#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 3.68 0.20 2.12 -0.21 -1.26 -0.40 119.66 123.78 2gbr s GLN 2 Ca 0.00 -0.35 0.06 0.00 0.02 0.00 0.00 55.36 55.09 2gbr s GLN 2 Cb 0.00 -3.09 -0.05 0.00 1.00 0.00 0.00 33.01 30.87 2gbr s GLN 2 CO 0.00 0.42 -0.10 0.96 -2.12 0.00 0.00 175.29 174.45 2gbr s ILE 3 N -0.06 1.46 0.06 1.08 -4.36 -0.73 0.08 121.20 118.72 2gbr s ILE 3 Ca 0.06 -2.13 0.07 0.00 -0.26 0.00 0.00 60.65 58.39 2gbr s ILE 3 Cb -0.12 -2.08 -0.04 0.00 1.25 0.00 0.00 42.46 41.47 2gbr s ILE 3 CO 0.01 -0.57 -0.17 -0.36 0.24 0.00 0.00 174.94 174.10 2gbr s PHE 4 N -3.15 2.59 -0.05 1.37 0.08 -0.26 -0.68 117.98 117.89 2gbr s PHE 4 Ca 0.22 -0.24 0.03 0.00 0.12 0.00 0.00 56.93 57.07 2gbr s PHE 4 Cb 0.02 -1.44 0.00 0.00 -0.57 0.00 0.00 43.02 41.03 2gbr s PHE 4 CO 0.06 0.31 -0.14 0.08 -0.10 0.00 0.00 175.22 175.43 2gbr s VAL 5 N -1.02 1.26 -0.26 -0.44 1.01 -0.18 -0.39 120.40 120.38 2gbr s VAL 5 Ca 0.16 -0.59 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 2gbr s VAL 5 Cb -0.11 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.14 2gbr s VAL 5 CO 0.07 0.38 0.57 -0.54 0.00 0.00 0.00 175.10 175.58 2gbr s LYS 6 N 0.33 4.07 0.96 2.72 -0.14 0.08 -1.23 119.74 126.52 2gbr s LYS 6 Ca -0.09 0.40 -0.14 0.00 -1.36 0.00 0.00 55.97 54.78 2gbr s LYS 6 Cb -0.13 -3.66 0.17 0.00 -1.68 0.00 0.00 37.83 32.53 2gbr s LYS 6 CO 0.03 -0.39 1.18 0.95 -0.76 0.00 0.00 175.35 176.36 2gbr s THR 7 N 2.41 1.93 0.59 2.17 -4.23 -0.17 -0.92 115.64 117.41 2gbr s THR 7 Ca 0.23 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 61.03 2gbr s THR 7 Cb -0.16 -2.79 0.35 0.00 1.34 0.00 0.00 72.50 71.25 2gbr s THR 7 CO 0.09 0.00 2.16 -0.07 -0.54 0.00 0.00 174.62 176.26 2gbr h LEU 8 N -1.68 0.00 -2.28 4.79 3.38 -1.90 -0.41 115.31 117.21 2gbr h LEU 8 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2gbr h LEU 8 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2gbr h LEU 8 CO 0.52 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.40 2gbr n THR 9 N -3.86 0.65 -0.92 0.22 -2.24 -1.26 -4.96 114.28 101.90 2gbr n THR 9 Ca -0.00 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 2gbr n THR 9 Cb 0.23 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 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 1.50 0.84 3.78 3.38 0.00 -0.16 -5.03 105.19 109.50 2gbr n GLY 10 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2gbr n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gbr s LYS 11 N -0.08 3.89 -0.21 1.61 -0.14 -1.26 -4.70 119.74 118.86 2gbr s LYS 11 Ca 0.00 1.63 -0.11 0.00 -1.36 0.00 0.00 55.97 56.13 2gbr s LYS 11 Cb 0.00 -2.40 -0.05 0.00 -1.68 0.00 0.00 37.83 33.70 2gbr s LYS 11 CO 0.00 -0.41 0.15 0.99 -0.76 0.00 0.00 175.35 175.33 2gbr s THR 12 N -1.64 5.38 0.08 2.17 2.01 -1.26 -1.00 115.64 121.38 2gbr s THR 12 Ca 0.62 0.22 0.09 0.00 0.31 0.00 0.00 61.69 62.93 2gbr s THR 12 Cb -0.25 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 2gbr s THR 12 CO 0.30 0.40 -0.24 0.27 -0.69 0.00 0.00 174.62 174.67 2gbr s ILE 13 N 0.60 2.41 -0.17 1.82 -4.36 -0.37 -4.97 121.20 116.17 2gbr s ILE 13 Ca 0.09 -1.48 -0.05 0.00 -0.26 0.00 0.00 60.65 58.94 2gbr s ILE 13 Cb -0.12 -2.02 -0.03 0.00 1.25 0.00 0.00 42.46 41.54 2gbr s ILE 13 CO 0.01 0.24 0.01 -0.89 0.24 0.00 0.00 174.94 174.54 2gbr s THR 14 N -0.96 4.27 0.08 8.37 2.01 -1.26 -1.01 115.64 127.15 2gbr s THR 14 Ca 0.14 -0.22 0.10 0.00 0.31 0.00 0.00 61.69 62.02 2gbr s THR 14 Cb -0.10 -2.90 -0.03 0.00 0.01 0.00 0.00 72.50 69.47 2gbr s THR 14 CO 0.05 0.47 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.43 2gbr s LEU 15 N 0.47 2.24 -0.28 4.42 1.43 0.15 -5.00 118.68 122.10 2gbr s LEU 15 Ca -0.00 -0.66 -0.10 0.00 -1.03 0.00 0.00 54.13 52.33 2gbr s LEU 15 Cb -0.14 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 2gbr s LEU 15 CO 0.02 0.21 0.17 -0.70 0.23 0.00 0.00 176.35 176.28 2gbr s GLU 16 N -1.62 3.81 0.07 1.70 2.56 -1.26 -1.77 118.70 122.18 2gbr s GLU 16 Ca 0.12 -0.41 0.01 0.00 0.00 0.00 0.00 54.97 54.69 2gbr s GLU 16 Cb -0.10 -3.61 -0.04 0.00 2.00 0.00 0.00 34.13 32.39 2gbr s GLU 16 CO 0.04 -0.23 -0.06 0.14 -0.56 0.00 0.00 175.26 174.59 2gbr s VAL 17 N 1.72 0.52 0.22 3.70 -7.23 0.46 -4.98 120.40 114.81 2gbr s VAL 17 Ca 0.07 -1.67 -0.05 0.00 -1.81 0.00 0.00 61.98 58.51 2gbr s VAL 17 Cb -0.16 -1.34 -0.06 0.00 0.56 0.00 0.00 36.38 35.38 2gbr s VAL 17 CO 0.09 -0.78 0.47 -1.61 -0.31 0.00 0.00 175.10 172.97 2gbr s GLU 18 N -3.25 3.65 0.56 4.82 2.02 -1.26 -1.13 118.70 124.11 2gbr s GLU 18 Ca 0.05 -0.01 0.24 0.00 0.02 0.00 0.00 54.97 55.26 2gbr s GLU 18 Cb 0.02 -2.74 1.55 0.00 0.10 0.00 0.00 34.13 33.06 2gbr s GLU 18 CO -0.05 0.34 2.16 -1.00 0.02 0.00 0.00 175.26 176.73 2gbr h PRO 19 N 2.28 0.00 -0.43 0.39 0.13 -1.96 -1.15 132.00 131.26 2gbr h PRO 19 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2gbr h PRO 19 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2gbr h PRO 19 CO 0.69 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.89 2gbr n SER 20 N -4.14 3.09 -4.59 1.44 7.64 -1.26 -1.09 113.62 114.71 2gbr n SER 20 Ca -0.01 -1.95 -0.45 0.00 1.01 0.00 0.00 58.87 57.48 2gbr n SER 20 Cb 0.20 -0.28 -0.02 0.00 -1.01 0.00 0.00 64.21 63.10 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 1.22 1.36 -4.89 6.43 8.00 -0.44 -4.64 116.55 123.61 2gbr n ASP 21 Ca 0.19 1.18 -0.29 0.00 0.71 0.00 0.00 54.79 56.57 2gbr n ASP 21 Cb 0.53 -1.29 0.01 0.00 -0.02 0.00 0.00 41.12 40.35 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 -0.94 4.76 0.31 -3.53 -4.23 -1.26 -0.48 115.64 110.27 2gbr s THR 22 Ca 0.60 0.56 0.03 0.00 -1.18 0.00 0.00 61.69 61.70 2gbr s THR 22 Cb -0.71 -3.85 0.14 0.00 1.34 0.00 0.00 72.50 69.41 2gbr s THR 22 CO 0.59 -1.00 1.83 0.40 -0.54 0.00 0.00 174.62 175.90 2gbr h ILE 23 N -0.09 1.22 -0.81 2.99 1.08 -0.77 -0.84 117.51 120.29 2gbr h ILE 23 Ca -0.45 -0.90 0.03 0.00 -0.39 0.00 0.00 64.86 63.16 2gbr h ILE 23 Cb 1.20 0.97 -0.05 0.00 -3.07 0.00 0.00 36.82 35.87 2gbr h ILE 23 CO 0.62 0.31 0.52 -0.08 -0.69 0.00 0.00 178.15 178.82 2gbr h GLU 24 N 0.56 0.97 -0.55 2.37 4.57 -0.63 -0.17 114.58 121.70 2gbr h GLU 24 Ca 0.11 -0.06 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 2gbr h GLU 24 Cb 0.40 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 2gbr h GLU 24 CO 0.02 0.64 0.08 -0.91 -1.18 0.00 0.00 179.01 177.66 2gbr h ASN 25 N 1.00 0.83 -0.26 1.04 2.35 -1.47 -2.39 115.58 116.69 2gbr h ASN 25 Ca 0.33 -0.18 -0.04 0.00 -0.55 0.00 0.00 56.30 55.86 2gbr h ASN 25 Cb 0.02 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 2gbr h ASN 25 CO -0.12 0.85 0.01 0.58 -1.65 0.00 0.00 177.43 177.10 2gbr h VAL 26 N 0.83 1.25 -0.99 2.81 2.07 -0.66 -2.84 116.25 118.72 2gbr h VAL 26 Ca 0.17 -0.89 0.10 0.00 0.82 0.00 0.00 66.70 66.91 2gbr h VAL 26 Cb 0.38 1.33 -0.08 0.00 -1.52 0.00 0.00 31.29 31.40 2gbr h VAL 26 CO 0.01 0.28 0.63 0.11 0.02 0.00 0.00 177.57 178.62 2gbr h LYS 27 N 0.23 1.01 -0.77 1.57 1.57 -0.92 -1.39 116.57 117.87 2gbr h LYS 27 Ca 0.07 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 2gbr h LYS 27 Cb 0.40 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 2gbr h LYS 27 CO 0.01 0.67 0.37 0.00 -0.57 0.00 0.00 179.45 179.93 2gbr h ALA 28 N 1.52 1.00 -0.37 3.86 0.00 -1.31 -1.30 119.26 122.66 2gbr h ALA 28 Ca 0.47 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 2gbr h ALA 28 Cb 0.38 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2gbr h ALA 28 CO -0.22 0.56 0.15 0.87 0.00 0.00 0.00 179.25 180.60 2gbr h LYS 29 N 1.09 0.55 -0.66 0.00 1.57 -1.18 -2.61 116.57 115.33 2gbr h LYS 29 Ca 0.27 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 2gbr h LYS 29 Cb 0.12 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 2gbr h LYS 29 CO -0.03 0.53 0.40 0.82 -0.57 0.00 0.00 179.45 180.60 2gbr h ILE 30 N 0.45 1.06 -0.98 1.86 2.04 -1.12 -2.55 117.51 118.28 2gbr h ILE 30 Ca 0.12 -0.27 0.05 0.00 1.00 0.00 0.00 64.86 65.76 2gbr h ILE 30 Cb 0.19 0.21 -0.06 0.00 -0.74 0.00 0.00 36.82 36.42 2gbr h ILE 30 CO -0.01 0.14 0.63 -0.61 0.00 0.00 0.00 178.15 178.31 2gbr h GLN 31 N 0.78 1.16 -0.50 2.37 4.15 -0.94 -1.43 115.11 120.71 2gbr h GLN 31 Ca 0.27 -0.07 -0.07 0.00 0.77 0.00 0.00 58.65 59.55 2gbr h GLN 31 Cb 0.05 -0.26 -0.02 0.00 0.21 0.00 0.00 27.48 27.46 2gbr h GLN 31 CO -0.12 0.77 0.02 -0.44 -1.93 0.00 0.00 178.83 177.12 2gbr h ASP 32 N 1.20 0.78 0.70 -0.69 3.32 -1.10 -3.03 116.42 117.59 2gbr h ASP 32 Ca 0.40 -0.19 -0.18 0.00 0.02 0.00 0.00 57.03 57.08 2gbr h ASP 32 Cb 0.06 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2gbr h ASP 32 CO -0.14 0.84 -0.84 0.11 -1.72 0.00 0.00 179.24 177.49 2gbr h LYS 33 N 0.76 0.09 -7.66 3.56 1.79 -1.06 -3.47 116.57 110.59 2gbr h LYS 33 Ca 0.15 -0.10 -0.46 0.00 -2.18 0.00 0.00 60.65 58.06 2gbr h LYS 33 Cb 0.44 0.03 0.12 0.00 -1.58 0.00 0.00 32.23 31.24 2gbr h LYS 33 CO 0.02 0.88 0.40 -1.83 -1.08 0.00 0.00 179.45 177.83 2gbr s GLU 34 N -3.19 1.47 0.67 3.15 -1.05 -0.59 -5.06 118.70 114.10 2gbr s GLU 34 Ca -0.01 -0.02 -0.06 0.00 -0.15 0.00 0.00 54.97 54.72 2gbr s GLU 34 Cb 0.11 -1.91 0.04 0.00 -0.44 0.00 0.00 34.13 31.94 2gbr s GLU 34 CO 0.81 -1.91 0.98 0.20 0.95 0.00 0.00 175.26 176.29 2gbr s GLY 35 N -4.61 1.66 0.16 -3.83 0.00 -1.26 -4.97 107.32 94.47 2gbr s GLY 35 Ca 0.66 -0.84 -0.18 0.00 0.00 0.00 0.00 44.72 44.35 2gbr s GLY 35 CO 0.51 -0.48 1.67 0.07 0.00 0.00 0.00 173.10 174.87 2gbr h ARG 36 N -0.48 -0.03 -0.81 2.90 0.11 -1.97 -1.67 114.38 112.43 2gbr h ARG 36 Ca -0.45 0.00 0.22 0.00 0.10 0.00 0.00 59.98 59.86 2gbr h ARG 36 Cb 1.30 0.01 -0.15 0.00 1.11 0.00 0.00 29.97 32.23 2gbr h ARG 36 CO 0.60 -0.02 0.02 0.91 0.10 0.00 0.00 179.97 181.58 2gbr n TRP 37 N -5.30 0.52 0.94 4.08 7.02 -1.26 0.38 117.44 123.83 2gbr n TRP 37 Ca 0.01 0.98 0.10 0.00 -1.02 0.00 0.00 57.50 57.57 2gbr n TRP 37 Cb 0.21 -1.11 0.50 0.00 -2.42 0.00 0.00 31.31 28.49 2gbr n TRP 37 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2gbr n ALA 38 N -3.25 2.05 0.29 6.99 0.00 -0.63 -3.05 120.51 122.90 2gbr n ALA 38 Ca 0.19 -0.09 0.18 0.00 0.00 0.00 0.00 53.44 53.72 2gbr n ALA 38 Cb 0.63 -1.32 0.96 0.00 0.00 0.00 0.00 19.45 19.72 2gbr n ALA 38 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2gbr h LEU 39 N 0.00 0.00 0.00 0.00 3.38 0.70 -1.84 115.31 117.55 2gbr h LEU 39 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2gbr h LEU 39 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2gbr h LEU 39 CO 0.00 0.00 -0.94 0.00 0.09 0.00 0.00 178.44 177.59 2gbr n ALA 40 N -1.98 3.90 -2.54 1.53 0.00 -1.17 -4.84 120.51 115.42 2gbr n ALA 40 Ca -0.02 -0.47 -0.43 0.00 0.00 0.00 0.00 53.44 52.52 2gbr n ALA 40 Cb 0.09 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 18.56 2gbr n ALA 40 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2gbr s ILE 41 N -3.10 4.73 0.72 0.00 -1.09 -0.69 -5.04 121.20 116.74 2gbr s ILE 41 Ca 0.06 0.36 -0.16 0.00 -2.23 0.00 0.00 60.65 58.68 2gbr s ILE 41 Cb 0.16 -4.26 0.03 0.00 -1.58 0.00 0.00 42.46 36.81 2gbr s ILE 41 CO 0.81 -0.64 1.24 -2.16 -1.23 0.00 0.00 174.94 172.97 2gbr s PRO 42 N 3.08 2.12 0.28 2.79 0.04 -1.26 -4.92 135.00 137.13 2gbr s PRO 42 Ca 0.27 1.89 -0.02 0.00 0.04 0.00 0.00 61.00 63.18 2gbr s PRO 42 Cb -0.13 -1.82 0.40 0.00 0.04 0.00 0.00 34.50 32.99 2gbr s PRO 42 CO 0.21 -1.88 1.84 -1.00 0.04 0.00 0.00 177.00 176.21 2gbr h PRO 43 N -0.17 0.88 -0.03 0.56 0.13 -1.96 -2.42 132.00 129.00 2gbr h PRO 43 Ca -0.48 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2gbr h PRO 43 Cb 1.31 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2gbr h PRO 43 CO 0.50 0.75 0.00 -0.40 -0.23 0.00 0.00 178.00 178.62 2gbr n ASP 44 N -4.30 0.26 -0.40 1.44 5.75 -1.26 -2.67 116.55 115.38 2gbr n ASP 44 Ca 0.05 -1.57 0.08 0.00 -0.01 0.00 0.00 54.79 53.34 2gbr n ASP 44 Cb 0.19 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 2gbr n ASP 44 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 2gbr n GLN 45 N -0.56 1.60 -4.71 0.11 7.27 -0.91 -4.93 117.38 115.25 2gbr n GLN 45 Ca 0.12 -0.87 -0.33 0.00 0.07 0.00 0.00 57.00 55.98 2gbr n GLN 45 Cb 0.09 -1.31 -0.12 0.00 2.41 0.00 0.00 30.24 31.31 2gbr n GLN 45 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2gbr s GLN 46 N -1.97 2.82 0.06 3.69 -0.21 -1.09 -1.45 119.66 121.52 2gbr s GLN 46 Ca 0.14 -0.61 0.06 0.00 0.02 0.00 0.00 55.36 54.98 2gbr s GLN 46 Cb 0.14 -2.55 -0.03 0.00 1.00 0.00 0.00 33.01 31.57 2gbr s GLN 46 CO 0.42 0.56 -0.17 -0.98 -2.12 0.00 0.00 175.29 173.01 2gbr s ARG 47 N -0.55 1.03 -0.04 2.91 1.70 -0.26 -4.91 118.95 118.83 2gbr s ARG 47 Ca 0.08 -0.93 -0.14 0.00 -0.47 0.00 0.00 55.73 54.27 2gbr s ARG 47 Cb -0.12 -1.12 -0.05 0.00 -0.57 0.00 0.00 34.95 33.09 2gbr s ARG 47 CO 0.02 0.27 0.36 -0.51 -1.08 0.00 0.00 175.30 174.36 2gbr s LEU 48 N -1.46 4.43 0.03 -1.89 1.43 -1.26 -0.38 118.68 119.57 2gbr s LEU 48 Ca 0.03 0.84 0.08 0.00 -1.03 0.00 0.00 54.13 54.05 2gbr s LEU 48 Cb -0.09 -2.50 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 2gbr s LEU 48 CO 0.02 0.29 -0.24 -0.63 0.23 0.00 0.00 176.35 176.02 2gbr s ILE 49 N -0.78 2.32 -0.08 -0.59 -1.09 0.49 -0.89 121.20 120.58 2gbr s ILE 49 Ca 0.22 -1.26 -0.04 0.00 -2.23 0.00 0.00 60.65 57.35 2gbr s ILE 49 Cb -0.16 -1.90 0.04 0.00 -1.58 0.00 0.00 42.46 38.86 2gbr s ILE 49 CO 0.11 0.41 0.18 0.12 -1.23 0.00 0.00 174.94 174.53 2gbr s PHE 50 N -0.79 -0.22 -1.44 3.97 5.36 -0.79 -0.82 117.98 123.25 2gbr s PHE 50 Ca 0.12 0.61 -0.07 0.00 -0.96 0.00 0.00 56.93 56.62 2gbr s PHE 50 Cb -0.10 -0.08 0.05 0.00 -0.34 0.00 0.00 43.02 42.55 2gbr s PHE 50 CO 0.02 -0.21 0.80 0.00 -1.46 0.00 0.00 175.22 174.37 2gbr n ALA 51 N 4.44 -1.65 0.00 11.12 0.00 -1.26 -1.23 120.51 131.94 2gbr n ALA 51 Ca -0.22 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2gbr n ALA 51 Cb 0.52 -3.11 0.00 0.00 0.00 0.00 0.00 19.45 16.85 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 -1.67 2.88 3.84 0.00 0.00 -1.26 -5.02 105.19 103.97 2gbr n GLY 52 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.05 3.79 -0.20 1.61 1.02 -0.36 -5.07 119.74 120.48 2gbr s LYS 53 Ca 0.00 0.18 -0.29 0.00 0.02 0.00 0.00 55.97 55.88 2gbr s LYS 53 Cb 0.00 -3.24 0.00 0.00 -0.52 0.00 0.00 37.83 34.08 2gbr s LYS 53 CO 0.00 0.66 1.03 1.14 -0.92 0.00 0.00 175.35 177.26 2gbr s GLN 54 N -0.86 4.30 -0.00 1.68 -2.07 -1.26 -1.88 119.66 119.57 2gbr s GLN 54 Ca 0.20 1.36 -0.23 0.00 -1.82 0.00 0.00 55.36 54.87 2gbr s GLN 54 Cb -0.15 -3.62 -0.05 0.00 -1.09 0.00 0.00 33.01 28.11 2gbr s GLN 54 CO 0.09 -0.55 0.68 -0.51 -1.32 0.00 0.00 175.29 173.68 2gbr s LEU 55 N 2.91 4.40 -0.01 2.60 1.43 -0.07 -5.00 118.68 124.94 2gbr s LEU 55 Ca 0.45 1.27 -0.17 0.00 -1.03 0.00 0.00 54.13 54.65 2gbr s LEU 55 Cb -0.16 -3.08 -0.06 0.00 0.03 0.00 0.00 46.19 42.93 2gbr s LEU 55 CO 0.09 0.01 0.48 -1.61 0.23 0.00 0.00 176.35 175.55 2gbr s GLU 56 N 0.12 4.12 0.43 1.70 2.02 -1.26 -4.56 118.70 121.26 2gbr s GLU 56 Ca 0.35 0.52 0.17 0.00 0.02 0.00 0.00 54.97 56.04 2gbr s GLU 56 Cb -0.19 -3.29 1.08 0.00 0.10 0.00 0.00 34.13 31.84 2gbr s GLU 56 CO 0.19 0.53 1.89 -0.44 0.02 0.00 0.00 175.26 177.45 2gbr h ASP 57 N 5.21 0.38 0.14 -0.19 5.19 -1.96 -2.10 116.42 123.09 2gbr h ASP 57 Ca -0.48 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2gbr h ASP 57 Cb 1.21 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.67 2gbr h ASP 57 CO 0.66 0.18 -0.25 0.61 -3.12 0.00 0.00 179.24 177.32 2gbr n GLY 58 N -1.53 -0.33 3.96 2.75 0.00 -1.26 0.07 105.19 108.85 2gbr n GLY 58 Ca 0.17 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.40 3.04 0.32 1.61 1.81 -0.79 -4.86 118.95 117.67 2gbr s ARG 59 Ca 0.25 -0.55 0.04 0.00 -1.72 0.00 0.00 55.73 53.76 2gbr s ARG 59 Cb 0.19 -2.58 -0.02 0.00 -0.45 0.00 0.00 34.95 32.10 2gbr s ARG 59 CO 0.49 -0.27 0.47 0.95 -0.68 0.00 0.00 175.30 176.27 2gbr s THR 60 N -2.54 4.69 0.33 0.02 -4.23 -1.26 -1.21 115.64 111.44 2gbr s THR 60 Ca 0.49 -0.83 0.06 0.00 -1.18 0.00 0.00 61.69 60.23 2gbr s THR 60 Cb -0.10 -3.67 0.31 0.00 1.34 0.00 0.00 72.50 70.38 2gbr s THR 60 CO 0.37 -0.32 1.86 -0.07 -0.54 0.00 0.00 174.62 175.93 2gbr h LEU 61 N 0.90 0.75 -1.07 4.79 3.38 -0.87 -1.90 115.31 121.30 2gbr h LEU 61 Ca -0.49 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 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 0.58 0.39 -0.05 0.77 0.09 0.00 0.00 178.44 180.23 2gbr h SER 62 N 0.80 0.58 -0.36 -0.43 4.64 -1.37 -1.95 113.55 115.47 2gbr h SER 62 Ca 0.46 -0.14 0.09 0.00 -0.47 0.00 0.00 61.79 61.74 2gbr h SER 62 Cb 0.62 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.54 2gbr h SER 62 CO -0.22 0.68 0.25 0.44 -0.87 0.00 0.00 176.83 177.11 2gbr h ASP 63 N 0.57 0.05 -0.58 4.97 3.32 -1.64 -2.61 116.42 120.50 2gbr h ASP 63 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2gbr h ASP 63 Cb 0.43 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2gbr h ASP 63 CO 0.02 0.03 0.00 -1.22 -1.72 0.00 0.00 179.24 176.35 2gbr n TYR 64 N -4.45 0.86 -2.78 4.55 4.01 -0.80 -4.95 117.16 113.60 2gbr n TYR 64 Ca 0.05 -0.52 -0.18 0.00 -0.16 0.00 0.00 57.90 57.09 2gbr n TYR 64 Cb 0.39 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.38 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 1.15 -4.38 -4.65 7.72 2.85 -0.98 -4.92 115.26 112.05 2gbr n ASN 65 Ca 0.20 -0.06 -0.43 0.00 -0.11 0.00 0.00 54.58 54.18 2gbr n ASN 65 Cb 0.60 -3.65 -0.02 0.00 1.24 0.00 0.00 39.78 37.94 2gbr n ASN 65 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2gbr s ILE 66 N -2.83 4.30 0.52 -1.44 1.01 -0.82 -5.01 121.20 116.93 2gbr s ILE 66 Ca 0.16 1.53 0.07 0.00 0.00 0.00 0.00 60.65 62.41 2gbr s ILE 66 Cb -0.08 -4.14 0.03 0.00 0.01 0.00 0.00 42.46 38.28 2gbr s ILE 66 CO 0.19 -0.31 0.50 -1.10 0.00 0.00 0.00 174.94 174.22 2gbr s GLN 67 N 3.74 2.35 0.43 2.79 -1.52 -1.26 -4.65 119.66 121.54 2gbr s GLN 67 Ca 0.53 -1.78 -0.26 0.00 -1.95 0.00 0.00 55.36 51.90 2gbr s GLN 67 Cb -0.18 -2.33 -0.09 0.00 -0.22 0.00 0.00 33.01 30.19 2gbr s GLN 67 CO 0.17 -0.56 1.39 1.17 -0.25 0.00 0.00 175.29 177.20 2gbr n LYS 68 N -1.83 2.21 -1.19 2.91 4.81 -1.26 -1.96 118.16 121.84 2gbr n LYS 68 Ca 0.04 0.78 -0.07 0.00 -0.87 0.00 0.00 58.31 58.20 2gbr n LYS 68 Cb 0.63 -2.55 -0.03 0.00 0.02 0.00 0.00 35.03 33.10 2gbr n LYS 68 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2gbr n GLU 69 N -0.01 -0.88 -2.15 1.64 1.02 0.11 -5.01 120.64 115.37 2gbr n GLU 69 Ca 0.05 0.64 -0.38 0.00 -0.02 0.00 0.00 57.16 57.45 2gbr n GLU 69 Cb 0.40 -4.54 -0.00 0.00 -0.02 0.00 0.00 31.44 27.28 2gbr n GLU 69 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2gbr s SER 70 N -2.53 6.17 -0.21 1.62 0.01 -0.83 -4.75 113.70 113.19 2gbr s SER 70 Ca 0.00 2.47 -0.06 0.00 1.31 0.00 0.00 55.95 59.67 2gbr s SER 70 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 2gbr s SER 70 CO 0.00 -0.93 0.04 -0.89 0.41 0.00 0.00 173.24 171.87 2gbr s THR 71 N -1.40 4.34 0.28 1.44 2.01 -1.26 -1.10 115.64 119.95 2gbr s THR 71 Ca 0.61 -0.18 0.06 0.00 0.31 0.00 0.00 61.69 62.49 2gbr s THR 71 Cb -0.33 -2.98 -0.02 0.00 0.01 0.00 0.00 72.50 69.18 2gbr s THR 71 CO 0.41 0.41 0.37 -0.76 -0.69 0.00 0.00 174.62 174.36 2gbr s LEU 72 N 0.97 4.10 -0.10 4.42 1.02 0.48 -4.79 118.68 124.77 2gbr s LEU 72 Ca 0.03 -0.09 0.03 0.00 0.02 0.00 0.00 54.13 54.12 2gbr s LEU 72 Cb -0.14 -2.72 0.01 0.00 0.02 0.00 0.00 46.19 43.36 2gbr s LEU 72 CO 0.02 -0.20 -0.18 -1.00 0.02 0.00 0.00 176.35 175.02 2gbr s HIS 73 N -2.08 2.13 -0.31 0.29 3.76 -0.00 -0.74 115.29 118.33 2gbr s HIS 73 Ca 0.38 -0.94 -0.22 0.00 -0.15 0.00 0.00 55.06 54.13 2gbr s HIS 73 Cb -0.09 -1.49 -0.00 0.00 1.11 0.00 0.00 32.58 32.11 2gbr s HIS 73 CO 0.29 -0.44 0.71 -1.17 -0.85 0.00 0.00 174.74 173.28 2gbr s LEU 74 N 0.73 4.12 0.26 0.89 2.96 -0.10 -0.38 118.68 127.17 2gbr s LEU 74 Ca -0.11 0.52 0.04 0.00 -0.22 0.00 0.00 54.13 54.36 2gbr s LEU 74 Cb -0.16 -2.94 -0.06 0.00 0.50 0.00 0.00 46.19 43.53 2gbr s LEU 74 CO 0.02 -0.56 -0.00 0.68 -1.32 0.00 0.00 176.35 175.17 2gbr s VAL 75 N 2.79 1.21 0.62 1.68 -7.23 0.49 -3.88 120.40 116.09 2gbr s VAL 75 Ca 0.29 -2.05 -0.15 0.00 -1.81 0.00 0.00 61.98 58.26 2gbr s VAL 75 Cb -0.14 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.31 2gbr s VAL 75 CO 0.12 -0.25 1.06 -0.76 -0.31 0.00 0.00 175.10 174.97 2gbr s LEU 76 N -3.38 3.42 0.00 1.32 1.43 -1.26 -1.10 118.68 119.11 2gbr s LEU 76 Ca 0.30 1.79 0.00 0.00 -1.03 0.00 0.00 54.13 55.19 2gbr s LEU 76 Cb 0.06 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.75 2gbr s LEU 76 CO 0.11 -1.26 0.00 -1.14 0.23 0.00 0.00 176.35 174.29