.03 3.10 0.52 -0.22 -0.89 118.94 122.20 3gbq s TRP 36 Ca 0.00 -0.67 0.03 0.00 0.02 0.00 0.00 56.10 55.48 3gbq s TRP 36 Cb 0.00 -0.43 -0.02 0.00 -1.15 0.00 0.00 33.47 31.87 3gbq s TRP 36 CO 0.00 -0.12 -0.09 0.71 0.02 0.00 0.00 176.95 177.47 3gbq s TYR 37 N -2.25 0.75 -0.29 -1.98 2.02 0.13 -4.57 117.35 111.17 3gbq s TYR 37 Ca -0.02 -0.37 -0.11 0.00 -0.37 0.00 0.00 57.07 56.20 3gbq s TYR 37 Cb -0.04 -0.45 -0.05 0.00 -0.40 0.00 0.00 41.96 41.02 3gbq s TYR 37 CO -0.02 -0.03 0.19 0.21 -1.57 0.00 0.00 175.55 174.33 3gbq s LYS 38 N -1.14 3.89 0.24 -0.62 2.20 -1.17 -0.94 119.74 122.20 3gbq s LYS 38 Ca -0.04 -0.36 0.00 0.00 -0.36 0.00 0.00 55.97 55.21 3gbq s LYS 38 Cb -0.08 -3.67 -0.03 0.00 -1.51 0.00 0.00 37.83 32.54 3gbq s LYS 38 CO 0.01 -0.21 0.20 0.00 -0.36 0.00 0.00 175.35 174.98 3gbq s ALA 39 N 1.75 1.25 -0.08 3.13 0.00 -0.83 -0.94 121.76 126.04 3gbq s ALA 39 Ca 0.07 -1.74 0.02 0.00 0.00 0.00 0.00 51.96 50.31 3gbq s ALA 39 Cb -0.16 1.39 -0.02 0.00 0.00 0.00 0.00 23.12 24.33 3gbq s ALA 39 CO 0.11 -0.63 -0.15 -2.00 0.00 0.00 0.00 175.76 173.09 3gbq s GLU 40 N -3.94 2.87 -0.27 0.00 2.12 0.71 -1.97 118.70 118.22 3gbq s GLU 40 Ca 0.38 -0.72 -0.25 0.00 0.36 0.00 0.00 54.97 54.74 3gbq s GLU 40 Cb 0.05 -2.45 0.08 0.00 0.26 0.00 0.00 34.13 32.08 3gbq s GLU 40 CO 0.16 0.42 0.79 -0.51 -0.54 0.00 0.00 175.26 175.58 3gbq s LEU 41 N -0.21 -0.68 -1.91 2.70 1.43 -0.01 -2.02 118.68 117.98 3gbq s LEU 41 Ca 0.00 1.31 0.00 0.00 -1.03 0.00 0.00 54.13 54.41 3gbq s LEU 41 Cb -0.13 2.34 0.00 0.00 0.03 0.00 0.00 46.19 48.43 3gbq s LEU 41 CO 0.03 -0.24 0.00 -3.20 0.23 0.00 0.00 176.35 173.18 3gbq n ASN 42 N 2.55 -5.61 0.00 2.29 2.85 -1.26 -0.87 115.26 115.21 3gbq n ASN 42 Ca -0.14 0.20 0.00 0.00 -0.11 0.00 0.00 54.58 54.54 3gbq n ASN 42 Cb 0.55 -4.79 0.00 0.00 1.24 0.00 0.00 39.78 36.78 3gbq n ASN 42 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3gbq n GLY 43 N -0.75 0.56 3.30 8.20 0.00 -1.26 -5.04 105.19 110.21 3gbq n GLY 43 Ca -0.23 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.23 3gbq n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gbq s LYS 44 N -0.85 1.34 -0.05 1.61 1.02 -0.05 -5.17 119.74 117.59 3gbq s LYS 44 Ca 0.00 -1.71 -0.04 0.00 0.02 0.00 0.00 55.97 54.25 3gbq s LYS 44 Cb 0.00 -0.27 0.02 0.00 -0.52 0.00 0.00 37.83 37.06 3gbq s LYS 44 CO 0.00 -0.25 0.13 0.16 -0.92 0.00 0.00 175.35 174.47 3gbq s ASP 45 N -3.28 -0.12 0.00 2.83 1.47 -1.26 -0.83 116.67 115.48 3gbq s ASP 45 Ca 0.34 0.27 -0.28 0.00 1.18 0.00 0.00 52.55 54.06 3gbq s ASP 45 Cb 0.07 0.23 0.10 0.00 -0.34 0.00 0.00 42.92 42.98 3gbq s ASP 45 CO 0.11 -0.08 1.26 -0.83 0.68 0.00 0.00 175.17 176.31 3gbq s GLY 46 N 0.48 -0.16 0.37 2.12 0.00 -0.83 -4.86 107.32 104.43 3gbq s GLY 46 Ca -0.03 0.14 -0.25 0.00 0.00 0.00 0.00 44.72 44.58 3gbq s GLY 46 CO -0.02 4.18 0.99 -1.36 0.00 0.00 0.00 173.10 176.89 3gbq s PHE 47 N -2.12 3.48 -0.01 1.90 0.08 -0.12 -1.97 117.98 119.22 3gbq s PHE 47 Ca 0.26 1.70 -0.05 0.00 0.12 0.00 0.00 56.93 58.96 3gbq s PHE 47 Cb 0.00 -2.99 -0.00 0.00 -0.57 0.00 0.00 43.02 39.46 3gbq s PHE 47 CO -0.01 -0.16 0.10 0.96 -0.10 0.00 0.00 175.22 176.01 3gbq s ILE 48 N -1.71 0.06 0.24 0.64 -4.36 -0.12 -2.60 121.20 113.35 3gbq s ILE 48 Ca 0.55 -0.53 -0.28 0.00 -0.26 0.00 0.00 60.65 60.12 3gbq s ILE 48 Cb -0.19 -0.32 -0.09 0.00 1.25 0.00 0.00 42.46 43.11 3gbq s ILE 48 CO 0.24 -0.29 0.91 -2.16 0.24 0.00 0.00 174.94 173.87 3gbq s PRO 49 N -0.98 4.75 0.29 0.37 0.04 -1.26 -0.69 135.00 137.52 3gbq s PRO 49 Ca -0.11 1.39 0.07 0.00 0.04 0.00 0.00 61.00 62.40 3gbq s PRO 49 Cb -0.06 -3.19 0.43 0.00 0.04 0.00 0.00 34.50 31.72 3gbq s PRO 49 CO 0.01 0.49 1.67 1.57 0.04 0.00 0.00 177.00 180.78 3gbq h LYS 50 N 4.00 0.18 0.00 4.56 2.10 -1.33 -2.14 116.57 123.93 3gbq h LYS 50 Ca -0.46 -0.09 0.00 0.00 -2.00 0.00 0.00 60.65 58.10 3gbq h LYS 50 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3gbq h LYS 50 CO 0.67 0.62 0.00 0.27 -2.00 0.00 0.00 179.45 179.01 3gbq n ASN 51 N -3.97 0.15 0.01 7.07 6.94 -1.26 -1.55 115.26 122.65 3gbq n ASN 51 Ca -0.02 0.54 0.12 0.00 -0.02 0.00 0.00 54.58 55.20 3gbq n ASN 51 Cb 0.52 -0.57 0.15 0.00 -2.36 0.00 0.00 39.78 37.52 3gbq n ASN 51 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 3gbq n TYR 52 N -1.67 0.10 -4.43 -2.53 4.02 -0.81 -4.95 117.16 106.88 3gbq n TYR 52 Ca 0.03 0.03 -0.21 0.00 -0.01 0.00 0.00 57.90 57.73 3gbq n TYR 52 Cb 0.17 -0.28 -0.10 0.00 -0.02 0.00 0.00 39.34 39.11 3gbq n TYR 52 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 3gbq s ILE 53 N -3.05 0.83 -0.03 -0.72 2.07 -0.59 -0.43 121.20 119.27 3gbq s ILE 53 Ca 0.09 -2.00 0.01 0.00 -1.41 0.00 0.00 60.65 57.34 3gbq s ILE 53 Cb 0.16 -2.62 0.02 0.00 0.13 0.00 0.00 42.46 40.15 3gbq s ILE 53 CO 0.74 0.00 -0.05 -0.70 -1.91 0.00 0.00 174.94 173.02 3gbq s GLU 54 N -3.87 0.76 0.62 3.50 2.12 -0.59 -4.86 118.70 116.37 3gbq s GLU 54 Ca 0.33 -0.14 -0.07 0.00 0.36 0.00 0.00 54.97 55.45 3gbq s GLU 54 Cb 0.07 -0.75 0.01 0.00 0.26 0.00 0.00 34.13 33.72 3gbq s GLU 54 CO 0.15 -0.02 0.95 -1.64 -0.54 0.00 0.00 175.26 174.16 3gbq s MET 55 N 0.63 2.84 -0.46 4.30 -1.94 -1.26 -1.23 119.30 122.18 3gbq s MET 55 Ca -0.08 0.06 0.06 0.00 -1.71 0.00 0.00 55.69 54.02 3gbq s MET 55 Cb -0.12 -2.22 0.21 0.00 2.01 0.00 0.00 34.83 34.72 3gbq s MET 55 CO 0.00 -0.81 0.61 1.63 -0.01 0.00 0.00 175.02 176.45 3gbq n LYS 56 N -2.69 0.53 0.00 2.03 4.76 -0.28 -4.93 118.16 117.57 3gbq n LYS 56 Ca 0.05 -2.53 0.00 0.00 -2.87 0.00 0.00 58.31 52.96 3gbq n LYS 56 Cb 0.58 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.30 3gbq n LYS 56 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68