#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbf n SER 2 N 0.00 -8.66 0.00 1.61 7.64 -1.26 -5.02 113.62 107.92 2dbf n SER 2 Ca 0.00 0.84 0.00 0.00 1.01 0.00 0.00 58.87 60.72 2dbf n SER 2 Cb 0.00 -4.56 0.00 0.00 -1.01 0.00 0.00 64.21 58.64 2dbf n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dbf n SER 3 N -4.29 0.00 0.00 6.43 2.88 -1.26 -5.07 113.62 112.31 2dbf n SER 3 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2dbf n SER 3 Cb 0.67 0.06 0.00 0.00 -0.75 0.00 0.00 64.21 64.19 2dbf n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dbf n GLY 4 N -0.95 2.76 3.67 0.46 0.00 -1.26 -5.05 105.19 104.83 2dbf n GLY 4 Ca 0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 46.02 45.33 2dbf n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dbf s SER 5 N 0.00 -0.35 -0.79 1.61 0.15 -1.26 -4.96 113.70 108.10 2dbf s SER 5 Ca 0.00 -0.32 -0.26 0.00 0.70 0.00 0.00 55.95 56.07 2dbf s SER 5 Cb 0.00 0.61 -0.09 0.00 -1.71 0.00 0.00 66.02 64.83 2dbf s SER 5 CO 0.00 -1.08 2.22 -0.44 1.20 0.00 0.00 173.24 175.14 2dbf s SER 6 N -2.82 4.45 -0.01 5.45 0.01 -1.26 -4.82 113.70 114.69 2dbf s SER 6 Ca 0.08 -0.10 0.02 0.00 1.31 0.00 0.00 55.95 57.26 2dbf s SER 6 Cb -0.03 -2.55 -0.00 0.00 0.21 0.00 0.00 66.02 63.65 2dbf s SER 6 CO -0.02 -3.32 -0.07 -0.83 0.41 0.00 0.00 173.24 169.42 2dbf s GLY 7 N 9.84 0.36 -0.49 3.44 0.00 -1.26 -4.75 107.32 114.46 2dbf s GLY 7 Ca 0.84 -0.28 0.03 0.00 0.00 0.00 0.00 44.72 45.31 2dbf s GLY 7 CO 0.07 -0.17 1.73 1.22 0.00 0.00 0.00 173.10 175.95 2dbf n ASP 8 N 3.04 5.62 -0.02 1.64 8.00 -1.17 -4.50 116.55 129.15 2dbf n ASP 8 Ca -0.15 -3.76 -0.09 0.00 0.71 0.00 0.00 54.79 51.50 2dbf n ASP 8 Cb 0.57 -0.76 -0.14 0.00 -0.02 0.00 0.00 41.12 40.77 2dbf n ASP 8 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2dbf n MET 9 N -0.94 0.64 0.11 -1.24 2.81 -1.26 -4.03 117.12 113.21 2dbf n MET 9 Ca 0.53 0.29 0.05 0.00 -1.81 0.00 0.00 57.70 56.76 2dbf n MET 9 Cb 0.95 -1.78 0.49 0.00 -0.71 0.00 0.00 33.22 32.16 2dbf n MET 9 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2dbf h LYS 10 N 0.00 0.30 -0.01 0.03 1.57 -1.94 -1.36 116.57 115.16 2dbf h LYS 10 Ca -0.30 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.39 2dbf h LYS 10 Cb 2.02 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 34.26 2dbf h LYS 10 CO 0.08 0.25 -0.29 -0.56 -0.57 0.00 0.00 179.45 178.36 2dbf h GLN 11 N 0.30 0.02 -6.82 3.15 3.07 -1.90 -3.43 115.11 109.49 2dbf h GLN 11 Ca 0.08 -0.01 -0.53 0.00 0.09 0.00 0.00 58.65 58.29 2dbf h GLN 11 Cb 0.05 -0.00 0.07 0.00 0.08 0.00 0.00 27.48 27.68 2dbf h GLN 11 CO -0.01 0.31 0.71 -0.51 0.09 0.00 0.00 178.83 179.41 2dbf s LEU 12 N -8.40 4.40 0.52 0.06 1.43 -0.51 -4.98 118.68 111.19 2dbf s LEU 12 Ca -0.03 2.71 -0.20 0.00 -1.03 0.00 0.00 54.13 55.58 2dbf s LEU 12 Cb 0.15 -3.64 -0.07 0.00 0.03 0.00 0.00 46.19 42.66 2dbf s LEU 12 CO 0.72 -0.64 1.09 0.00 0.23 0.00 0.00 176.35 177.75 2dbf s ALA 13 N -0.62 2.77 0.45 4.21 0.00 -1.26 -4.93 121.76 122.38 2dbf s ALA 13 Ca 0.54 0.74 0.12 0.00 0.00 0.00 0.00 51.96 53.35 2dbf s ALA 13 Cb -0.41 -3.32 1.04 0.00 0.00 0.00 0.00 23.12 20.43 2dbf s ALA 13 CO 0.50 -0.58 2.07 0.93 0.00 0.00 0.00 175.76 178.68 2dbf h GLU 14 N 1.35 0.32 -0.06 0.00 3.07 -1.94 -0.86 114.58 116.45 2dbf h GLU 14 Ca -0.50 -0.02 -0.08 0.00 -0.50 0.00 0.00 59.36 58.26 2dbf h GLU 14 Cb 1.24 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 29.07 2dbf h GLU 14 CO 0.58 0.21 -0.33 -0.44 -1.40 0.00 0.00 179.01 177.63 2dbf h ASP 15 N 0.33 0.12 -0.06 1.42 5.19 -1.98 -0.13 116.42 121.30 2dbf h ASP 15 Ca 0.13 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.49 2dbf h ASP 15 Cb 0.10 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.58 2dbf h ASP 15 CO -0.03 0.45 0.00 0.58 -3.12 0.00 0.00 179.24 177.12 2dbf h VAL 16 N 0.11 1.24 0.00 -1.35 2.07 -1.49 -2.84 116.25 113.98 2dbf h VAL 16 Ca 0.01 -0.73 -0.13 0.00 0.82 0.00 0.00 66.70 66.68 2dbf h VAL 16 Cb 0.64 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 2dbf h VAL 16 CO 0.05 0.20 -0.60 0.11 0.02 0.00 0.00 177.57 177.35 2dbf h LYS 17 N -0.17 0.00 -0.96 1.57 6.56 -1.44 -3.17 116.57 118.97 2dbf h LYS 17 Ca 0.02 0.00 0.02 0.00 -1.06 0.00 0.00 60.65 59.63 2dbf h LYS 17 Cb 0.31 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 31.92 2dbf h LYS 17 CO 0.00 0.60 0.63 -0.07 -2.06 0.00 0.00 179.45 178.55 2dbf h LEU 18 N 0.00 1.08 -1.01 2.94 3.38 -0.92 -1.85 115.31 118.92 2dbf h LEU 18 Ca -0.01 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 2dbf h LEU 18 Cb 1.16 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2dbf h LEU 18 CO 0.08 0.77 -0.36 1.56 0.09 0.00 0.00 178.44 180.57 2dbf h GLN 19 N 1.27 0.25 -0.96 1.13 4.20 -1.47 -2.96 115.11 116.56 2dbf h GLN 19 Ca 0.36 -0.11 0.01 0.00 0.06 0.00 0.00 58.65 58.97 2dbf h GLN 19 Cb -0.10 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.62 2dbf h GLN 19 CO -0.09 0.58 0.62 -0.07 -0.67 0.00 0.00 178.83 179.20 2dbf h LEU 20 N 0.21 1.11 -1.07 1.46 3.38 -1.37 -1.27 115.31 117.76 2dbf h LEU 20 Ca 0.02 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2dbf h LEU 20 Cb 0.75 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 2dbf h LEU 20 CO 0.06 0.82 0.43 1.88 0.09 0.00 0.00 178.44 181.71 2dbf h TYR 21 N 1.30 1.05 -0.29 1.13 0.05 -1.34 -0.43 116.97 118.44 2dbf h TYR 21 Ca 0.35 -0.02 -0.18 0.00 0.05 0.00 0.00 58.73 58.93 2dbf h TYR 21 Cb -0.13 -0.34 -0.00 0.00 1.01 0.00 0.00 36.73 37.27 2dbf h TYR 21 CO -0.00 0.73 -0.52 0.87 -1.05 0.00 0.00 178.16 178.19 2dbf h LYS 22 N 1.08 0.83 0.07 4.88 6.56 -1.41 -1.66 116.57 126.92 2dbf h LYS 22 Ca 0.27 -0.50 -0.00 0.00 -1.06 0.00 0.00 60.65 59.36 2dbf h LYS 22 Cb 0.02 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.73 2dbf h LYS 22 CO -0.04 1.14 -0.04 -0.07 -2.06 0.00 0.00 179.45 178.38 2dbf h LEU 23 N 0.64 -0.08 -1.78 2.94 3.38 -0.85 -2.93 115.31 116.63 2dbf h LEU 23 Ca 0.02 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 2dbf h LEU 23 Cb 1.11 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 2dbf h LEU 23 CO 0.11 0.21 -0.16 -0.07 0.09 0.00 0.00 178.44 178.63 2dbf h LEU 24 N -0.39 0.00 -2.03 1.67 3.38 -1.14 -2.54 115.31 114.27 2dbf h LEU 24 Ca -0.01 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.09 2dbf h LEU 24 Cb 0.33 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 2dbf h LEU 24 CO 0.02 0.16 0.40 -0.08 0.09 0.00 0.00 178.44 179.02 2dbf h GLU 25 N 0.00 0.00 -6.48 1.13 4.81 -1.10 -2.68 114.58 110.27 2dbf h GLU 25 Ca -0.00 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.70 2dbf h GLU 25 Cb 0.37 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.77 2dbf h GLU 25 CO 0.02 0.00 0.98 0.42 -0.73 0.00 0.00 179.01 179.70 2dbf s ILE 26 N -4.75 2.94 -1.19 2.32 1.01 -0.96 -4.88 121.20 115.69 2dbf s ILE 26 Ca -0.05 0.46 -0.13 0.00 0.00 0.00 0.00 60.65 60.93 2dbf s ILE 26 Cb 0.17 -3.30 -0.06 0.00 0.01 0.00 0.00 42.46 39.28 2dbf s ILE 26 CO 0.61 0.01 2.30 -0.81 0.00 0.00 0.00 174.94 177.04 2dbf n PRO 27 N 5.29 2.53 -4.37 2.79 -0.04 -1.26 -3.82 135.00 136.12 2dbf n PRO 27 Ca 0.16 -2.04 -0.29 0.00 -0.04 0.00 0.00 63.50 61.29 2dbf n PRO 27 Cb 0.40 -2.88 -0.12 0.00 -0.04 0.00 0.00 33.50 30.86 2dbf n PRO 27 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dbf s ASP 28 N 3.46 3.60 0.46 3.54 1.11 -1.26 -5.02 116.67 122.56 2dbf s ASP 28 Ca 0.53 -0.65 0.22 0.00 0.18 0.00 0.00 52.55 52.83 2dbf s ASP 28 Cb 0.14 -0.39 1.13 0.00 1.07 0.00 0.00 42.92 44.87 2dbf s ASP 28 CO -0.02 0.18 1.96 1.55 1.18 0.00 0.00 175.17 180.02 2dbf h PRO 29 N 3.84 0.00 0.00 8.23 0.13 -1.98 -2.70 132.00 139.53 2dbf h PRO 29 Ca -0.50 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 2dbf h PRO 29 Cb 1.17 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.23 2dbf h PRO 29 CO 0.43 0.21 -0.59 -0.25 -0.23 0.00 0.00 178.00 177.57 2dbf n ASP 30 N -3.78 1.58 -1.88 1.44 8.00 -1.26 -4.70 116.55 115.96 2dbf n ASP 30 Ca -0.02 -3.53 -0.04 0.00 0.71 0.00 0.00 54.79 51.91 2dbf n ASP 30 Cb 0.31 -0.48 0.04 0.00 -0.02 0.00 0.00 41.12 40.97 2dbf n ASP 30 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2dbf n LYS 31 N -0.82 0.72 -4.45 -1.24 5.02 -1.13 -4.46 118.16 111.80 2dbf n LYS 31 Ca 0.16 -1.02 -0.23 0.00 -2.02 0.00 0.00 58.31 55.21 2dbf n LYS 31 Cb 0.77 0.44 -0.10 0.00 -0.02 0.00 0.00 35.03 36.12 2dbf n LYS 31 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2dbf s ASN 32 N -0.98 3.28 0.20 4.39 3.84 -1.03 -4.06 114.94 120.58 2dbf s ASN 32 Ca 0.05 -1.07 -0.08 0.00 0.21 0.00 0.00 52.86 51.97 2dbf s ASN 32 Cb 0.24 -0.25 0.11 0.00 -0.55 0.00 0.00 41.25 40.79 2dbf s ASN 32 CO -0.07 -0.08 1.71 4.11 -2.79 0.00 0.00 177.10 179.98 2dbf h TRP 33 N 2.31 1.20 -0.19 0.43 5.08 -1.74 -2.48 115.95 120.55 2dbf h TRP 33 Ca -0.40 -0.15 0.03 0.00 1.08 0.00 0.00 58.89 59.45 2dbf h TRP 33 Cb 1.25 -0.34 -0.01 0.00 -3.00 0.00 0.00 29.16 27.06 2dbf h TRP 33 CO 0.77 0.98 0.13 0.00 -1.28 0.00 0.00 178.44 179.04 2dbf h ALA 34 N 1.08 2.01 -0.10 0.11 0.00 -1.95 -1.15 119.26 119.26 2dbf h ALA 34 Ca 0.22 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.94 2dbf h ALA 34 Cb 0.40 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2dbf h ALA 34 CO 0.01 -0.05 -0.71 1.15 0.00 0.00 0.00 179.25 179.65 2dbf h THR 35 N 0.13 1.36 -0.03 0.00 2.02 -1.77 -3.14 112.91 111.48 2dbf h THR 35 Ca 0.08 -2.07 -0.15 0.00 0.77 0.00 0.00 66.41 65.04 2dbf h THR 35 Cb 0.16 2.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 2dbf h THR 35 CO -0.01 0.63 -0.66 0.25 0.37 0.00 0.00 175.52 176.09 2dbf h LEU 36 N 0.32 0.17 -1.23 2.58 5.85 -1.07 -2.80 115.31 119.13 2dbf h LEU 36 Ca -0.03 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 2dbf h LEU 36 Cb 1.28 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 2dbf h LEU 36 CO 0.13 0.78 0.32 0.00 -0.34 0.00 0.00 178.44 179.33 2dbf h ALA 37 N 1.22 1.41 0.05 1.25 0.00 -1.21 0.15 119.26 122.12 2dbf h ALA 37 Ca -0.01 -0.11 -0.23 0.00 0.00 0.00 0.00 54.91 54.56 2dbf h ALA 37 Cb 1.19 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2dbf h ALA 37 CO 0.10 0.48 -1.03 1.96 0.00 0.00 0.00 179.25 180.75 2dbf h GLN 38 N 0.86 0.29 -0.20 0.00 4.20 -1.53 0.62 115.11 119.35 2dbf h GLN 38 Ca 0.22 -0.38 -0.11 0.00 0.06 0.00 0.00 58.65 58.44 2dbf h GLN 38 Cb 0.05 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 2dbf h GLN 38 CO -0.03 1.10 -0.30 0.87 -0.67 0.00 0.00 178.83 179.80 2dbf h LYS 39 N 0.14 0.55 0.00 1.46 6.56 -1.17 -3.38 116.57 120.73 2dbf h LYS 39 Ca -0.09 -0.33 0.00 0.00 -1.06 0.00 0.00 60.65 59.17 2dbf h LYS 39 Cb 1.70 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 33.40 2dbf h LYS 39 CO 0.17 0.93 0.00 1.28 -2.06 0.00 0.00 179.45 179.77 2dbf n LEU 40 N -4.34 0.56 0.00 2.94 4.77 0.50 -4.89 117.00 116.53 2dbf n LEU 40 Ca -0.06 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 2dbf n LEU 40 Cb 0.47 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2dbf n LEU 40 CO 0.43 -0.32 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 2dbf n GLY 41 N 0.73 0.00 1.52 -0.72 0.00 -0.91 -5.04 105.19 100.76 2dbf n GLY 41 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2dbf n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dbf n LEU 42 N 0.00 1.43 0.23 0.99 4.77 0.21 -4.85 117.00 119.77 2dbf n LEU 42 Ca 0.00 -2.48 0.07 0.00 -0.03 0.00 0.00 56.01 53.57 2dbf n LEU 42 Cb 0.00 -0.04 0.54 0.00 -2.33 0.00 0.00 43.42 41.59 2dbf n LEU 42 CO 0.00 0.74 0.87 1.23 -1.33 0.00 0.00 177.39 178.91 2dbf h GLY 43 N 1.21 0.00 1.95 -0.72 0.00 -1.79 -2.48 103.07 101.24 2dbf h GLY 43 Ca -0.17 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.96 2dbf h GLY 43 CO 0.11 0.00 -0.93 1.19 0.00 0.00 0.00 176.54 176.91 2dbf h ILE 44 N 0.00 1.63 -0.90 2.60 6.09 -1.90 -3.21 117.51 121.82 2dbf h ILE 44 Ca -0.00 -3.07 -0.46 0.00 -1.37 0.00 0.00 64.86 59.97 2dbf h ILE 44 Cb 0.43 2.68 -0.27 0.00 0.47 0.00 0.00 36.82 40.13 2dbf h ILE 44 CO 0.03 0.88 0.58 0.18 -3.07 0.00 0.00 178.15 176.75 2dbf n LEU 45 N -3.48 6.38 -0.01 2.19 4.77 -0.95 -4.43 117.00 121.47 2dbf n LEU 45 Ca -0.01 -3.40 -0.17 0.00 -0.03 0.00 0.00 56.01 52.40 2dbf n LEU 45 Cb 0.87 -0.81 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 2dbf n LEU 45 CO 0.47 0.99 0.26 0.78 -1.33 0.00 0.00 177.39 178.55 2dbf h ASN 46 N 1.02 0.89 0.15 -1.43 2.35 -1.51 -3.14 115.58 113.91 2dbf h ASN 46 Ca 0.56 -0.60 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 2dbf h ASN 46 Cb 2.68 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 40.78 2dbf h ASN 46 CO 0.99 1.39 -0.21 -0.55 -1.65 0.00 0.00 177.43 177.41 2dbf h ASN 47 N 0.50 0.11 0.09 5.81 7.08 -1.85 -1.45 115.58 125.86 2dbf h ASN 47 Ca -0.06 -0.02 -0.09 0.00 -3.08 0.00 0.00 56.30 53.05 2dbf h ASN 47 Cb 1.42 -0.03 -0.01 0.00 -2.08 0.00 0.00 38.32 37.62 2dbf h ASN 47 CO 0.16 0.33 -0.28 0.00 -2.08 0.00 0.00 177.43 175.55 2dbf h ALA 48 N 1.69 1.22 0.19 4.14 0.00 -1.86 -2.79 119.26 121.85 2dbf h ALA 48 Ca 0.02 -0.33 -0.32 0.00 0.00 0.00 0.00 54.91 54.28 2dbf h ALA 48 Cb 0.43 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.14 2dbf h ALA 48 CO 0.03 0.52 -1.46 0.74 0.00 0.00 0.00 179.25 179.07 2dbf h PHE 49 N 0.28 0.74 -0.24 0.00 0.04 -1.41 -3.29 116.94 113.05 2dbf h PHE 49 Ca 0.04 -0.54 0.03 0.00 2.80 0.00 0.00 57.97 60.31 2dbf h PHE 49 Cb 0.65 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 2dbf h PHE 49 CO 0.01 1.48 0.16 -0.09 -0.60 0.00 0.00 178.31 179.27 2dbf h ARG 50 N 0.11 0.17 -0.11 1.51 2.43 -1.18 -0.86 114.38 116.45 2dbf h ARG 50 Ca -0.23 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.81 2dbf h ARG 50 Cb 2.09 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 31.59 2dbf h ARG 50 CO 0.23 0.11 -0.46 -0.07 -1.51 0.00 0.00 179.97 178.27 2dbf h LEU 51 N 0.17 0.29-10.21 3.80 3.38 -1.57 -3.45 115.31 107.73 2dbf h LEU 51 Ca 0.10 -0.13 -0.50 0.00 0.09 0.00 0.00 57.88 57.44 2dbf h LEU 51 Cb 0.19 -0.08 0.08 0.00 0.09 0.00 0.00 40.66 40.94 2dbf h LEU 51 CO -0.02 0.71 0.38 -0.44 0.09 0.00 0.00 178.44 179.16 2dbf s SER 52 N -6.88 5.49 0.52 -0.43 0.01 -0.33 -4.94 113.70 107.14 2dbf s SER 52 Ca -0.05 1.88 0.21 0.00 1.31 0.00 0.00 55.95 59.31 2dbf s SER 52 Cb 0.13 -2.54 1.37 0.00 0.21 0.00 0.00 66.02 65.19 2dbf s SER 52 CO 0.78 -1.37 2.11 1.55 0.41 0.00 0.00 173.24 176.73 2dbf h PRO 53 N 0.21 0.00 -2.55 12.44 0.13 -1.86 -3.33 132.00 137.04 2dbf h PRO 53 Ca -0.47 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.07 2dbf h PRO 53 Cb 1.23 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.97 2dbf h PRO 53 CO 0.56 0.08 -0.88 0.00 -0.23 0.00 0.00 178.00 177.53 2dbf s ALA 54 N -4.65 1.68 0.30 -0.56 0.00 -1.26 -4.99 121.76 112.29 2dbf s ALA 54 Ca -0.04 -2.53 0.05 0.00 0.00 0.00 0.00 51.96 49.44 2dbf s ALA 54 Cb 0.15 -1.69 0.72 0.00 0.00 0.00 0.00 23.12 22.30 2dbf s ALA 54 CO 0.63 -2.02 1.79 -1.35 0.00 0.00 0.00 175.76 174.81 2dbf h PRO 55 N 5.94 0.77 -0.72 0.00 0.11 -1.68 -0.47 132.00 135.95 2dbf h PRO 55 Ca 0.19 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 2dbf h PRO 55 Cb 0.90 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.80 2dbf h PRO 55 CO 0.40 0.51 0.44 0.77 -0.21 0.00 0.00 178.00 179.92 2dbf h SER 56 N 0.80 0.86 -0.02 -2.05 0.02 -1.93 0.20 113.55 111.43 2dbf h SER 56 Ca 0.57 -0.06 -0.16 0.00 -0.84 0.00 0.00 61.79 61.30 2dbf h SER 56 Cb 0.84 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 2dbf h SER 56 CO -0.36 0.66 -0.53 0.50 -1.14 0.00 0.00 176.83 175.96 2dbf h LYS 57 N 0.98 0.59 -0.02 3.45 3.64 -1.52 -3.06 116.57 120.64 2dbf h LYS 57 Ca 0.26 -0.37 -0.13 0.00 -1.27 0.00 0.00 60.65 59.14 2dbf h LYS 57 Cb -0.04 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2dbf h LYS 57 CO -0.05 0.98 -0.61 1.15 -2.27 0.00 0.00 179.45 178.65 2dbf h THR 58 N 0.46 1.43 0.51 1.00 2.02 -0.76 -3.10 112.91 114.46 2dbf h THR 58 Ca 0.01 -2.06 -0.02 0.00 0.77 0.00 0.00 66.41 65.10 2dbf h THR 58 Cb 1.08 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 69.59 2dbf h THR 58 CO 0.10 0.59 -0.25 0.25 0.37 0.00 0.00 175.52 176.58 2dbf h LEU 59 N 0.04 -0.61 -2.15 2.58 5.85 -0.51 -2.09 115.31 118.43 2dbf h LEU 59 Ca -0.01 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2dbf h LEU 59 Cb 1.09 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 2dbf h LEU 59 CO 0.08 -0.43 0.06 0.24 -0.34 0.00 0.00 178.44 178.06 2dbf h MET 60 N -0.70 0.00 -0.05 1.25 2.86 -1.59 0.68 114.93 117.39 2dbf h MET 60 Ca -0.07 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.46 2dbf h MET 60 Cb 0.54 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 2dbf h MET 60 CO 0.11 0.00 -0.50 0.22 1.06 0.00 0.00 176.91 177.79 2dbf h ASP 61 N 0.00 0.13 0.57 1.22 3.58 -1.35 -1.51 116.42 119.06 2dbf h ASP 61 Ca 0.03 -0.06 -0.28 0.00 0.42 0.00 0.00 57.03 57.14 2dbf h ASP 61 Cb 0.15 -0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.12 2dbf h ASP 61 CO -0.00 0.62 -1.58 0.78 -2.88 0.00 0.00 179.24 176.18 2dbf h ASN 62 N 0.10 0.05 0.62 2.28 -0.26 -0.46 -3.20 115.58 114.71 2dbf h ASN 62 Ca 0.00 -0.09 -0.15 0.00 -0.56 0.00 0.00 56.30 55.51 2dbf h ASN 62 Cb 0.93 -0.02 -0.02 0.00 -1.06 0.00 0.00 38.32 38.15 2dbf h ASN 62 CO 0.07 1.08 -0.67 0.22 -1.06 0.00 0.00 177.43 177.06 2dbf h TYR 63 N 0.01 0.06 -0.03 1.19 3.20 -0.88 -2.47 116.97 118.06 2dbf h TYR 63 Ca -0.24 -0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.45 2dbf h TYR 63 Cb 1.97 -0.01 0.01 0.00 1.54 0.00 0.00 36.73 40.24 2dbf h TYR 63 CO 0.01 0.70 -0.57 1.49 -1.64 0.00 0.00 178.16 178.15 2dbf h GLU 64 N 0.03 0.44 0.00 1.82 4.81 -1.40 0.66 114.58 120.94 2dbf h GLU 64 Ca -0.01 -0.43 -0.06 0.00 -0.13 0.00 0.00 59.36 58.73 2dbf h GLU 64 Cb 1.20 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 2dbf h GLU 64 CO 0.09 1.09 -0.28 0.28 -0.73 0.00 0.00 179.01 179.46 2dbf h VAL 65 N -0.05 1.03 -0.84 0.32 2.07 -1.58 -2.77 116.25 114.43 2dbf h VAL 65 Ca -0.06 -1.03 -0.55 0.00 0.82 0.00 0.00 66.70 65.88 2dbf h VAL 65 Cb 1.27 1.58 -0.25 0.00 -1.52 0.00 0.00 31.29 32.37 2dbf h VAL 65 CO 0.11 0.28 0.71 -0.24 0.02 0.00 0.00 177.57 178.45 2dbf n SER 66 N -3.95 6.67 0.00 0.57 2.88 -0.93 -4.75 113.62 114.11 2dbf n SER 66 Ca -0.02 -3.53 0.00 0.00 -1.33 0.00 0.00 58.87 53.99 2dbf n SER 66 Cb 0.35 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 2dbf n SER 66 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dbf n GLY 67 N -0.60 1.96 1.84 0.46 0.00 -1.04 -4.97 105.19 102.83 2dbf n GLY 67 Ca 0.53 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2dbf n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dbf n GLY 68 N 0.00 -5.14 3.10 -0.02 0.00 0.22 -3.99 105.19 99.37 2dbf n GLY 68 Ca 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 46.02 45.54 2dbf n GLY 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dbf s THR 69 N -0.58 0.83 0.24 2.61 -4.23 -1.26 -3.07 115.64 110.18 2dbf s THR 69 Ca 0.00 -1.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.59 2dbf s THR 69 Cb 0.00 -0.80 -0.06 0.00 1.34 0.00 0.00 72.50 72.98 2dbf s THR 69 CO 0.00 -0.16 1.55 0.58 -0.54 0.00 0.00 174.62 176.05 2dbf h VAL 70 N 4.52 1.44 -0.22 2.29 2.07 -1.97 -2.61 116.25 121.76 2dbf h VAL 70 Ca -0.37 -2.19 -0.04 0.00 0.82 0.00 0.00 66.70 64.92 2dbf h VAL 70 Cb 1.19 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 33.11 2dbf h VAL 70 CO 0.43 0.63 -0.05 0.03 0.02 0.00 0.00 177.57 178.63 2dbf h ARG 71 N 0.07 0.34 0.12 1.57 3.08 -1.96 -0.91 114.38 116.69 2dbf h ARG 71 Ca -0.01 -0.07 -0.28 0.00 0.07 0.00 0.00 59.98 59.69 2dbf h ARG 71 Cb 1.18 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.17 2dbf h ARG 71 CO 0.09 0.42 -1.35 0.93 -1.07 0.00 0.00 179.97 178.99 2dbf h GLU 72 N 0.33 0.25 -0.35 0.04 4.39 -1.97 -2.93 114.58 114.34 2dbf h GLU 72 Ca 0.07 -0.42 -0.07 0.00 0.34 0.00 0.00 59.36 59.28 2dbf h GLU 72 Cb 0.31 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 2dbf h GLU 72 CO 0.01 1.15 -0.05 1.25 -1.16 0.00 0.00 179.01 180.22 2dbf h LEU 73 N 0.07 0.64 -0.64 1.33 5.85 -1.14 0.28 115.31 121.70 2dbf h LEU 73 Ca -0.17 -0.34 -0.12 0.00 0.84 0.00 0.00 57.88 58.09 2dbf h LEU 73 Cb 1.98 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.82 2dbf h LEU 73 CO 0.18 0.83 -0.18 0.58 -0.34 0.00 0.00 178.44 179.52 2dbf h VAL 74 N 0.44 1.27 -0.08 1.05 2.07 -1.29 -1.42 116.25 118.29 2dbf h VAL 74 Ca 0.09 -1.31 -0.11 0.00 0.82 0.00 0.00 66.70 66.19 2dbf h VAL 74 Cb 0.54 1.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.42 2dbf h VAL 74 CO 0.03 0.45 -0.39 -0.33 0.02 0.00 0.00 177.57 177.34 2dbf h GLU 75 N 0.77 0.40 -0.91 1.57 5.08 -1.43 -2.83 114.58 117.22 2dbf h GLU 75 Ca 0.11 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 2dbf h GLU 75 Cb 0.71 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.99 2dbf h GLU 75 CO 0.05 0.97 0.53 0.00 -1.00 0.00 0.00 179.01 179.57 2dbf h ALA 76 N 0.43 1.22 -0.01 3.43 0.00 -0.43 -1.63 119.26 122.28 2dbf h ALA 76 Ca -0.03 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2dbf h ALA 76 Cb 1.04 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2dbf h ALA 76 CO 0.08 0.65 -0.32 -0.07 0.00 0.00 0.00 179.25 179.59 2dbf h LEU 77 N 1.27 0.02 -0.38 0.00 3.38 -1.29 -2.56 115.31 115.75 2dbf h LEU 77 Ca 0.33 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 58.11 2dbf h LEU 77 Cb -0.03 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2dbf h LEU 77 CO -0.06 0.34 -0.82 -0.09 0.09 0.00 0.00 178.44 177.91 2dbf h ARG 78 N 0.02 0.11 -0.39 1.13 2.43 -1.08 0.12 114.38 116.71 2dbf h ARG 78 Ca -0.00 -0.11 -0.11 0.00 -0.81 0.00 0.00 59.98 58.95 2dbf h ARG 78 Cb 0.58 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2dbf h ARG 78 CO 0.04 0.86 -0.20 1.96 -1.51 0.00 0.00 179.97 181.12 2dbf h GLN 79 N 0.06 0.75 -0.01 0.20 4.20 -0.92 -3.00 115.11 116.39 2dbf h GLN 79 Ca -0.02 -0.29 -0.20 0.00 0.06 0.00 0.00 58.65 58.19 2dbf h GLN 79 Cb 1.42 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.16 2dbf h GLN 79 CO 0.12 0.89 -0.86 0.52 -0.67 0.00 0.00 178.83 178.83 2dbf h MET 80 N 0.66 0.30 0.00 1.46 2.86 -1.50 -3.48 114.93 115.24 2dbf h MET 80 Ca 0.10 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 2dbf h MET 80 Cb 0.70 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.44 2dbf h MET 80 CO 0.05 1.00 0.00 0.41 1.06 0.00 0.00 176.91 179.43 2dbf n GLY 81 N 0.82 1.92 3.72 8.32 0.00 -0.98 -4.75 105.19 114.23 2dbf n GLY 81 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 2dbf n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dbf s TYR 82 N -2.00 3.58 -0.12 1.61 2.02 0.36 -4.94 117.35 117.86 2dbf s TYR 82 Ca 0.00 1.22 0.03 0.00 -0.37 0.00 0.00 57.07 57.95 2dbf s TYR 82 Cb 0.00 -2.77 -0.09 0.00 -0.40 0.00 0.00 41.96 38.69 2dbf s TYR 82 CO 0.00 0.11 -0.07 2.41 -1.57 0.00 0.00 175.55 176.43 2dbf n THR 83 N 3.71 0.71 0.08 -0.71 -1.04 -1.26 -4.42 114.28 111.35 2dbf n THR 83 Ca -0.02 -0.32 -0.09 0.00 -2.04 0.00 0.00 64.05 61.58 2dbf n THR 83 Cb 0.51 -0.89 -0.08 0.00 -1.82 0.00 0.00 70.33 68.06 2dbf n THR 83 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 2dbf h GLU 84 N 0.00 0.09 -0.42 -2.82 4.81 -1.99 -3.05 114.58 111.20 2dbf h GLU 84 Ca -0.28 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 58.75 2dbf h GLU 84 Cb 1.49 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.90 2dbf h GLU 84 CO -0.03 1.00 -0.05 0.00 -0.73 0.00 0.00 179.01 179.20 2dbf h ALA 85 N 0.95 1.12 -0.01 2.92 0.00 -1.97 -2.53 119.26 119.73 2dbf h ALA 85 Ca -0.04 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.42 2dbf h ALA 85 Cb 1.71 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 2dbf h ALA 85 CO 0.14 0.56 -0.78 0.82 0.00 0.00 0.00 179.25 179.99 2dbf h ILE 86 N 0.66 1.48 -0.33 0.00 2.04 -1.77 -3.18 117.51 116.42 2dbf h ILE 86 Ca 0.12 -2.46 -0.09 0.00 1.00 0.00 0.00 64.86 63.43 2dbf h ILE 86 Cb 0.49 2.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 2dbf h ILE 86 CO 0.03 0.71 -0.18 -0.33 0.00 0.00 0.00 178.15 178.38 2dbf h GLU 87 N 0.09 0.59 -0.07 2.37 5.08 -1.38 0.13 114.58 121.40 2dbf h GLU 87 Ca -0.02 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.11 2dbf h GLU 87 Cb 1.36 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 2dbf h GLU 87 CO 0.11 0.74 -0.05 0.28 -1.00 0.00 0.00 179.01 179.09 2dbf h VAL 88 N 0.53 1.08 0.01 3.13 2.07 -1.44 0.22 116.25 121.86 2dbf h VAL 88 Ca 0.09 -0.35 -0.27 0.00 0.82 0.00 0.00 66.70 66.98 2dbf h VAL 88 Cb 0.61 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 2dbf h VAL 88 CO 0.04 0.11 -1.49 -0.38 0.02 0.00 0.00 177.57 175.87 2dbf n ILE 89 N -4.42 1.56 -0.35 4.57 5.41 -1.00 -3.45 119.36 121.68 2dbf n ILE 89 Ca -0.02 -0.13 -0.02 0.00 1.00 0.00 0.00 62.75 63.58 2dbf n ILE 89 Cb 0.17 -1.99 0.13 0.00 -0.71 0.00 0.00 39.64 37.24 2dbf n ILE 89 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 2dbf h GLN 90 N -0.88 1.27 0.01 0.38 4.20 -0.72 0.78 115.11 120.14 2dbf h GLN 90 Ca -0.40 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.23 2dbf h GLN 90 Cb 1.42 -0.29 0.00 0.00 0.30 0.00 0.00 27.48 28.91 2dbf h GLN 90 CO -0.20 0.84 -0.00 0.00 -0.67 0.00 0.00 178.83 178.79 2dbf h ALA 91 N 1.40 -0.01 0.06 3.87 0.00 -0.75 0.26 119.26 124.09 2dbf h ALA 91 Ca 0.35 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2dbf h ALA 91 Cb -0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2dbf h ALA 91 CO -0.08 -0.38 -0.03 0.00 0.00 0.00 0.00 179.25 178.77 2dbf h ALA 92 N 0.72 -0.08 0.52 0.00 0.00 -1.53 -3.32 119.26 115.57 2dbf h ALA 92 Ca -0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2dbf h ALA 92 Cb 0.26 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2dbf h ALA 92 CO 0.00 -0.29 -0.25 0.66 0.00 0.00 0.00 179.25 179.37 2dbf h SER 93 N -0.60 -0.59 -3.48 0.00 4.64 0.50 -3.49 113.55 110.53 2dbf h SER 93 Ca -0.01 0.02 0.37 0.00 -0.47 0.00 0.00 61.79 61.70 2dbf h SER 93 Cb 0.52 0.15 -0.15 0.00 -0.31 0.00 0.00 62.40 62.61 2dbf h SER 93 CO 0.01 -0.42 -0.93 -1.20 -0.87 0.00 0.00 176.83 173.42 2dbf n SER 94 N -5.39 -8.55 -3.80 4.97 7.64 0.92 -4.96 113.62 104.45 2dbf n SER 94 Ca -0.12 1.06 -0.14 0.00 1.01 0.00 0.00 58.87 60.68 2dbf n SER 94 Cb 0.29 -4.66 -0.15 0.00 -1.01 0.00 0.00 64.21 58.67 2dbf n SER 94 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dbf s SER 95 N -7.23 0.09 0.00 6.43 0.01 -1.26 -5.05 113.70 106.69 2dbf s SER 95 Ca 0.00 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.28 2dbf s SER 95 Cb 0.00 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.17 2dbf s SER 95 CO 0.00 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2dbf n GLY 96 N 3.86 -1.13 0.24 3.44 0.00 -1.26 -4.91 105.19 105.43 2dbf n GLY 96 Ca -0.23 0.95 -0.06 0.00 0.00 0.00 0.00 46.02 46.68 2dbf n GLY 96 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dbf h PRO 97 N 0.00 0.56 0.00 1.61 0.13 -2.04 -3.42 132.00 128.83 2dbf h PRO 97 Ca 0.00 -0.24 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2dbf h PRO 97 Cb 0.00 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.11 2dbf h PRO 97 CO 0.00 0.80 0.00 -1.13 -0.23 0.00 0.00 178.00 177.44 2dbf n SER 98 N -4.08 0.11 -4.12 1.44 3.41 -1.26 -5.14 113.62 103.98 2dbf n SER 98 Ca -0.01 0.03 -0.10 0.00 -0.26 0.00 0.00 58.87 58.53 2dbf n SER 98 Cb 0.45 -0.02 -0.09 0.00 -0.26 0.00 0.00 64.21 64.29 2dbf n SER 98 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dbf s SER 99 N -4.89 0.19 0.00 4.04 0.15 -1.26 -5.27 113.70 106.65 2dbf s SER 99 Ca 0.00 -1.17 0.00 0.00 0.70 0.00 0.00 55.95 55.48 2dbf s SER 99 Cb 0.00 0.36 0.00 0.00 -1.71 0.00 0.00 66.02 64.67 2dbf s SER 99 CO 0.00 -0.82 0.12 0.61 1.20 0.00 0.00 173.24 174.35