#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bgf s GLN 2 N 0.00 4.19 0.05 3.17 0.74 -1.26 -1.21 119.66 125.34 2bgf s GLN 2 Ca 0.00 0.84 0.00 0.00 0.05 0.00 0.00 55.36 56.25 2bgf s GLN 2 Cb 0.00 -2.69 -0.03 0.00 1.10 0.00 0.00 33.01 31.38 2bgf s GLN 2 CO 0.00 0.29 -0.04 0.96 -0.55 0.00 0.00 175.29 175.95 2bgf s ILE 3 N -1.71 0.30 -0.35 -2.34 -4.36 -0.87 0.09 121.20 111.96 2bgf s ILE 3 Ca 0.48 -1.49 0.00 0.00 -0.26 0.00 0.00 60.65 59.39 2bgf s ILE 3 Cb -0.14 -1.08 0.09 0.00 1.25 0.00 0.00 42.46 42.58 2bgf s ILE 3 CO 0.20 -0.77 0.08 -0.36 0.24 0.00 0.00 174.94 174.33 2bgf s PHE 4 N -2.88 3.56 -0.65 1.37 0.08 0.39 -3.35 117.98 116.50 2bgf s PHE 4 Ca -0.01 -2.53 -0.17 0.00 0.12 0.00 0.00 56.93 54.35 2bgf s PHE 4 Cb 0.00 -2.78 0.14 0.00 -0.57 0.00 0.00 43.02 39.82 2bgf s PHE 4 CO -0.05 -0.92 0.68 0.08 -0.10 0.00 0.00 175.22 174.90 2bgf s VAL 5 N 1.07 5.13 -0.30 -0.44 1.01 -0.72 -1.91 120.40 124.24 2bgf s VAL 5 Ca 0.05 -1.56 -0.20 0.00 0.00 0.00 0.00 61.98 60.28 2bgf s VAL 5 Cb -0.21 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 31.71 2bgf s VAL 5 CO -0.05 -1.04 0.59 -0.54 0.00 0.00 0.00 175.10 174.06 2bgf s LYS 6 N 1.72 3.90 0.74 2.72 1.02 -0.29 -1.18 119.74 128.38 2bgf s LYS 6 Ca 0.12 0.25 -0.11 0.00 0.02 0.00 0.00 55.97 56.25 2bgf s LYS 6 Cb -0.22 -3.72 0.04 0.00 -0.52 0.00 0.00 37.83 33.41 2bgf s LYS 6 CO 0.00 -0.54 1.09 0.95 -0.92 0.00 0.00 175.35 175.94 2bgf s THR 7 N 2.53 3.44 -1.64 2.17 -4.23 0.74 -2.86 115.64 115.77 2bgf s THR 7 Ca 0.24 0.47 0.30 0.00 -1.18 0.00 0.00 61.69 61.51 2bgf s THR 7 Cb -0.15 -3.31 0.57 0.00 1.34 0.00 0.00 72.50 70.95 2bgf s THR 7 CO 0.11 -0.61 2.00 0.18 -0.54 0.00 0.00 174.62 175.77 2bgf n LEU 8 N -3.21 0.22 0.17 4.79 4.32 -0.99 -2.83 117.00 119.48 2bgf n LEU 8 Ca 0.07 0.11 0.12 0.00 -0.02 0.00 0.00 56.01 56.29 2bgf n LEU 8 Cb 0.56 -0.19 0.21 0.00 -1.62 0.00 0.00 43.42 42.38 2bgf n LEU 8 CO 0.57 0.04 0.73 0.71 -1.22 0.00 0.00 177.39 178.22 2bgf h THR 9 N 0.28 0.00 0.00 -5.08 1.35 -1.92 -3.47 112.91 104.06 2bgf h THR 9 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 2bgf h THR 9 Cb 0.27 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 2bgf h THR 9 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2bgf n GLY 10 N 1.17 1.83 3.25 5.82 0.00 -1.13 -5.13 105.19 111.00 2bgf n GLY 10 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 2bgf n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bgf s LYS 11 N -0.46 1.04 -0.03 1.61 -2.85 -1.26 -4.98 119.74 112.81 2bgf s LYS 11 Ca 0.00 -1.34 0.07 0.00 -1.00 0.00 0.00 55.97 53.70 2bgf s LYS 11 Cb 0.00 -0.78 -0.02 0.00 -2.06 0.00 0.00 37.83 34.98 2bgf s LYS 11 CO 0.00 0.13 -0.24 0.99 0.10 0.00 0.00 175.35 176.32 2bgf s THR 12 N -2.68 1.95 -0.06 3.79 2.01 -1.26 -0.19 115.64 119.20 2bgf s THR 12 Ca 0.12 -1.04 0.04 0.00 0.31 0.00 0.00 61.69 61.13 2bgf s THR 12 Cb -0.02 -1.63 -0.02 0.00 0.01 0.00 0.00 72.50 70.84 2bgf s THR 12 CO 0.02 0.55 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.69 2bgf s ILE 13 N -0.40 2.76 -0.30 1.82 1.01 -0.33 -4.96 121.20 120.80 2bgf s ILE 13 Ca 0.04 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 59.83 2bgf s ILE 13 Cb -0.11 -2.07 0.04 0.00 0.01 0.00 0.00 42.46 40.33 2bgf s ILE 13 CO 0.01 0.58 0.03 -0.89 0.00 0.00 0.00 174.94 174.67 2bgf s THR 14 N -0.46 3.36 0.05 2.92 2.01 -1.26 -1.76 115.64 120.49 2bgf s THR 14 Ca 0.06 -1.15 0.08 0.00 0.31 0.00 0.00 61.69 60.98 2bgf s THR 14 Cb -0.12 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.50 2bgf s THR 14 CO 0.02 -0.06 -0.22 -0.76 -0.69 0.00 0.00 174.62 172.91 2bgf s LEU 15 N 1.34 2.44 -1.03 4.42 1.43 -1.21 -4.98 118.68 121.09 2bgf s LEU 15 Ca -0.02 -0.51 -0.05 0.00 -1.03 0.00 0.00 54.13 52.51 2bgf s LEU 15 Cb -0.19 -1.42 0.27 0.00 0.03 0.00 0.00 46.19 44.89 2bgf s LEU 15 CO 0.00 0.25 1.13 -0.62 0.23 0.00 0.00 176.35 177.34 2bgf n GLU 16 N 1.55 3.57 -2.17 1.70 -0.58 -1.26 -2.05 120.64 121.39 2bgf n GLU 16 Ca -0.17 -4.51 -0.26 0.00 -0.42 0.00 0.00 57.16 51.81 2bgf n GLU 16 Cb 0.52 -2.49 0.08 0.00 -0.57 0.00 0.00 31.44 28.98 2bgf n GLU 16 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2bgf s VAL 17 N -1.84 2.22 0.14 2.62 -7.23 -0.35 -4.57 120.40 111.40 2bgf s VAL 17 Ca 0.31 -0.24 0.04 0.00 -1.81 0.00 0.00 61.98 60.27 2bgf s VAL 17 Cb -0.03 -2.98 -0.04 0.00 0.56 0.00 0.00 36.38 33.89 2bgf s VAL 17 CO -0.03 0.00 0.17 -1.61 -0.31 0.00 0.00 175.10 173.32 2bgf s GLU 18 N -5.31 3.08 0.36 4.82 2.02 -1.26 0.38 118.70 122.80 2bgf s GLU 18 Ca 0.61 -0.73 0.06 0.00 0.02 0.00 0.00 54.97 54.94 2bgf s GLU 18 Cb -0.10 -2.78 0.75 0.00 0.10 0.00 0.00 34.13 32.11 2bgf s GLU 18 CO 0.46 0.52 1.95 -1.35 0.02 0.00 0.00 175.26 176.86 2bgf h PRO 19 N 2.55 0.72 -0.64 0.39 0.11 -1.96 -0.99 132.00 132.18 2bgf h PRO 19 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2bgf h PRO 19 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2bgf h PRO 19 CO 0.66 0.48 0.00 0.43 -0.21 0.00 0.00 178.00 179.36 2bgf n SER 20 N -4.48 4.87 -4.70 -2.05 7.64 -1.26 -3.71 113.62 109.93 2bgf n SER 20 Ca 0.11 -2.71 -0.42 0.00 1.01 0.00 0.00 58.87 56.86 2bgf n SER 20 Cb 0.24 -0.63 -0.03 0.00 -1.01 0.00 0.00 64.21 62.78 2bgf n SER 20 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2bgf s ASP 21 N -0.70 7.23 0.55 6.43 2.15 -0.38 -4.90 116.67 127.06 2bgf s ASP 21 Ca 0.46 1.68 -0.19 0.00 0.43 0.00 0.00 52.55 54.93 2bgf s ASP 21 Cb 0.34 -2.56 -0.05 0.00 -0.30 0.00 0.00 42.92 40.34 2bgf s ASP 21 CO 0.15 -0.42 1.11 0.42 -0.17 0.00 0.00 175.17 176.26 2bgf s THR 22 N 1.63 3.32 0.29 1.71 -4.23 -1.26 -2.40 115.64 114.71 2bgf s THR 22 Ca 0.52 0.78 0.02 0.00 -1.18 0.00 0.00 61.69 61.83 2bgf s THR 22 Cb -0.22 -3.30 0.29 0.00 1.34 0.00 0.00 72.50 70.61 2bgf s THR 22 CO 0.23 -0.22 1.87 0.40 -0.54 0.00 0.00 174.62 176.36 2bgf h ILE 23 N 1.05 0.97 -0.44 2.99 1.08 -0.43 0.05 117.51 122.78 2bgf h ILE 23 Ca -0.49 -0.34 -0.06 0.00 -0.39 0.00 0.00 64.86 63.57 2bgf h ILE 23 Cb 1.25 -0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 34.87 2bgf h ILE 23 CO 0.57 0.18 0.01 -0.08 -0.69 0.00 0.00 178.15 178.14 2bgf h GLU 24 N 0.99 0.70 0.00 2.37 4.22 -1.49 -0.96 114.58 120.42 2bgf h GLU 24 Ca 0.46 -0.17 -0.15 0.00 0.08 0.00 0.00 59.36 59.58 2bgf h GLU 24 Cb 0.40 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2bgf h GLU 24 CO -0.21 0.71 -0.69 -0.97 -2.18 0.00 0.00 179.01 175.66 2bgf h ASN 25 N 0.66 0.00 -0.30 1.04 -1.24 -1.37 -0.40 115.58 113.98 2bgf h ASN 25 Ca 0.14 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.10 2bgf h ASN 25 Cb 0.40 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.44 2bgf h ASN 25 CO 0.01 0.69 0.00 0.58 -1.29 0.00 0.00 177.43 177.43 2bgf h VAL 26 N 0.00 1.26 -0.70 2.57 2.07 -0.48 -2.20 116.25 118.76 2bgf h VAL 26 Ca -0.01 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.53 2bgf h VAL 26 Cb 1.23 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 32.25 2bgf h VAL 26 CO 0.09 0.30 0.23 0.11 0.02 0.00 0.00 177.57 178.32 2bgf h LYS 27 N 0.31 1.07 -0.65 1.57 1.57 -1.03 -2.19 116.57 117.22 2bgf h LYS 27 Ca 0.08 -0.21 0.06 0.00 -1.87 0.00 0.00 60.65 58.71 2bgf h LYS 27 Cb 0.43 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2bgf h LYS 27 CO 0.01 0.90 0.43 0.00 -0.57 0.00 0.00 179.45 180.22 2bgf h ALA 28 N 1.22 1.76 -0.34 3.86 0.00 -0.82 -0.97 119.26 123.97 2bgf h ALA 28 Ca 0.23 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2bgf h ALA 28 Cb 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2bgf h ALA 28 CO -0.01 0.14 0.07 0.87 0.00 0.00 0.00 179.25 180.32 2bgf h LYS 29 N 0.66 0.54 -0.83 0.00 1.57 -0.77 -1.32 116.57 116.42 2bgf h LYS 29 Ca 0.28 -0.14 0.05 0.00 -1.87 0.00 0.00 60.65 58.98 2bgf h LYS 29 Cb 0.26 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.44 2bgf h LYS 29 CO -0.09 0.61 0.51 0.82 -0.57 0.00 0.00 179.45 180.74 2bgf h ILE 30 N 0.39 1.05 -0.76 1.86 2.04 -1.14 0.12 117.51 121.07 2bgf h ILE 30 Ca 0.10 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.69 2bgf h ILE 30 Cb 0.32 0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.37 2bgf h ILE 30 CO 0.00 0.17 0.50 -0.61 0.00 0.00 0.00 178.15 178.22 2bgf h GLN 31 N 0.95 0.81 -0.21 2.37 4.15 -0.72 0.28 115.11 122.75 2bgf h GLN 31 Ca 0.36 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.67 2bgf h GLN 31 Cb 0.14 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 2bgf h GLN 31 CO -0.16 0.54 -0.09 -0.44 -1.93 0.00 0.00 178.83 176.74 2bgf h ASP 32 N 0.84 0.44 0.00 -0.69 3.32 0.03 -2.39 116.42 117.97 2bgf h ASP 32 Ca 0.32 -0.41 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2bgf h ASP 32 Cb 0.20 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2bgf h ASP 32 CO -0.11 0.75 0.00 0.29 -1.72 0.00 0.00 179.24 178.46 2bgf n LYS 33 N -4.56 0.00 0.21 3.56 5.02 -0.13 -4.42 118.16 117.84 2bgf n LYS 33 Ca -0.05 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.39 2bgf n LYS 33 Cb 0.32 -0.27 0.73 0.00 -0.02 0.00 0.00 35.03 35.79 2bgf n LYS 33 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2bgf h GLU 34 N 0.00 0.00 -0.83 1.97 4.39 -0.74 -3.46 114.58 115.92 2bgf h GLU 34 Ca 0.00 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 2bgf h GLU 34 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2bgf h GLU 34 CO 0.00 0.00 -0.15 0.41 -1.16 0.00 0.00 179.01 178.11 2bgf n GLY 35 N -0.85 0.16 3.57 -3.84 0.00 -0.35 -4.96 105.19 98.91 2bgf n GLY 35 Ca -0.01 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 2bgf n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bgf s ILE 36 N -2.30 5.08 0.29 -0.61 1.01 -1.23 -4.89 121.20 118.55 2bgf s ILE 36 Ca 0.00 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 2bgf s ILE 36 Cb 0.00 -3.40 -0.11 0.00 0.01 0.00 0.00 42.46 38.96 2bgf s ILE 36 CO 0.00 0.29 1.61 -2.84 0.00 0.00 0.00 174.94 174.00 2bgf s PRO 37 N 1.59 4.12 0.32 2.79 0.02 -1.26 -2.89 135.00 139.69 2bgf s PRO 37 Ca 0.07 2.59 0.06 0.00 0.02 0.00 0.00 61.00 63.74 2bgf s PRO 37 Cb -0.15 -3.03 0.74 0.00 0.02 0.00 0.00 34.50 32.08 2bgf s PRO 37 CO 0.08 -0.65 1.81 -1.35 -0.33 0.00 0.00 177.00 176.56 2bgf h PRO 38 N 5.05 0.75 0.00 5.54 0.11 -1.93 0.89 132.00 142.41 2bgf h PRO 38 Ca -0.47 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 2bgf h PRO 38 Cb 1.22 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 2bgf h PRO 38 CO 0.81 0.50 -0.14 -0.44 -0.21 0.00 0.00 178.00 178.52 2bgf h ASP 39 N 0.78 0.00 -0.36 -2.05 3.32 -1.96 -1.24 116.42 114.91 2bgf h ASP 39 Ca 0.54 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.59 2bgf h ASP 39 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2bgf h ASP 39 CO -0.32 0.14 0.00 0.00 -1.72 0.00 0.00 179.24 177.35 2bgf n GLN 40 N -4.09 3.33 -5.05 3.56 3.00 0.30 -4.87 117.38 113.56 2bgf n GLN 40 Ca -0.02 -1.93 -0.30 0.00 -0.01 0.00 0.00 57.00 54.73 2bgf n GLN 40 Cb 0.22 -1.94 -0.15 0.00 0.00 0.00 0.00 30.24 28.37 2bgf n GLN 40 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2bgf s GLN 41 N -2.04 1.89 -0.22 -1.09 -0.21 -0.47 -0.17 119.66 117.34 2bgf s GLN 41 Ca 0.34 -1.01 -0.01 0.00 0.02 0.00 0.00 55.36 54.69 2bgf s GLN 41 Cb 0.25 -1.96 0.06 0.00 1.00 0.00 0.00 33.01 32.37 2bgf s GLN 41 CO 0.11 0.52 -0.00 1.03 -2.12 0.00 0.00 175.29 174.82 2bgf s ARG 42 N -0.95 1.12 -0.42 2.91 1.81 -0.77 -4.86 118.95 117.78 2bgf s ARG 42 Ca 0.11 -0.73 -0.20 0.00 -1.72 0.00 0.00 55.73 53.18 2bgf s ARG 42 Cb -0.10 -2.34 0.02 0.00 -0.45 0.00 0.00 34.95 32.08 2bgf s ARG 42 CO 0.01 -0.64 0.63 -0.51 -0.68 0.00 0.00 175.30 174.11 2bgf s LEU 43 N 1.62 4.45 -0.10 2.53 1.43 -1.26 -1.40 118.68 125.95 2bgf s LEU 43 Ca -0.03 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 2bgf s LEU 43 Cb -0.18 -2.73 -0.02 0.00 0.03 0.00 0.00 46.19 43.29 2bgf s LEU 43 CO -0.08 -0.73 -0.10 -0.63 0.23 0.00 0.00 176.35 175.04 2bgf s ILE 44 N 2.77 3.36 -0.06 -0.59 1.01 0.70 -1.22 121.20 127.18 2bgf s ILE 44 Ca 0.23 -0.58 -0.02 0.00 0.00 0.00 0.00 60.65 60.28 2bgf s ILE 44 Cb -0.14 -2.40 0.03 0.00 0.01 0.00 0.00 42.46 39.96 2bgf s ILE 44 CO 0.18 0.55 0.03 0.12 0.00 0.00 0.00 174.94 175.82 2bgf s PHE 45 N -0.14 0.36 -0.54 3.97 5.36 0.16 -1.21 117.98 125.94 2bgf s PHE 45 Ca 0.00 0.02 0.00 0.00 -0.96 0.00 0.00 56.93 56.00 2bgf s PHE 45 Cb -0.13 -0.65 0.00 0.00 -0.34 0.00 0.00 43.02 41.90 2bgf s PHE 45 CO 0.03 -0.27 0.00 0.00 -1.46 0.00 0.00 175.22 173.52 2bgf n ALA 46 N 5.22 -0.08 0.00 11.12 0.00 -1.26 -1.04 120.51 134.48 2bgf n ALA 46 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2bgf n ALA 46 Cb 0.50 -1.61 0.00 0.00 0.00 0.00 0.00 19.45 18.34 2bgf n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bgf n GLY 47 N 0.58 2.11 3.92 0.00 0.00 -1.26 -5.09 105.19 105.45 2bgf n GLY 47 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 2bgf n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bgf s LYS 48 N -0.30 3.21 -0.11 1.61 3.01 -0.20 -5.11 119.74 121.84 2bgf s LYS 48 Ca 0.00 -0.91 -0.01 0.00 -1.01 0.00 0.00 55.97 54.04 2bgf s LYS 48 Cb 0.00 -2.76 -0.03 0.00 -1.01 0.00 0.00 37.83 34.03 2bgf s LYS 48 CO 0.00 0.37 -0.06 -0.65 0.51 0.00 0.00 175.35 175.51 2bgf s GLN 49 N -3.96 3.20 0.33 1.68 -0.21 -1.26 0.37 119.66 119.81 2bgf s GLN 49 Ca 0.35 -0.55 -0.26 0.00 0.02 0.00 0.00 55.36 54.92 2bgf s GLN 49 Cb -0.09 -2.73 -0.10 0.00 1.00 0.00 0.00 33.01 31.10 2bgf s GLN 49 CO 0.28 0.44 0.95 -0.51 -2.12 0.00 0.00 175.29 174.33 2bgf s LEU 50 N -0.20 4.31 0.03 2.90 1.43 -0.36 -4.97 118.68 121.82 2bgf s LEU 50 Ca 0.03 1.85 -0.23 0.00 -1.03 0.00 0.00 54.13 54.74 2bgf s LEU 50 Cb -0.13 -4.05 -0.06 0.00 0.03 0.00 0.00 46.19 41.99 2bgf s LEU 50 CO 0.03 -0.11 0.70 -0.70 0.23 0.00 0.00 176.35 176.50 2bgf s GLU 51 N -2.13 4.43 0.26 1.70 2.56 -1.26 -4.75 118.70 119.51 2bgf s GLU 51 Ca 0.51 0.95 -0.02 0.00 0.00 0.00 0.00 54.97 56.40 2bgf s GLU 51 Cb -0.18 -3.35 0.42 0.00 2.00 0.00 0.00 34.13 33.01 2bgf s GLU 51 CO 0.24 0.33 1.87 -0.44 -0.56 0.00 0.00 175.26 176.69 2bgf h ASP 52 N 5.58 0.97 -0.14 -1.70 5.19 -1.96 -1.72 116.42 122.65 2bgf h ASP 52 Ca -0.45 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 2bgf h ASP 52 Cb 1.20 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.53 2bgf h ASP 52 CO 0.70 0.60 0.00 0.61 -3.12 0.00 0.00 179.24 178.03 2bgf n GLY 53 N -1.35 1.39 3.95 2.75 0.00 -1.26 -1.48 105.19 109.19 2bgf n GLY 53 Ca 0.15 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 2bgf n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bgf s ARG 54 N -1.48 2.33 0.28 1.61 1.81 -0.65 -4.93 118.95 117.92 2bgf s ARG 54 Ca 0.12 -1.79 0.10 0.00 -1.72 0.00 0.00 55.73 52.44 2bgf s ARG 54 Cb 0.09 -2.36 -0.04 0.00 -0.45 0.00 0.00 34.95 32.18 2bgf s ARG 54 CO 0.04 -0.64 -0.01 0.99 -0.68 0.00 0.00 175.30 175.00 2bgf s THR 55 N -2.68 3.29 0.10 0.02 2.01 -1.26 0.07 115.64 117.19 2bgf s THR 55 Ca 0.47 -1.95 -0.23 0.00 0.31 0.00 0.00 61.69 60.28 2bgf s THR 55 Cb -0.04 -2.80 -0.12 0.00 0.01 0.00 0.00 72.50 69.56 2bgf s THR 55 CO 0.29 -0.36 1.72 -0.07 -0.69 0.00 0.00 174.62 175.51 2bgf h LEU 56 N 1.90 -0.12 -0.59 4.42 3.38 -1.68 -1.99 115.31 120.64 2bgf h LEU 56 Ca -0.44 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2bgf h LEU 56 Cb 1.25 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2bgf h LEU 56 CO 0.61 -0.06 0.00 -1.54 0.09 0.00 0.00 178.44 177.54 2bgf n SER 57 N -5.15 0.26 0.08 -0.43 3.41 -1.24 -1.49 113.62 109.06 2bgf n SER 57 Ca -0.06 0.61 -0.08 0.00 -0.26 0.00 0.00 58.87 59.08 2bgf n SER 57 Cb 0.08 -0.65 0.05 0.00 -0.26 0.00 0.00 64.21 63.43 2bgf n SER 57 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2bgf h ASP 58 N 0.00 0.32 -0.58 4.04 3.32 -1.71 -3.15 116.42 118.66 2bgf h ASP 58 Ca 0.00 -0.22 -0.25 0.00 0.02 0.00 0.00 57.03 56.58 2bgf h ASP 58 Cb 0.05 -0.10 -0.15 0.00 0.22 0.00 0.00 39.33 39.36 2bgf h ASP 58 CO 0.00 0.95 0.19 -1.22 -1.72 0.00 0.00 179.24 177.44 2bgf n TYR 59 N -3.78 1.85 -2.41 4.55 4.01 -0.66 -4.92 117.16 115.80 2bgf n TYR 59 Ca -0.03 -1.47 -0.18 0.00 -0.16 0.00 0.00 57.90 56.05 2bgf n TYR 59 Cb 0.72 -0.62 -0.01 0.00 -0.31 0.00 0.00 39.34 39.11 2bgf n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2bgf n ASN 60 N -0.84 -5.35 -4.67 7.72 5.15 -1.19 -4.94 115.26 111.15 2bgf n ASN 60 Ca 0.40 0.05 -0.42 0.00 -0.60 0.00 0.00 54.58 54.01 2bgf n ASN 60 Cb 1.25 -4.47 -0.04 0.00 -0.53 0.00 0.00 39.78 35.99 2bgf n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2bgf s ILE 61 N -2.92 4.86 0.00 -1.44 1.01 -0.55 -4.99 121.20 117.17 2bgf s ILE 61 Ca 0.00 1.67 0.00 0.00 0.00 0.00 0.00 60.65 62.32 2bgf s ILE 61 Cb 0.00 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.31 2bgf s ILE 61 CO 0.00 0.01 0.00 0.00 0.00 0.00 0.00 174.94 174.95 2bgf n GLN 62 N 5.32 1.45 -1.91 2.79 6.02 -1.26 -4.05 117.38 125.74 2bgf n GLN 62 Ca 0.05 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.66 2bgf n GLN 62 Cb 0.49 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.78 2bgf n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2bgf s LYS 63 N 0.26 3.22 -0.03 -1.09 -2.85 -1.26 -2.62 119.74 115.37 2bgf s LYS 63 Ca 0.00 2.08 0.00 0.00 -1.00 0.00 0.00 55.97 57.05 2bgf s LYS 63 Cb 0.00 -2.23 0.00 0.00 -2.06 0.00 0.00 37.83 33.54 2bgf s LYS 63 CO 0.00 -1.08 0.00 0.39 0.10 0.00 0.00 175.35 174.76 2bgf n GLU 64 N -1.02 -1.99 -2.08 1.78 4.71 0.11 -4.94 120.64 117.21 2bgf n GLU 64 Ca 0.10 0.47 -0.36 0.00 -0.01 0.00 0.00 57.16 57.36 2bgf n GLU 64 Cb 0.46 -4.80 0.02 0.00 -1.01 0.00 0.00 31.44 26.11 2bgf n GLU 64 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2bgf s SER 65 N -1.84 5.54 -0.21 1.62 0.01 -1.08 -4.51 113.70 113.22 2bgf s SER 65 Ca 0.00 2.39 -0.04 0.00 1.31 0.00 0.00 55.95 59.60 2bgf s SER 65 Cb 0.00 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 2bgf s SER 65 CO 0.00 -1.35 -0.02 -0.89 0.41 0.00 0.00 173.24 171.39 2bgf s THR 66 N -1.57 3.64 0.00 1.44 2.01 -1.25 -0.46 115.64 119.45 2bgf s THR 66 Ca 0.72 -0.41 0.07 0.00 0.31 0.00 0.00 61.69 62.39 2bgf s THR 66 Cb -0.30 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.53 2bgf s THR 66 CO 0.34 0.42 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.71 2bgf s LEU 67 N 1.32 2.08 -0.10 4.42 1.43 -0.80 -4.96 118.68 122.07 2bgf s LEU 67 Ca 0.04 -0.44 -0.18 0.00 -1.03 0.00 0.00 54.13 52.51 2bgf s LEU 67 Cb -0.14 -1.12 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 2bgf s LEU 67 CO -0.01 0.25 0.49 -1.00 0.23 0.00 0.00 176.35 176.31 2bgf s HIS 68 N -0.61 3.55 -0.11 0.29 3.76 -0.35 -1.14 115.29 120.68 2bgf s HIS 68 Ca 0.09 0.94 0.01 0.00 -0.15 0.00 0.00 55.06 55.95 2bgf s HIS 68 Cb -0.09 -2.55 -0.01 0.00 1.11 0.00 0.00 32.58 31.04 2bgf s HIS 68 CO 0.00 0.21 -0.16 -1.17 -0.85 0.00 0.00 174.74 172.78 2bgf s LEU 69 N 0.44 2.59 -0.04 0.89 2.96 -1.14 -0.21 118.68 124.17 2bgf s LEU 69 Ca 0.27 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.88 2bgf s LEU 69 Cb -0.16 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 44.96 2bgf s LEU 69 CO 0.11 0.19 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.42 2bgf s VAL 70 N 0.19 1.87 -0.19 1.68 1.01 -0.49 -2.34 120.40 122.12 2bgf s VAL 70 Ca -0.09 -0.98 -0.29 0.00 0.00 0.00 0.00 61.98 60.62 2bgf s VAL 70 Cb -0.15 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 2bgf s VAL 70 CO 0.05 0.53 1.35 -0.76 0.00 0.00 0.00 175.10 176.27 2bgf s LEU 71 N -0.26 4.09 -0.78 3.92 1.43 -1.26 -1.85 118.68 123.96 2bgf s LEU 71 Ca 0.01 1.62 0.02 0.00 -1.03 0.00 0.00 54.13 54.76 2bgf s LEU 71 Cb -0.12 -3.54 0.30 0.00 0.03 0.00 0.00 46.19 42.87 2bgf s LEU 71 CO 0.02 -0.91 1.17 -1.14 0.23 0.00 0.00 176.35 175.72 2bgf n ARG 72 N 6.96 3.73 -2.24 1.70 0.00 0.76 -4.97 116.66 122.60 2bgf n ARG 72 Ca 0.15 -4.72 -0.41 0.00 -0.00 0.00 0.00 57.85 52.87 2bgf n ARG 72 Cb 0.45 -2.34 -0.03 0.00 0.00 0.00 0.00 32.46 30.54 2bgf n ARG 72 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2bgf s LEU 73 N -3.26 4.45 0.34 6.15 1.43 -1.26 -4.26 118.68 122.27 2bgf s LEU 73 Ca 0.41 2.48 0.10 0.00 -1.03 0.00 0.00 54.13 56.09 2bgf s LEU 73 Cb 0.18 -3.63 0.60 0.00 0.03 0.00 0.00 46.19 43.38 2bgf s LEU 73 CO -0.06 -0.44 1.77 0.03 0.23 0.00 0.00 176.35 177.88 2bgf h ARG 74 N 4.26 0.09 -2.14 1.70 2.47 -1.95 -3.30 114.38 115.51 2bgf h ARG 74 Ca -0.47 -0.04 -0.58 0.00 -1.26 0.00 0.00 59.98 57.63 2bgf h ARG 74 Cb 1.22 -0.00 -0.41 0.00 -1.65 0.00 0.00 29.97 29.12 2bgf h ARG 74 CO 0.70 0.47 -0.76 0.41 0.56 0.00 0.00 179.97 181.36 2bgf n GLY 75 N -0.33 4.33 0.00 0.04 0.00 -1.26 -5.27 105.19 102.70 2bgf n GLY 75 Ca -0.02 -2.42 0.00 0.00 0.00 0.00 0.00 46.02 43.59 2bgf n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93