#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gbr s GLN 2 N 0.00 2.80 0.19 2.12 -0.21 -1.26 -0.88 119.66 122.43 2gbr s GLN 2 Ca 0.00 -0.87 0.02 0.00 0.02 0.00 0.00 55.36 54.53 2gbr s GLN 2 Cb 0.00 -2.26 -0.05 0.00 1.00 0.00 0.00 33.01 31.71 2gbr s GLN 2 CO 0.00 0.30 0.01 0.96 -2.12 0.00 0.00 175.29 174.44 2gbr s ILE 3 N 0.05 0.71 0.01 1.08 -4.36 -0.95 0.71 121.20 118.45 2gbr s ILE 3 Ca -0.10 -1.99 0.08 0.00 -0.26 0.00 0.00 60.65 58.39 2gbr s ILE 3 Cb -0.15 -2.23 -0.02 0.00 1.25 0.00 0.00 42.46 41.31 2gbr s ILE 3 CO 0.06 -0.38 -0.26 -0.36 0.24 0.00 0.00 174.94 174.24 2gbr s PHE 4 N -3.64 2.26 -0.13 1.37 0.08 0.09 -1.49 117.98 116.53 2gbr s PHE 4 Ca 0.27 -0.42 0.01 0.00 0.12 0.00 0.00 56.93 56.90 2gbr s PHE 4 Cb 0.06 -1.41 0.02 0.00 -0.57 0.00 0.00 43.02 41.12 2gbr s PHE 4 CO 0.06 0.04 -0.13 0.08 -0.10 0.00 0.00 175.22 175.16 2gbr s VAL 5 N -0.69 1.45 -0.12 -0.44 1.01 0.23 0.41 120.40 122.25 2gbr s VAL 5 Ca 0.10 -0.57 -0.26 0.00 0.00 0.00 0.00 61.98 61.25 2gbr s VAL 5 Cb -0.10 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 34.90 2gbr s VAL 5 CO 0.00 0.44 0.84 -0.54 0.00 0.00 0.00 175.10 175.84 2gbr s LYS 6 N 1.36 4.37 0.98 2.72 -0.14 0.10 -0.14 119.74 129.00 2gbr s LYS 6 Ca 0.01 1.07 -0.16 0.00 -1.36 0.00 0.00 55.97 55.53 2gbr s LYS 6 Cb -0.13 -3.53 0.20 0.00 -1.68 0.00 0.00 37.83 32.69 2gbr s LYS 6 CO -0.07 -0.20 1.28 0.95 -0.76 0.00 0.00 175.35 176.54 2gbr s THR 7 N 1.68 1.95 0.34 2.17 -4.23 -0.31 -0.83 115.64 116.40 2gbr s THR 7 Ca 0.41 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 2gbr s THR 7 Cb -0.18 -2.92 0.25 0.00 1.34 0.00 0.00 72.50 70.99 2gbr s THR 7 CO 0.16 0.00 1.99 -0.07 -0.54 0.00 0.00 174.62 176.16 2gbr h LEU 8 N -1.71 0.76 -0.49 4.79 4.07 -1.90 -2.22 115.31 118.62 2gbr h LEU 8 Ca -0.45 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.48 2gbr h LEU 8 Cb 1.25 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.80 2gbr h LEU 8 CO 0.41 0.57 -0.35 0.35 -1.08 0.00 0.00 178.44 178.33 2gbr n THR 9 N -4.42 0.00 0.00 0.22 -2.24 -1.26 -4.96 114.28 101.62 2gbr n THR 9 Ca 0.07 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2gbr n THR 9 Cb 0.05 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 2gbr n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gbr n GLY 10 N 1.38 0.83 3.77 3.38 0.00 -0.83 -5.08 105.19 108.63 2gbr n GLY 10 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 2gbr n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gbr s LYS 11 N -0.89 4.41 -0.06 1.61 2.20 -1.26 -4.71 119.74 121.03 2gbr s LYS 11 Ca 0.00 1.59 -0.19 0.00 -0.36 0.00 0.00 55.97 57.01 2gbr s LYS 11 Cb 0.00 -2.83 -0.05 0.00 -1.51 0.00 0.00 37.83 33.44 2gbr s LYS 11 CO 0.00 0.06 0.53 0.99 -0.36 0.00 0.00 175.35 176.57 2gbr s THR 12 N -1.46 5.07 -0.04 3.43 2.01 -1.26 -1.17 115.64 122.22 2gbr s THR 12 Ca 0.52 1.09 0.05 0.00 0.31 0.00 0.00 61.69 63.66 2gbr s THR 12 Cb -0.25 -3.87 -0.02 0.00 0.01 0.00 0.00 72.50 68.36 2gbr s THR 12 CO 0.32 0.37 -0.19 0.27 -0.69 0.00 0.00 174.62 174.70 2gbr s ILE 13 N 0.23 2.65 -0.18 1.82 -4.36 0.81 -4.96 121.20 117.20 2gbr s ILE 13 Ca 0.29 -0.88 -0.09 0.00 -0.26 0.00 0.00 60.65 59.71 2gbr s ILE 13 Cb -0.17 -1.99 -0.05 0.00 1.25 0.00 0.00 42.46 41.50 2gbr s ILE 13 CO 0.14 0.59 0.12 -0.89 0.24 0.00 0.00 174.94 175.13 2gbr s THR 14 N -0.66 5.32 0.06 8.37 2.01 -1.26 -0.60 115.64 128.88 2gbr s THR 14 Ca 0.10 0.15 0.10 0.00 0.31 0.00 0.00 61.69 62.35 2gbr s THR 14 Cb -0.10 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 2gbr s THR 14 CO -0.00 0.47 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.38 2gbr s LEU 15 N 0.12 2.20 -0.25 4.42 1.43 -0.56 -5.01 118.68 121.03 2gbr s LEU 15 Ca 0.08 -0.62 -0.09 0.00 -1.03 0.00 0.00 54.13 52.47 2gbr s LEU 15 Cb -0.11 -1.25 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 2gbr s LEU 15 CO -0.01 0.23 0.13 -0.70 0.23 0.00 0.00 176.35 176.23 2gbr s GLU 16 N -1.42 3.88 0.26 1.70 2.56 -1.26 -2.25 118.70 122.18 2gbr s GLU 16 Ca 0.12 -0.36 0.02 0.00 0.00 0.00 0.00 54.97 54.74 2gbr s GLU 16 Cb -0.10 -3.46 -0.04 0.00 2.00 0.00 0.00 34.13 32.53 2gbr s GLU 16 CO 0.03 -0.07 0.15 0.14 -0.56 0.00 0.00 175.26 174.95 2gbr s VAL 17 N 1.36 0.22 0.14 3.70 -7.23 -0.06 -4.97 120.40 113.56 2gbr s VAL 17 Ca 0.06 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.27 2gbr s VAL 17 Cb -0.15 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 2gbr s VAL 17 CO 0.06 0.00 0.16 -1.61 -0.31 0.00 0.00 175.10 173.40 2gbr s GLU 18 N -3.94 3.05 0.49 4.82 2.02 -1.26 -0.75 118.70 123.13 2gbr s GLU 18 Ca 0.38 -0.75 0.19 0.00 0.02 0.00 0.00 54.97 54.81 2gbr s GLU 18 Cb 0.06 -2.75 1.24 0.00 0.10 0.00 0.00 34.13 32.78 2gbr s GLU 18 CO 0.16 0.51 2.02 -1.00 0.02 0.00 0.00 175.26 176.98 2gbr h PRO 19 N 2.53 0.14 -0.64 0.39 0.13 -1.95 -1.70 132.00 130.90 2gbr h PRO 19 Ca -0.48 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2gbr h PRO 19 Cb 1.19 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2gbr h PRO 19 CO 0.66 0.09 0.00 0.43 -0.23 0.00 0.00 178.00 178.95 2gbr n SER 20 N -4.45 5.00 -4.75 1.44 7.64 -1.26 -1.90 113.62 115.34 2gbr n SER 20 Ca 0.07 -2.61 -0.42 0.00 1.01 0.00 0.00 58.87 56.92 2gbr n SER 20 Cb 0.41 -0.62 -0.01 0.00 -1.01 0.00 0.00 64.21 62.99 2gbr n SER 20 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2gbr n ASP 21 N 0.91 3.60 -4.80 6.43 8.00 -0.64 -4.66 116.55 125.39 2gbr n ASP 21 Ca 0.26 1.20 -0.31 0.00 0.71 0.00 0.00 54.79 56.65 2gbr n ASP 21 Cb 0.99 -1.58 0.07 0.00 -0.02 0.00 0.00 41.12 40.57 2gbr n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2gbr s THR 22 N -0.79 3.70 0.27 -3.53 -4.23 -1.26 -0.64 115.64 109.16 2gbr s THR 22 Ca 0.57 0.57 -0.03 0.00 -1.18 0.00 0.00 61.69 61.62 2gbr s THR 22 Cb -0.50 -3.19 0.19 0.00 1.34 0.00 0.00 72.50 70.33 2gbr s THR 22 CO 0.59 -0.71 1.86 0.40 -0.54 0.00 0.00 174.62 176.22 2gbr h ILE 23 N -0.82 1.23 -0.94 2.99 1.08 -0.86 -1.66 117.51 118.53 2gbr h ILE 23 Ca -0.44 -0.70 0.06 0.00 -0.39 0.00 0.00 64.86 63.39 2gbr h ILE 23 Cb 1.22 0.40 -0.06 0.00 -3.07 0.00 0.00 36.82 35.31 2gbr h ILE 23 CO 0.54 0.28 0.61 -0.08 -0.69 0.00 0.00 178.15 178.82 2gbr h GLU 24 N 0.97 1.07 -0.54 2.37 4.57 -1.46 0.34 114.58 121.88 2gbr h GLU 24 Ca 0.23 -0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 58.28 2gbr h GLU 24 Cb 0.16 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 2gbr h GLU 24 CO -0.02 0.71 0.08 -0.91 -1.18 0.00 0.00 179.01 177.69 2gbr h ASN 25 N 1.10 0.87 -0.48 1.04 2.35 -1.68 -1.52 115.58 117.26 2gbr h ASN 25 Ca 0.40 -0.26 -0.06 0.00 -0.55 0.00 0.00 56.30 55.83 2gbr h ASN 25 Cb 0.15 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 2gbr h ASN 25 CO -0.15 0.91 0.08 0.58 -1.65 0.00 0.00 177.43 177.20 2gbr h VAL 26 N 0.79 1.25 -0.37 2.81 2.07 -0.65 -2.92 116.25 119.22 2gbr h VAL 26 Ca 0.16 -0.92 0.02 0.00 0.82 0.00 0.00 66.70 66.78 2gbr h VAL 26 Cb 0.41 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 2gbr h VAL 26 CO 0.01 0.32 0.22 0.11 0.02 0.00 0.00 177.57 178.25 2gbr h LYS 27 N 0.66 0.43 -0.80 1.57 1.57 -0.14 -1.33 116.57 118.53 2gbr h LYS 27 Ca 0.15 -0.03 0.16 0.00 -1.87 0.00 0.00 60.65 59.06 2gbr h LYS 27 Cb 0.39 -0.10 -0.10 0.00 0.08 0.00 0.00 32.23 32.50 2gbr h LYS 27 CO 0.01 0.28 0.33 0.00 -0.57 0.00 0.00 179.45 179.51 2gbr h ALA 28 N 1.16 1.16 -0.43 3.86 0.00 -1.25 -1.13 119.26 122.63 2gbr h ALA 28 Ca 0.15 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 2gbr h ALA 28 Cb 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2gbr h ALA 28 CO -0.07 -0.22 -0.13 0.87 0.00 0.00 0.00 179.25 179.70 2gbr h LYS 29 N 0.46 0.85 0.10 0.00 1.57 -1.17 -1.86 116.57 116.52 2gbr h LYS 29 Ca 0.45 -0.34 0.02 0.00 -1.87 0.00 0.00 60.65 58.91 2gbr h LYS 29 Cb 0.72 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 2gbr h LYS 29 CO -0.43 0.97 -0.33 0.82 -0.57 0.00 0.00 179.45 179.91 2gbr h ILE 30 N 0.68 0.29 -0.97 1.86 2.04 -0.93 -1.78 117.51 118.70 2gbr h ILE 30 Ca 0.11 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.18 2gbr h ILE 30 Cb 0.68 0.29 -0.12 0.00 -0.74 0.00 0.00 36.82 36.94 2gbr h ILE 30 CO 0.05 0.00 0.55 1.56 0.00 0.00 0.00 178.15 180.31 2gbr h GLN 31 N -0.55 0.60 -0.65 2.37 4.20 -1.02 0.39 115.11 120.45 2gbr h GLN 31 Ca 0.04 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 2gbr h GLN 31 Cb 0.59 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 2gbr h GLN 31 CO -0.21 0.40 0.14 -0.44 -0.67 0.00 0.00 178.83 178.05 2gbr h ASP 32 N 0.62 0.98 1.10 1.46 3.32 -0.93 -3.17 116.42 119.80 2gbr h ASP 32 Ca 0.59 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 57.33 2gbr h ASP 32 Cb 1.03 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 2gbr h ASP 32 CO -0.44 0.96 -0.49 0.11 -1.72 0.00 0.00 179.24 177.65 2gbr h LYS 33 N 0.99 0.00 -6.98 3.56 1.79 -0.10 -3.47 116.57 112.36 2gbr h LYS 33 Ca 0.21 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 58.17 2gbr h LYS 33 Cb 0.37 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.08 2gbr h LYS 33 CO 0.00 0.49 0.49 -1.21 -1.08 0.00 0.00 179.45 178.15 2gbr s GLU 34 N -3.27 3.88 0.38 3.15 2.02 -0.53 -5.07 118.70 119.26 2gbr s GLU 34 Ca 0.02 1.80 -0.06 0.00 0.02 0.00 0.00 54.97 56.74 2gbr s GLU 34 Cb 0.10 -2.52 0.09 0.00 0.10 0.00 0.00 34.13 31.90 2gbr s GLU 34 CO 0.72 -0.46 0.45 0.41 0.02 0.00 0.00 175.26 176.41 2gbr n GLY 35 N 0.51 -1.68 0.26 -1.39 0.00 -1.26 -4.82 105.19 96.82 2gbr n GLY 35 Ca 0.06 -1.61 0.14 0.00 0.00 0.00 0.00 46.02 44.61 2gbr n GLY 35 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2gbr h ARG 36 N 0.00 0.00 0.00 1.61 3.08 -1.97 -2.41 114.38 114.68 2gbr h ARG 36 Ca -0.15 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 2gbr h ARG 36 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 2gbr h ARG 36 CO 0.10 0.11 -0.64 -1.49 -1.07 0.00 0.00 179.97 176.99 2gbr h TRP 37 N 0.00 0.00 0.00 3.04 4.06 -2.00 -2.80 115.95 118.25 2gbr h TRP 37 Ca -0.00 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.80 2gbr h TRP 37 Cb 0.47 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.60 2gbr h TRP 37 CO 0.00 0.07 -2.11 0.00 -3.56 0.00 0.00 178.44 172.84 2gbr n ALA 38 N -2.17 2.24 0.21 1.49 0.00 -1.20 -4.36 120.51 116.71 2gbr n ALA 38 Ca 0.01 -0.83 0.10 0.00 0.00 0.00 0.00 53.44 52.72 2gbr n ALA 38 Cb 0.57 -0.47 0.25 0.00 0.00 0.00 0.00 19.45 19.80 2gbr n ALA 38 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2gbr h LEU 39 N 0.00 0.00 -0.35 0.00 5.85 -1.46 -3.00 115.31 116.34 2gbr h LEU 39 Ca -0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.50 2gbr h LEU 39 Cb 1.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.51 2gbr h LEU 39 CO 0.01 0.18 0.00 0.00 -0.34 0.00 0.00 178.44 178.29 2gbr h ALA 40 N 1.82 1.00 -2.71 1.25 0.00 -1.69 -3.44 119.26 115.48 2gbr h ALA 40 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 2gbr h ALA 40 Cb 1.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 2gbr h ALA 40 CO 0.02 0.00 0.07 0.42 0.00 0.00 0.00 179.25 179.76 2gbr s ILE 41 N -3.24 4.87 -0.32 0.00 1.01 -1.14 -4.97 121.20 117.41 2gbr s ILE 41 Ca 0.07 1.43 -0.39 0.00 0.00 0.00 0.00 60.65 61.76 2gbr s ILE 41 Cb 0.10 -4.02 -0.15 0.00 0.01 0.00 0.00 42.46 38.40 2gbr s ILE 41 CO 0.55 0.37 1.89 -0.81 0.00 0.00 0.00 174.94 176.93 2gbr n PRO 42 N 2.95 1.03 0.00 2.79 -0.04 -1.26 -4.76 135.00 135.71 2gbr n PRO 42 Ca -0.04 0.35 0.04 0.00 -0.04 0.00 0.00 63.50 63.82 2gbr n PRO 42 Cb 0.51 -2.13 0.26 0.00 -0.04 0.00 0.00 33.50 32.09 2gbr n PRO 42 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2gbr n PRO 43 N 6.23 0.49 -0.07 0.54 -0.04 -1.26 -2.84 135.00 138.06 2gbr n PRO 43 Ca 0.32 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.70 2gbr n PRO 43 Cb 0.14 -1.27 -0.07 0.00 -0.04 0.00 0.00 33.50 32.25 2gbr n PRO 43 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2gbr n ASP 44 N -0.77 2.76 -0.05 3.54 9.92 -1.26 -4.62 116.55 126.06 2gbr n ASP 44 Ca 0.06 -0.06 0.15 0.00 -0.53 0.00 0.00 54.79 54.41 2gbr n ASP 44 Cb 0.03 0.03 0.70 0.00 -0.64 0.00 0.00 41.12 41.24 2gbr n ASP 44 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 2gbr n GLN 45 N -2.78 0.58 -1.88 -1.24 0.00 -1.13 -4.57 117.38 106.36 2gbr n GLN 45 Ca -0.23 -0.11 -0.31 0.00 -0.00 0.00 0.00 57.00 56.36 2gbr n GLN 45 Cb 0.79 -1.50 0.01 0.00 0.00 0.00 0.00 30.24 29.54 2gbr n GLN 45 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2gbr s GLN 46 N -2.50 3.51 0.07 3.69 -0.21 -1.25 -4.87 119.66 118.10 2gbr s GLN 46 Ca 0.30 0.71 0.05 0.00 0.02 0.00 0.00 55.36 56.44 2gbr s GLN 46 Cb 0.20 -2.07 -0.03 0.00 1.00 0.00 0.00 33.01 32.11 2gbr s GLN 46 CO 0.46 -0.63 -0.15 1.03 -2.12 0.00 0.00 175.29 173.89 2gbr s ARG 47 N -5.20 0.84 -0.20 2.91 0.52 -0.57 -4.99 118.95 112.25 2gbr s ARG 47 Ca 0.55 -0.95 -0.13 0.00 -0.52 0.00 0.00 55.73 54.68 2gbr s ARG 47 Cb -0.11 -0.86 -0.04 0.00 0.52 0.00 0.00 34.95 34.46 2gbr s ARG 47 CO 0.54 0.19 0.28 -0.51 0.02 0.00 0.00 175.30 175.82 2gbr s LEU 48 N -1.72 4.17 0.00 2.53 1.43 -1.26 -1.67 118.68 122.16 2gbr s LEU 48 Ca -0.01 0.37 0.08 0.00 -1.03 0.00 0.00 54.13 53.53 2gbr s LEU 48 Cb -0.10 -2.33 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 2gbr s LEU 48 CO 0.02 0.03 -0.24 -0.63 0.23 0.00 0.00 176.35 175.76 2gbr s ILE 49 N 0.96 1.92 -0.16 -0.59 -1.09 -0.00 -0.39 121.20 121.85 2gbr s ILE 49 Ca 0.14 -1.12 -0.08 0.00 -2.23 0.00 0.00 60.65 57.36 2gbr s ILE 49 Cb -0.14 -1.61 0.06 0.00 -1.58 0.00 0.00 42.46 39.20 2gbr s ILE 49 CO 0.05 0.47 0.38 0.12 -1.23 0.00 0.00 174.94 174.73 2gbr s PHE 50 N -0.64 -0.59 -1.49 3.97 5.36 -0.83 -1.67 117.98 122.10 2gbr s PHE 50 Ca 0.10 1.24 -0.12 0.00 -0.96 0.00 0.00 56.93 57.19 2gbr s PHE 50 Cb -0.09 0.23 0.07 0.00 -0.34 0.00 0.00 43.02 42.88 2gbr s PHE 50 CO -0.00 -0.35 1.00 0.00 -1.46 0.00 0.00 175.22 174.41 2gbr n ALA 51 N 4.46 -1.35 -1.06 11.12 0.00 -1.26 -2.22 120.51 130.20 2gbr n ALA 51 Ca -0.21 0.20 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 2gbr n ALA 51 Cb 0.54 -4.46 -0.01 0.00 0.00 0.00 0.00 19.45 15.52 2gbr n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gbr n GLY 52 N -1.73 0.56 3.21 0.00 0.00 -1.26 -5.02 105.19 100.95 2gbr n GLY 52 Ca 0.01 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.19 2gbr n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gbr s LYS 53 N -1.54 1.95 -0.57 1.61 1.02 -0.94 -5.08 119.74 116.18 2gbr s LYS 53 Ca 0.00 -0.75 -0.28 0.00 0.02 0.00 0.00 55.97 54.96 2gbr s LYS 53 Cb 0.00 -1.75 0.03 0.00 -0.52 0.00 0.00 37.83 35.58 2gbr s LYS 53 CO 0.00 0.37 1.25 -1.14 -0.92 0.00 0.00 175.35 174.92 2gbr s GLN 54 N -0.25 3.47 0.12 1.68 0.74 -1.26 -1.97 119.66 122.19 2gbr s GLN 54 Ca 0.01 0.32 -0.31 0.00 0.05 0.00 0.00 55.36 55.44 2gbr s GLN 54 Cb -0.11 -4.04 -0.08 0.00 1.10 0.00 0.00 33.01 29.88 2gbr s GLN 54 CO 0.01 -1.74 1.42 -0.51 -0.55 0.00 0.00 175.29 173.92 2gbr s LEU 55 N 5.23 4.37 -0.07 3.68 1.43 0.48 -4.97 118.68 128.83 2gbr s LEU 55 Ca 0.46 2.36 -0.25 0.00 -1.03 0.00 0.00 54.13 55.67 2gbr s LEU 55 Cb -0.08 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.52 2gbr s LEU 55 CO 0.26 -0.68 0.77 -1.61 0.23 0.00 0.00 176.35 175.32 2gbr s GLU 56 N 1.19 4.43 0.33 1.70 2.02 -1.26 -4.76 118.70 122.34 2gbr s GLU 56 Ca 0.65 1.00 0.11 0.00 0.02 0.00 0.00 54.97 56.75 2gbr s GLU 56 Cb -0.38 -3.47 0.97 0.00 0.10 0.00 0.00 34.13 31.35 2gbr s GLU 56 CO 0.30 -0.03 1.69 -0.44 0.02 0.00 0.00 175.26 176.80 2gbr h ASP 57 N 6.88 0.53 0.06 -0.19 5.19 -1.93 -0.90 116.42 126.06 2gbr h ASP 57 Ca -0.39 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 2gbr h ASP 57 Cb 1.19 0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.81 2gbr h ASP 57 CO 0.77 -0.04 -0.03 0.61 -3.12 0.00 0.00 179.24 177.42 2gbr n GLY 58 N -1.30 -0.49 3.95 2.75 0.00 -1.26 -1.29 105.19 107.55 2gbr n GLY 58 Ca 0.29 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 2gbr n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gbr s ARG 59 N -2.10 3.17 0.37 1.61 1.81 -0.34 -4.89 118.95 118.57 2gbr s ARG 59 Ca 0.39 -0.43 0.03 0.00 -1.72 0.00 0.00 55.73 53.99 2gbr s ARG 59 Cb 0.21 -2.58 -0.01 0.00 -0.45 0.00 0.00 34.95 32.12 2gbr s ARG 59 CO 0.38 -0.18 0.54 0.95 -0.68 0.00 0.00 175.30 176.31 2gbr s THR 60 N -2.51 4.42 0.24 0.02 -4.23 -1.26 -0.92 115.64 111.40 2gbr s THR 60 Ca 0.47 -0.71 -0.05 0.00 -1.18 0.00 0.00 61.69 60.22 2gbr s THR 60 Cb -0.10 -3.59 0.21 0.00 1.34 0.00 0.00 72.50 70.36 2gbr s THR 60 CO 0.38 -0.33 1.83 -0.07 -0.54 0.00 0.00 174.62 175.89 2gbr h LEU 61 N 0.72 0.74 -1.16 4.79 3.38 -0.98 -2.83 115.31 119.97 2gbr h LEU 61 Ca -0.48 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 2gbr h LEU 61 Cb 1.24 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2gbr h LEU 61 CO 0.57 0.44 0.14 0.77 0.09 0.00 0.00 178.44 180.46 2gbr h SER 62 N 0.86 0.67 -0.90 -0.43 4.64 -1.60 -0.72 113.55 116.07 2gbr h SER 62 Ca 0.38 -0.10 0.21 0.00 -0.47 0.00 0.00 61.79 61.81 2gbr h SER 62 Cb 0.28 -0.17 -0.07 0.00 -0.31 0.00 0.00 62.40 62.13 2gbr h SER 62 CO -0.21 0.65 0.60 0.44 -0.87 0.00 0.00 176.83 177.44 2gbr h ASP 63 N 0.71 0.39 -0.38 4.97 3.32 -1.82 -1.77 116.42 121.84 2gbr h ASP 63 Ca 0.16 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2gbr h ASP 63 Cb 0.23 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2gbr h ASP 63 CO -0.01 0.15 0.00 -1.22 -1.72 0.00 0.00 179.24 176.44 2gbr n TYR 64 N -4.50 0.49 -3.37 4.55 4.01 -0.86 -4.94 117.16 112.53 2gbr n TYR 64 Ca 0.19 -0.24 -0.24 0.00 -0.16 0.00 0.00 57.90 57.45 2gbr n TYR 64 Cb 0.72 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.80 2gbr n TYR 64 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2gbr n ASN 65 N 1.42 -5.98 -4.63 7.72 5.15 -0.67 -4.95 115.26 113.32 2gbr n ASN 65 Ca 0.19 -0.45 -0.42 0.00 -0.60 0.00 0.00 54.58 53.31 2gbr n ASN 65 Cb 0.59 -4.77 -0.04 0.00 -0.53 0.00 0.00 39.78 35.02 2gbr n ASN 65 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2gbr s ILE 66 N -3.24 4.76 0.49 -1.44 1.01 -0.33 -5.02 121.20 117.44 2gbr s ILE 66 Ca 0.46 1.39 0.05 0.00 0.00 0.00 0.00 60.65 62.56 2gbr s ILE 66 Cb -0.21 -4.18 -0.00 0.00 0.01 0.00 0.00 42.46 38.08 2gbr s ILE 66 CO 0.57 -0.23 0.25 -1.10 0.00 0.00 0.00 174.94 174.43 2gbr s GLN 67 N 3.03 2.24 -0.20 2.79 -1.52 -1.26 -4.48 119.66 120.27 2gbr s GLN 67 Ca 0.35 -2.04 -0.43 0.00 -1.95 0.00 0.00 55.36 51.29 2gbr s GLN 67 Cb -0.14 -1.94 -0.20 0.00 -0.22 0.00 0.00 33.01 30.51 2gbr s GLN 67 CO 0.11 -0.40 1.27 1.17 -0.25 0.00 0.00 175.29 177.19 2gbr n LYS 68 N -1.49 0.00 -1.15 2.91 3.00 -1.26 -1.05 118.16 119.12 2gbr n LYS 68 Ca -0.05 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.21 2gbr n LYS 68 Cb 0.65 -1.49 -0.02 0.00 0.00 0.00 0.00 35.03 34.17 2gbr n LYS 68 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2gbr n GLU 69 N 2.48 -0.87 -2.20 1.64 -0.58 0.22 -5.00 120.64 116.33 2gbr n GLU 69 Ca 0.24 0.55 -0.38 0.00 -0.42 0.00 0.00 57.16 57.15 2gbr n GLU 69 Cb 0.02 -4.39 -0.01 0.00 -0.57 0.00 0.00 31.44 26.49 2gbr n GLU 69 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2gbr s SER 70 N -2.43 6.22 -0.19 1.62 0.01 -0.22 -4.75 113.70 113.96 2gbr s SER 70 Ca 0.00 2.40 -0.05 0.00 1.31 0.00 0.00 55.95 59.61 2gbr s SER 70 Cb 0.00 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.59 2gbr s SER 70 CO 0.00 -0.89 0.01 -0.89 0.41 0.00 0.00 173.24 171.88 2gbr s THR 71 N -1.45 4.14 0.14 1.44 2.01 -1.26 -0.73 115.64 119.93 2gbr s THR 71 Ca 0.61 -0.26 0.03 0.00 0.31 0.00 0.00 61.69 62.39 2gbr s THR 71 Cb -0.31 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 2gbr s THR 71 CO 0.39 0.44 0.23 -0.76 -0.69 0.00 0.00 174.62 174.23 2gbr s LEU 72 N 0.81 4.19 -0.07 4.42 1.02 0.17 -4.87 118.68 124.33 2gbr s LEU 72 Ca 0.01 0.10 0.05 0.00 0.02 0.00 0.00 54.13 54.31 2gbr s LEU 72 Cb -0.14 -2.77 -0.00 0.00 0.02 0.00 0.00 46.19 43.29 2gbr s LEU 72 CO 0.02 0.07 -0.23 -1.00 0.02 0.00 0.00 176.35 175.23 2gbr s HIS 73 N -1.70 2.37 -0.16 0.29 3.76 -0.67 0.01 115.29 119.19 2gbr s HIS 73 Ca 0.33 -0.82 -0.20 0.00 -0.15 0.00 0.00 55.06 54.22 2gbr s HIS 73 Cb -0.11 -1.57 -0.03 0.00 1.11 0.00 0.00 32.58 31.97 2gbr s HIS 73 CO 0.27 -0.30 0.59 -0.51 -0.85 0.00 0.00 174.74 173.94 2gbr s LEU 74 N 0.10 4.20 0.22 0.89 1.43 -0.01 -0.82 118.68 124.69 2gbr s LEU 74 Ca -0.10 0.87 0.06 0.00 -1.03 0.00 0.00 54.13 53.92 2gbr s LEU 74 Cb -0.15 -2.85 -0.05 0.00 0.03 0.00 0.00 46.19 43.17 2gbr s LEU 74 CO 0.06 -0.17 -0.08 0.68 0.23 0.00 0.00 176.35 177.07 2gbr s VAL 75 N 1.39 1.45 -2.85 -1.59 -7.23 -0.67 -4.10 120.40 106.79 2gbr s VAL 75 Ca 0.29 -2.12 0.25 0.00 -1.81 0.00 0.00 61.98 58.59 2gbr s VAL 75 Cb -0.16 -2.18 0.30 0.00 0.56 0.00 0.00 36.38 34.90 2gbr s VAL 75 CO 0.12 -0.49 1.41 -0.11 -0.31 0.00 0.00 175.10 175.72