#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 -3.10 -4.77 1.61 2.88 -1.26 -4.93 113.62 104.05 2dbf n SER 2 Ca 0.00 1.49 -0.36 0.00 -1.33 0.00 0.00 58.87 58.67 2dbf n SER 2 Cb 0.00 -5.19 0.00 0.00 -0.75 0.00 0.00 64.21 58.27 2dbf n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dbf s SER 3 N -0.63 5.77 -0.22 -3.46 0.01 -1.26 -5.05 113.70 108.86 2dbf s SER 3 Ca -0.20 2.25 -0.08 0.00 1.31 0.00 0.00 55.95 59.22 2dbf s SER 3 Cb 0.01 -2.59 0.10 0.00 0.21 0.00 0.00 66.02 63.75 2dbf s SER 3 CO 0.54 -1.19 0.49 -0.83 0.41 0.00 0.00 173.24 172.66 2dbf s GLY 4 N -1.62 -0.46 -0.45 3.44 0.00 -1.26 -5.10 107.32 101.87 2dbf s GLY 4 Ca 0.71 1.76 0.08 0.00 0.00 0.00 0.00 44.72 47.26 2dbf s GLY 4 CO 0.30 2.47 0.66 -0.45 0.00 0.00 0.00 173.10 176.09 2dbf s SER 5 N 2.48 -1.46 0.00 1.64 0.15 -1.26 -5.01 113.70 110.23 2dbf s SER 5 Ca -0.04 -1.16 0.00 0.00 0.70 0.00 0.00 55.95 55.45 2dbf s SER 5 Cb -0.11 1.92 0.00 0.00 -1.71 0.00 0.00 66.02 66.12 2dbf s SER 5 CO -0.15 -0.13 0.00 -1.20 1.20 0.00 0.00 173.24 172.97 2dbf n SER 6 N 3.86 0.83 0.00 5.45 7.64 -1.26 -5.04 113.62 125.10 2dbf n SER 6 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.02 2dbf n SER 6 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2dbf n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dbf n GLY 7 N 2.65 -0.44 2.34 0.23 0.00 -1.26 -4.70 105.19 104.01 2dbf n GLY 7 Ca 0.00 -1.44 -0.19 0.00 0.00 0.00 0.00 46.02 44.40 2dbf n GLY 7 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dbf n ASP 8 N -0.64 3.90 -0.02 1.61 9.92 -0.68 -4.74 116.55 125.90 2dbf n ASP 8 Ca 0.00 -3.31 0.01 0.00 -0.53 0.00 0.00 54.79 50.96 2dbf n ASP 8 Cb 0.00 -0.41 -0.13 0.00 -0.64 0.00 0.00 41.12 39.94 2dbf n ASP 8 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 2dbf n MET 9 N -0.58 0.65 0.06 -1.24 2.81 -0.98 -4.21 117.12 113.64 2dbf n MET 9 Ca 0.32 0.01 0.17 0.00 -1.81 0.00 0.00 57.70 56.40 2dbf n MET 9 Cb 0.85 -1.63 0.68 0.00 -0.71 0.00 0.00 33.22 32.42 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 0.00 -0.17 0.03 1.79 -1.86 0.04 116.57 116.40 2dbf h LYS 10 Ca -0.23 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.10 2dbf h LYS 10 Cb 1.59 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.23 2dbf h LYS 10 CO 0.02 0.00 -0.48 -0.56 -1.08 0.00 0.00 179.45 177.35 2dbf h GLN 11 N 0.00 0.45 -6.63 3.15 3.07 -1.95 -3.44 115.11 109.75 2dbf h GLN 11 Ca 0.19 -0.25 -0.52 0.00 0.09 0.00 0.00 58.65 58.16 2dbf h GLN 11 Cb 0.78 0.02 0.06 0.00 0.08 0.00 0.00 27.48 28.41 2dbf h GLN 11 CO -0.00 0.83 1.02 -0.51 0.09 0.00 0.00 178.83 180.27 2dbf s LEU 12 N -8.31 4.37 0.57 0.06 1.43 -0.00 -4.97 118.68 111.83 2dbf s LEU 12 Ca -0.06 2.84 -0.16 0.00 -1.03 0.00 0.00 54.13 55.72 2dbf s LEU 12 Cb 0.12 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.70 2dbf s LEU 12 CO 0.82 -0.97 1.04 0.00 0.23 0.00 0.00 176.35 177.47 2dbf s ALA 13 N 1.42 2.82 0.21 4.21 0.00 -1.26 -4.94 121.76 124.22 2dbf s ALA 13 Ca 0.76 0.36 -0.10 0.00 0.00 0.00 0.00 51.96 52.97 2dbf s ALA 13 Cb -0.49 -3.21 0.17 0.00 0.00 0.00 0.00 23.12 19.60 2dbf s ALA 13 CO 0.33 -0.67 1.86 1.49 0.00 0.00 0.00 175.76 178.77 2dbf h GLU 14 N 0.59 0.90 -0.00 0.00 4.57 -1.96 -1.39 114.58 117.28 2dbf h GLU 14 Ca -0.47 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 2dbf h GLU 14 Cb 1.21 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 29.60 2dbf h GLU 14 CO 0.58 0.59 0.00 -0.44 -1.18 0.00 0.00 179.01 178.57 2dbf h ASP 15 N 0.92 0.00 -0.09 1.04 3.32 -1.99 0.80 116.42 120.43 2dbf h ASP 15 Ca 0.28 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.28 2dbf h ASP 15 Cb -0.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2dbf h ASP 15 CO -0.09 0.00 -0.15 0.58 -1.72 0.00 0.00 179.24 177.86 2dbf h VAL 16 N 0.00 1.39 0.00 -1.35 2.07 -1.63 -3.18 116.25 113.55 2dbf h VAL 16 Ca 0.00 -1.41 -0.09 0.00 0.82 0.00 0.00 66.70 66.02 2dbf h VAL 16 Cb 0.01 2.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2dbf h VAL 16 CO -0.00 0.40 -0.43 0.11 0.02 0.00 0.00 177.57 177.67 2dbf h LYS 17 N -0.18 0.00 -0.92 1.57 6.56 -1.08 -3.11 116.57 119.40 2dbf h LYS 17 Ca 0.01 0.00 0.07 0.00 -1.06 0.00 0.00 60.65 59.67 2dbf h LYS 17 Cb 0.72 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 32.31 2dbf h LYS 17 CO 0.03 0.43 0.60 -0.07 -2.06 0.00 0.00 179.45 178.39 2dbf h LEU 18 N 0.00 0.92 -0.74 2.94 3.38 -0.83 -1.19 115.31 119.78 2dbf h LEU 18 Ca -0.00 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 2dbf h LEU 18 Cb 0.94 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2dbf h LEU 18 CO 0.06 0.58 -0.59 1.56 0.09 0.00 0.00 178.44 180.15 2dbf h GLN 19 N 1.04 0.15 -0.04 1.13 4.20 -1.56 -2.99 115.11 117.04 2dbf h GLN 19 Ca 0.40 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 59.01 2dbf h GLN 19 Cb 0.22 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 2dbf h GLN 19 CO -0.16 0.69 0.01 -0.07 -0.67 0.00 0.00 178.83 178.63 2dbf h LEU 20 N 0.11 0.05 -0.80 1.46 3.38 -1.27 -1.21 115.31 117.04 2dbf h LEU 20 Ca -0.00 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 2dbf h LEU 20 Cb 1.06 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2dbf h LEU 20 CO 0.09 0.06 -0.57 1.88 0.09 0.00 0.00 178.44 179.98 2dbf h TYR 21 N 0.06 0.12 -0.00 1.13 0.05 -1.36 -2.39 116.97 114.57 2dbf h TYR 21 Ca 0.02 -0.04 -0.14 0.00 0.05 0.00 0.00 58.73 58.61 2dbf h TYR 21 Cb 0.03 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 2dbf h TYR 21 CO 0.00 0.64 -0.67 0.87 -1.05 0.00 0.00 178.16 177.95 2dbf h LYS 22 N 0.07 0.01 0.16 4.88 1.57 -1.30 -2.43 116.57 119.54 2dbf h LYS 22 Ca -0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2dbf h LYS 22 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.34 2dbf h LYS 22 CO 0.08 0.68 -0.08 -0.07 -0.57 0.00 0.00 179.45 179.49 2dbf h LEU 23 N 0.01 -0.19 -2.21 2.94 3.38 -1.33 -3.29 115.31 114.62 2dbf h LEU 23 Ca -0.01 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2dbf h LEU 23 Cb 1.19 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 2dbf h LEU 23 CO 0.09 0.35 0.14 -0.07 0.09 0.00 0.00 178.44 179.04 2dbf h LEU 24 N -1.02 0.00 -2.18 1.67 3.38 -1.54 -1.02 115.31 114.61 2dbf h LEU 24 Ca -0.02 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.00 2dbf h LEU 24 Cb 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2dbf h LEU 24 CO 0.04 0.00 0.27 -0.08 0.09 0.00 0.00 178.44 178.76 2dbf h GLU 25 N 0.00 0.00 -6.18 1.13 4.81 -1.50 -2.63 114.58 110.22 2dbf h GLU 25 Ca 0.07 0.00 -0.57 0.00 -0.13 0.00 0.00 59.36 58.73 2dbf h GLU 25 Cb 0.35 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2dbf h GLU 25 CO -0.00 0.00 1.32 0.42 -0.73 0.00 0.00 179.01 180.02 2dbf s ILE 26 N -4.50 3.28 -0.92 2.32 1.01 -0.39 -4.86 121.20 117.14 2dbf s ILE 26 Ca -0.04 0.30 -0.10 0.00 0.00 0.00 0.00 60.65 60.81 2dbf s ILE 26 Cb 0.14 -3.32 -0.07 0.00 0.01 0.00 0.00 42.46 39.22 2dbf s ILE 26 CO 0.49 -0.16 2.10 -0.81 0.00 0.00 0.00 174.94 176.55 2dbf n PRO 27 N 8.24 2.02 -4.20 2.79 -0.04 -1.26 -3.60 135.00 138.95 2dbf n PRO 27 Ca 0.24 -1.60 -0.22 0.00 -0.04 0.00 0.00 63.50 61.88 2dbf n PRO 27 Cb 0.45 -2.59 -0.06 0.00 -0.04 0.00 0.00 33.50 31.26 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 3.73 5.06 0.35 3.54 1.01 -1.26 -4.99 116.67 124.10 2dbf s ASP 28 Ca 0.45 -0.44 0.12 0.00 0.71 0.00 0.00 52.55 53.39 2dbf s ASP 28 Cb 0.11 -1.14 0.63 0.00 1.01 0.00 0.00 42.92 43.54 2dbf s ASP 28 CO -0.00 -0.02 1.77 1.55 0.21 0.00 0.00 175.17 178.68 2dbf h PRO 29 N 1.69 0.00 -0.38 8.23 0.13 -1.99 -3.07 132.00 136.61 2dbf h PRO 29 Ca -0.46 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.37 2dbf h PRO 29 Cb 1.24 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.07 2dbf h PRO 29 CO 0.61 0.43 -0.82 -0.25 -0.23 0.00 0.00 178.00 177.74 2dbf n ASP 30 N -4.01 2.87 -1.20 1.44 8.00 -1.26 -4.71 116.55 117.68 2dbf n ASP 30 Ca -0.02 -3.22 -0.05 0.00 0.71 0.00 0.00 54.79 52.22 2dbf n ASP 30 Cb 0.46 -0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 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 -0.64 0.20 -4.22 -1.24 5.02 -1.21 -4.30 118.16 111.77 2dbf n LYS 31 Ca 0.25 -0.88 -0.24 0.00 -2.02 0.00 0.00 58.31 55.42 2dbf n LYS 31 Cb 0.88 0.48 -0.07 0.00 -0.02 0.00 0.00 35.03 36.31 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 -0.87 4.87 0.23 4.39 3.84 -1.16 -4.11 114.94 122.12 2dbf s ASN 32 Ca 0.01 -0.47 -0.07 0.00 0.21 0.00 0.00 52.86 52.55 2dbf s ASN 32 Cb 0.07 -1.04 0.21 0.00 -0.55 0.00 0.00 41.25 39.94 2dbf s ASN 32 CO -0.02 0.02 1.87 4.11 -2.79 0.00 0.00 177.10 180.29 2dbf h TRP 33 N 2.04 1.21 -0.70 0.43 5.08 -1.73 -2.24 115.95 120.04 2dbf h TRP 33 Ca -0.46 -0.01 0.01 0.00 1.08 0.00 0.00 58.89 59.51 2dbf h TRP 33 Cb 1.23 -0.39 -0.04 0.00 -3.00 0.00 0.00 29.16 26.96 2dbf h TRP 33 CO 0.63 0.82 0.47 0.00 -1.28 0.00 0.00 178.44 179.08 2dbf h ALA 34 N 1.29 1.51 -0.42 0.11 0.00 -1.96 -1.69 119.26 118.10 2dbf h ALA 34 Ca 0.32 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 2dbf h ALA 34 Cb -0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2dbf h ALA 34 CO -0.06 0.45 -0.08 1.15 0.00 0.00 0.00 179.25 180.71 2dbf h THR 35 N 0.94 1.25 -0.02 0.00 2.02 -1.77 -2.68 112.91 112.66 2dbf h THR 35 Ca 0.26 -1.09 -0.12 0.00 0.77 0.00 0.00 66.41 66.22 2dbf h THR 35 Cb -0.09 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 2dbf h THR 35 CO -0.06 0.37 -0.57 0.25 0.37 0.00 0.00 175.52 175.88 2dbf h LEU 36 N 0.67 0.05 -0.47 2.58 5.85 -1.09 -3.10 115.31 119.80 2dbf h LEU 36 Ca 0.12 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.83 2dbf h LEU 36 Cb 0.53 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2dbf h LEU 36 CO 0.03 0.62 0.28 0.00 -0.34 0.00 0.00 178.44 179.03 2dbf h ALA 37 N 1.38 0.60 -0.33 1.25 0.00 -0.98 0.43 119.26 121.61 2dbf h ALA 37 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2dbf h ALA 37 Cb 1.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2dbf h ALA 37 CO 0.08 -0.02 0.09 1.96 0.00 0.00 0.00 179.25 181.36 2dbf h GLN 38 N 0.57 0.53 -0.04 0.00 4.20 -1.51 0.58 115.11 119.42 2dbf h GLN 38 Ca 0.19 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2dbf h GLN 38 Cb 0.01 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 2dbf h GLN 38 CO -0.08 0.57 0.03 0.87 -0.67 0.00 0.00 178.83 179.55 2dbf h LYS 39 N 0.38 0.06 0.52 1.46 6.56 -1.41 -3.27 116.57 120.87 2dbf h LYS 39 Ca 0.11 -0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.67 2dbf h LYS 39 Cb 0.28 -0.01 0.01 0.00 -0.57 0.00 0.00 32.23 31.93 2dbf h LYS 39 CO -0.00 0.05 -0.25 -0.07 -2.06 0.00 0.00 179.45 177.12 2dbf h LEU 40 N 0.05 -0.60 0.00 2.94 3.38 -0.86 -3.47 115.31 116.75 2dbf h LEU 40 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2dbf h LEU 40 Cb 0.00 0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2dbf h LEU 40 CO -0.00 -0.30 0.00 0.61 0.09 0.00 0.00 178.44 178.84 2dbf n GLY 41 N -0.42 0.00 1.18 0.83 0.00 0.80 -5.06 105.19 102.51 2dbf n GLY 41 Ca -0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.98 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 1.51 0.25 0.99 4.77 0.17 -4.84 117.00 119.86 2dbf n LEU 42 Ca 0.00 -2.57 0.11 0.00 -0.03 0.00 0.00 56.01 53.52 2dbf n LEU 42 Cb 0.00 -0.17 0.68 0.00 -2.33 0.00 0.00 43.42 41.60 2dbf n LEU 42 CO 0.00 0.77 0.96 1.23 -1.33 0.00 0.00 177.39 179.03 2dbf h GLY 43 N 0.96 0.00 1.72 -0.72 0.00 -1.87 -2.30 103.07 100.85 2dbf h GLY 43 Ca -0.15 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.05 2dbf h GLY 43 CO 0.07 0.00 -0.51 1.19 0.00 0.00 0.00 176.54 177.28 2dbf h ILE 44 N 0.00 1.35 -0.88 2.60 6.09 -1.93 -2.96 117.51 121.78 2dbf h ILE 44 Ca -0.00 -1.77 -0.38 0.00 -1.37 0.00 0.00 64.86 61.34 2dbf h ILE 44 Cb 0.31 1.83 -0.23 0.00 0.47 0.00 0.00 36.82 39.20 2dbf h ILE 44 CO 0.02 0.53 0.48 0.18 -3.07 0.00 0.00 178.15 176.29 2dbf n LEU 45 N -3.95 6.44 -0.09 2.19 4.77 -0.88 -4.48 117.00 121.00 2dbf n LEU 45 Ca -0.02 -3.40 -0.13 0.00 -0.03 0.00 0.00 56.01 52.43 2dbf n LEU 45 Cb 0.56 -0.80 -0.04 0.00 -2.33 0.00 0.00 43.42 40.81 2dbf n LEU 45 CO 0.44 0.93 0.60 -1.13 -1.33 0.00 0.00 177.39 176.90 2dbf h ASN 46 N 1.76 0.69 0.14 -1.43 -0.73 -1.37 -2.96 115.58 111.68 2dbf h ASN 46 Ca 0.47 -0.46 -0.06 0.00 1.87 0.00 0.00 56.30 58.12 2dbf h ASN 46 Cb 2.63 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 41.01 2dbf h ASN 46 CO 0.94 1.00 -0.23 0.78 -0.37 0.00 0.00 177.43 179.55 2dbf h ASN 47 N 0.38 0.16 -0.14 1.15 4.21 -1.83 -2.42 115.58 117.08 2dbf h ASN 47 Ca 0.05 -0.04 -0.01 0.00 1.21 0.00 0.00 56.30 57.51 2dbf h ASN 47 Cb 0.79 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.94 2dbf h ASN 47 CO 0.06 0.40 0.05 0.00 -1.29 0.00 0.00 177.43 176.65 2dbf h ALA 48 N 1.62 0.19 -0.33 -0.83 0.00 -1.84 -2.79 119.26 115.27 2dbf h ALA 48 Ca 0.03 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2dbf h ALA 48 Cb 0.49 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2dbf h ALA 48 CO 0.03 -0.22 -0.08 0.74 0.00 0.00 0.00 179.25 179.72 2dbf h PHE 49 N 0.07 0.59 -0.44 0.00 0.04 -1.36 -2.52 116.94 113.32 2dbf h PHE 49 Ca 0.05 -0.08 0.03 0.00 2.80 0.00 0.00 57.97 60.76 2dbf h PHE 49 Cb 0.18 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 2dbf h PHE 49 CO -0.01 0.63 0.29 -0.09 -0.60 0.00 0.00 178.31 178.53 2dbf h ARG 50 N 0.52 0.47 -0.04 1.51 2.43 -1.22 -1.71 114.38 116.34 2dbf h ARG 50 Ca 0.10 -0.03 -0.20 0.00 -0.81 0.00 0.00 59.98 59.04 2dbf h ARG 50 Cb 0.46 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2dbf h ARG 50 CO 0.02 0.31 -0.81 -0.07 -1.51 0.00 0.00 179.97 177.92 2dbf h LEU 51 N 0.49 0.47-10.25 3.80 3.38 -1.20 -3.46 115.31 108.54 2dbf h LEU 51 Ca 0.17 -0.34 -0.52 0.00 0.09 0.00 0.00 57.88 57.28 2dbf h LEU 51 Cb 0.10 -0.14 0.17 0.00 0.09 0.00 0.00 40.66 40.87 2dbf h LEU 51 CO -0.04 1.10 0.30 -0.44 0.09 0.00 0.00 178.44 179.45 2dbf s SER 52 N -7.00 3.75 0.33 -0.43 0.01 -0.64 -4.93 113.70 104.78 2dbf s SER 52 Ca -0.05 2.14 0.05 0.00 1.31 0.00 0.00 55.95 59.40 2dbf s SER 52 Cb 0.10 -2.56 0.57 0.00 0.21 0.00 0.00 66.02 64.33 2dbf s SER 52 CO 0.85 -2.55 1.83 1.55 0.41 0.00 0.00 173.24 175.32 2dbf h PRO 53 N -1.17 0.45 -2.76 12.44 0.13 -1.88 -3.37 132.00 135.85 2dbf h PRO 53 Ca -0.45 -0.12 -0.60 0.00 -0.87 0.00 0.00 66.00 63.96 2dbf h PRO 53 Cb 1.27 -0.05 -0.40 0.00 0.13 0.00 0.00 31.00 31.95 2dbf h PRO 53 CO 0.47 0.57 -0.80 0.00 -0.23 0.00 0.00 178.00 178.00 2dbf s ALA 54 N -4.74 1.87 0.23 -0.56 0.00 -1.26 -5.00 121.76 112.30 2dbf s ALA 54 Ca -0.07 -2.53 -0.07 0.00 0.00 0.00 0.00 51.96 49.29 2dbf s ALA 54 Cb 0.15 -1.78 0.38 0.00 0.00 0.00 0.00 23.12 21.86 2dbf s ALA 54 CO 0.77 -2.06 1.70 -1.35 0.00 0.00 0.00 175.76 174.82 2dbf h PRO 55 N 6.39 0.29 -0.11 0.00 0.11 -1.73 0.13 132.00 137.07 2dbf h PRO 55 Ca 0.09 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 2dbf h PRO 55 Cb 0.91 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 2dbf h PRO 55 CO 0.43 0.19 0.06 0.66 -0.21 0.00 0.00 178.00 179.14 2dbf h SER 56 N 0.30 0.13 0.86 -2.05 4.64 -1.91 0.18 113.55 115.70 2dbf h SER 56 Ca 0.37 -0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.46 2dbf h SER 56 Cb 0.57 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2dbf h SER 56 CO -0.44 0.11 -1.03 0.50 -0.87 0.00 0.00 176.83 175.09 2dbf h LYS 57 N 0.16 0.08 0.00 4.77 3.64 -1.18 -3.28 116.57 120.76 2dbf h LYS 57 Ca 0.04 -0.13 -0.20 0.00 -1.27 0.00 0.00 60.65 59.08 2dbf h LYS 57 Cb 0.00 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 2dbf h LYS 57 CO -0.01 1.04 -0.97 1.15 -2.27 0.00 0.00 179.45 178.38 2dbf h THR 58 N 0.03 1.69 0.86 1.00 2.02 -0.10 -3.07 112.91 115.34 2dbf h THR 58 Ca -0.04 -3.31 -0.04 0.00 0.77 0.00 0.00 66.41 63.78 2dbf h THR 58 Cb 1.77 2.79 0.00 0.00 -1.74 0.00 0.00 68.15 70.98 2dbf h THR 58 CO 0.15 0.95 -0.47 0.25 0.37 0.00 0.00 175.52 176.76 2dbf h LEU 59 N 0.00 -1.15 -1.70 2.58 5.85 -0.73 0.32 115.31 120.48 2dbf h LEU 59 Ca -0.01 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2dbf h LEU 59 Cb 1.72 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 43.05 2dbf h LEU 59 CO 0.13 -0.76 0.12 0.24 -0.34 0.00 0.00 178.44 177.83 2dbf h MET 60 N -1.23 0.32 -0.17 1.25 2.86 -1.70 0.73 114.93 116.99 2dbf h MET 60 Ca -0.12 -0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.35 2dbf h MET 60 Cb 0.96 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 2dbf h MET 60 CO 0.16 0.24 -0.51 -0.44 1.06 0.00 0.00 176.91 177.42 2dbf h ASP 61 N 0.32 0.52 0.63 1.22 5.19 -1.39 -0.89 116.42 122.04 2dbf h ASP 61 Ca 0.08 -0.27 -0.27 0.00 -0.62 0.00 0.00 57.03 55.96 2dbf h ASP 61 Cb 0.02 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 39.35 2dbf h ASP 61 CO -0.01 0.94 -1.46 0.78 -3.12 0.00 0.00 179.24 176.37 2dbf h ASN 62 N 0.38 0.08 0.55 6.45 -0.26 0.56 -3.21 115.58 120.12 2dbf h ASN 62 Ca 0.01 -0.13 -0.16 0.00 -0.56 0.00 0.00 56.30 55.47 2dbf h ASN 62 Cb 1.03 -0.03 -0.02 0.00 -1.06 0.00 0.00 38.32 38.24 2dbf h ASN 62 CO 0.09 1.11 -0.70 0.22 -1.06 0.00 0.00 177.43 177.09 2dbf h TYR 63 N 0.01 0.18 -0.21 1.19 3.20 0.45 -3.17 116.97 118.63 2dbf h TYR 63 Ca -0.20 -0.08 -0.19 0.00 3.14 0.00 0.00 58.73 61.41 2dbf h TYR 63 Cb 1.94 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 40.18 2dbf h TYR 63 CO 0.01 0.79 -0.62 1.49 -1.64 0.00 0.00 178.16 178.20 2dbf h GLU 64 N 0.09 0.73 -0.12 1.82 4.81 -1.27 -2.55 114.58 118.08 2dbf h GLU 64 Ca -0.02 -0.50 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 2dbf h GLU 64 Cb 1.25 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2dbf h GLU 64 CO 0.10 1.12 0.02 0.28 -0.73 0.00 0.00 179.01 179.81 2dbf h VAL 65 N 0.54 1.06 -0.92 0.32 2.07 -1.55 -1.79 116.25 115.98 2dbf h VAL 65 Ca -0.01 -0.22 -0.56 0.00 0.82 0.00 0.00 66.70 66.73 2dbf h VAL 65 Cb 1.21 0.95 -0.27 0.00 -1.52 0.00 0.00 31.29 31.66 2dbf h VAL 65 CO 0.13 0.08 0.72 -1.20 0.02 0.00 0.00 177.57 177.32 2dbf n SER 66 N -4.46 5.94 0.00 0.57 7.64 -1.16 -4.95 113.62 117.19 2dbf n SER 66 Ca -0.01 -3.59 0.00 0.00 1.01 0.00 0.00 58.87 56.27 2dbf n SER 66 Cb 0.12 -0.92 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 2dbf n SER 66 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dbf n GLY 67 N -0.84 1.59 1.41 0.23 0.00 -0.67 -4.98 105.19 101.92 2dbf n GLY 67 Ca 0.57 -0.66 -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 -3.58 3.51 -0.02 0.00 -0.97 -4.46 105.19 99.67 2dbf n GLY 68 Ca 0.00 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.16 3.05 0.17 2.61 -4.23 -1.26 -1.68 115.64 114.14 2dbf s THR 69 Ca -0.01 -1.26 0.03 0.00 -1.18 0.00 0.00 61.69 59.27 2dbf s THR 69 Cb 0.00 -2.36 -0.14 0.00 1.34 0.00 0.00 72.50 71.34 2dbf s THR 69 CO 0.03 0.21 1.40 0.58 -0.54 0.00 0.00 174.62 176.30 2dbf h VAL 70 N 3.62 1.49 -0.15 2.29 2.07 -1.97 -2.72 116.25 120.88 2dbf h VAL 70 Ca -0.49 -2.57 -0.00 0.00 0.82 0.00 0.00 66.70 64.46 2dbf h VAL 70 Cb 1.16 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 33.35 2dbf h VAL 70 CO 0.49 0.75 0.09 0.03 0.02 0.00 0.00 177.57 178.95 2dbf h ARG 71 N 0.10 0.20 0.08 1.57 3.08 -1.95 0.64 114.38 118.10 2dbf h ARG 71 Ca -0.04 -0.01 -0.30 0.00 0.07 0.00 0.00 59.98 59.70 2dbf h ARG 71 Cb 1.46 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.44 2dbf h ARG 71 CO 0.13 0.14 -1.57 0.93 -1.07 0.00 0.00 179.97 178.53 2dbf h GLU 72 N 0.20 0.17 -0.05 0.04 5.08 -1.98 -2.87 114.58 115.18 2dbf h GLU 72 Ca 0.05 -0.29 -0.11 0.00 -1.00 0.00 0.00 59.36 58.01 2dbf h GLU 72 Cb -0.01 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2dbf h GLU 72 CO -0.01 0.97 -0.48 1.25 -1.00 0.00 0.00 179.01 179.74 2dbf h LEU 73 N 0.05 0.13 0.22 1.33 5.85 -1.08 0.94 115.31 122.74 2dbf h LEU 73 Ca -0.25 -0.06 -0.33 0.00 0.84 0.00 0.00 57.88 58.08 2dbf h LEU 73 Cb 1.99 -0.04 0.03 0.00 0.37 0.00 0.00 40.66 43.01 2dbf h LEU 73 CO 0.13 0.60 -1.50 0.58 -0.34 0.00 0.00 178.44 177.91 2dbf h VAL 74 N 0.10 1.25 -0.14 1.05 2.07 -1.00 -3.19 116.25 116.39 2dbf h VAL 74 Ca 0.00 -2.73 -0.19 0.00 0.82 0.00 0.00 66.70 64.60 2dbf h VAL 74 Cb 0.89 2.97 0.01 0.00 -1.52 0.00 0.00 31.29 33.64 2dbf h VAL 74 CO 0.07 0.83 -0.64 -0.33 0.02 0.00 0.00 177.57 177.52 2dbf h GLU 75 N 0.13 0.69 -0.12 1.57 5.08 -1.46 -3.00 114.58 117.47 2dbf h GLU 75 Ca -0.25 -0.55 0.01 0.00 -1.00 0.00 0.00 59.36 57.56 2dbf h GLU 75 Cb 2.13 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 31.48 2dbf h GLU 75 CO 0.25 1.17 0.08 0.00 -1.00 0.00 0.00 179.01 179.51 2dbf h ALA 76 N 0.53 1.95 -0.12 3.43 0.00 -0.94 -0.18 119.26 123.94 2dbf h ALA 76 Ca -0.04 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.66 2dbf h ALA 76 Cb 1.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2dbf h ALA 76 CO 0.13 0.03 -0.76 -0.07 0.00 0.00 0.00 179.25 178.59 2dbf h LEU 77 N 0.13 0.74 -0.54 0.00 3.38 -1.52 -3.00 115.31 114.50 2dbf h LEU 77 Ca 0.05 -0.48 -0.16 0.00 0.09 0.00 0.00 57.88 57.38 2dbf h LEU 77 Cb 0.03 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2dbf h LEU 77 CO -0.01 1.26 -0.71 -0.09 0.09 0.00 0.00 178.44 178.97 2dbf h ARG 78 N 0.42 0.11 -0.12 1.13 2.43 -1.19 0.09 114.38 117.26 2dbf h ARG 78 Ca -0.04 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 58.96 2dbf h ARG 78 Cb 1.36 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.92 2dbf h ARG 78 CO 0.15 0.77 -0.29 1.96 -1.51 0.00 0.00 179.97 181.05 2dbf h GLN 79 N 0.07 0.21 0.00 0.20 4.20 -1.05 -3.33 115.11 115.42 2dbf h GLN 79 Ca -0.02 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2dbf h GLN 79 Cb 1.26 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.03 2dbf h GLN 79 CO 0.10 0.49 -0.19 0.52 -0.67 0.00 0.00 178.83 179.08 2dbf h MET 80 N 0.19 0.00 0.00 1.46 2.86 -1.44 -3.50 114.93 114.50 2dbf h MET 80 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2dbf h MET 80 Cb 0.61 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.27 2dbf h MET 80 CO 0.04 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.42 2dbf n GLY 81 N 1.74 0.00 3.78 8.32 0.00 -0.55 -4.97 105.19 113.51 2dbf n GLY 81 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 3.29 0.00 1.61 2.02 -0.09 -4.97 117.35 119.21 2dbf s TYR 82 Ca 0.00 0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.92 2dbf s TYR 82 Cb 0.00 -1.75 0.00 0.00 -0.40 0.00 0.00 41.96 39.81 2dbf s TYR 82 CO 0.00 0.55 0.00 2.41 -1.57 0.00 0.00 175.55 176.94 2dbf n THR 83 N 1.26 0.00 -0.03 -0.71 -1.04 -1.26 -4.57 114.28 107.93 2dbf n THR 83 Ca -0.14 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.76 2dbf n THR 83 Cb 0.53 -1.31 0.01 0.00 -1.82 0.00 0.00 70.33 67.73 2dbf n THR 83 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2dbf h GLU 84 N 0.00 0.70 -0.12 -2.82 5.08 -1.99 -2.58 114.58 112.85 2dbf h GLU 84 Ca 0.00 -0.45 0.02 0.00 -1.00 0.00 0.00 59.36 57.94 2dbf h GLU 84 Cb 1.00 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 2dbf h GLU 84 CO 0.00 1.07 0.08 0.00 -1.00 0.00 0.00 179.01 179.16 2dbf h ALA 85 N 0.84 2.04 0.01 3.43 0.00 -1.96 -0.94 119.26 122.68 2dbf h ALA 85 Ca 0.01 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 2dbf h ALA 85 Cb 1.13 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 2dbf h ALA 85 CO 0.11 -0.07 -1.29 0.82 0.00 0.00 0.00 179.25 178.83 2dbf h ILE 86 N 0.06 1.37 -0.04 0.00 2.04 -1.79 -3.28 117.51 115.87 2dbf h ILE 86 Ca 0.05 -3.12 -0.13 0.00 1.00 0.00 0.00 64.86 62.65 2dbf h ILE 86 Cb 0.14 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 2dbf h ILE 86 CO -0.00 0.79 -0.59 -0.33 0.00 0.00 0.00 178.15 178.01 2dbf h GLU 87 N 0.01 0.12 -0.40 2.37 5.08 -0.89 -1.27 114.58 119.61 2dbf h GLU 87 Ca -0.13 -0.08 -0.14 0.00 -1.00 0.00 0.00 59.36 58.02 2dbf h GLU 87 Cb 1.88 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.13 2dbf h GLU 87 CO 0.12 0.68 -0.28 0.28 -1.00 0.00 0.00 179.01 178.80 2dbf h VAL 88 N 0.09 1.27 0.05 3.13 2.07 -1.31 -0.05 116.25 121.51 2dbf h VAL 88 Ca -0.01 -1.44 -0.14 0.00 0.82 0.00 0.00 66.70 65.94 2dbf h VAL 88 Cb 1.07 1.26 0.01 0.00 -1.52 0.00 0.00 31.29 32.12 2dbf h VAL 88 CO 0.09 0.48 -0.57 0.40 0.02 0.00 0.00 177.57 177.99 2dbf h ILE 89 N 0.74 1.50 -0.09 4.57 2.04 -1.60 -3.23 117.51 121.44 2dbf h ILE 89 Ca 0.08 -2.22 -0.06 0.00 1.00 0.00 0.00 64.86 63.66 2dbf h ILE 89 Cb 0.84 2.87 -0.01 0.00 -0.74 0.00 0.00 36.82 39.78 2dbf h ILE 89 CO 0.07 0.63 -0.23 1.56 0.00 0.00 0.00 178.15 180.18 2dbf h GLN 90 N -0.32 0.16 -0.05 2.37 4.20 -1.26 0.40 115.11 120.61 2dbf h GLN 90 Ca -0.08 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.53 2dbf h GLN 90 Cb 1.35 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.10 2dbf h GLN 90 CO 0.11 0.38 -0.20 0.00 -0.67 0.00 0.00 178.83 178.46 2dbf h ALA 91 N 1.63 1.59 0.00 3.87 0.00 -1.06 -2.66 119.26 122.63 2dbf h ALA 91 Ca 0.02 -0.21 -0.35 0.00 0.00 0.00 0.00 54.91 54.38 2dbf h ALA 91 Cb 0.49 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 2dbf h ALA 91 CO 0.03 0.30 -2.28 0.00 0.00 0.00 0.00 179.25 177.30 2dbf n ALA 92 N -2.49 1.54 -0.34 0.00 0.00 -0.92 -4.37 120.51 113.93 2dbf n ALA 92 Ca -0.02 -1.24 -0.02 0.00 0.00 0.00 0.00 53.44 52.16 2dbf n ALA 92 Cb 0.28 -0.29 0.11 0.00 0.00 0.00 0.00 19.45 19.55 2dbf n ALA 92 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2dbf h SER 93 N 0.00 1.03 -2.10 0.00 4.64 -0.10 -3.47 113.55 113.55 2dbf h SER 93 Ca -0.50 -0.02 0.25 0.00 -0.47 0.00 0.00 61.79 61.05 2dbf h SER 93 Cb 2.18 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 63.98 2dbf h SER 93 CO 0.04 0.73 0.70 -0.24 -0.87 0.00 0.00 176.83 177.19 2dbf n SER 94 N -4.47 -1.27 -3.36 4.97 2.88 -1.01 -5.07 113.62 106.29 2dbf n SER 94 Ca 0.11 -1.45 -0.25 0.00 -1.33 0.00 0.00 58.87 55.94 2dbf n SER 94 Cb 0.04 2.01 -0.09 0.00 -0.75 0.00 0.00 64.21 65.42 2dbf n SER 94 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dbf s SER 95 N -3.41 1.40 0.00 -3.46 0.01 -1.26 -4.43 113.70 102.55 2dbf s SER 95 Ca 0.25 -2.81 0.00 0.00 1.31 0.00 0.00 55.95 54.70 2dbf s SER 95 Cb -0.01 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 65.98 2dbf s SER 95 CO 0.02 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.09 2dbf n GLY 96 N 3.06 0.06 0.24 3.44 0.00 -1.26 -4.96 105.19 105.76 2dbf n GLY 96 Ca 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.15 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 0.84 -3.96 1.61 0.13 -2.00 -3.45 132.00 125.18 2dbf h PRO 97 Ca 0.00 -0.46 -0.25 0.00 -0.87 0.00 0.00 66.00 64.42 2dbf h PRO 97 Cb 0.00 0.03 -0.27 0.00 0.13 0.00 0.00 31.00 30.89 2dbf h PRO 97 CO 0.00 1.10 -0.73 -1.12 -0.23 0.00 0.00 178.00 177.02 2dbf s SER 98 N -6.75 0.23 -0.20 1.44 0.01 -1.26 -5.15 113.70 102.03 2dbf s SER 98 Ca -0.11 -0.13 -0.09 0.00 1.31 0.00 0.00 55.95 56.93 2dbf s SER 98 Cb 0.10 0.00 0.08 0.00 0.21 0.00 0.00 66.02 66.41 2dbf s SER 98 CO 0.86 -0.04 0.44 -0.44 0.41 0.00 0.00 173.24 174.48 2dbf s SER 99 N -0.35 -0.44 0.00 2.44 0.01 -1.26 -4.64 113.70 109.46 2dbf s SER 99 Ca -0.03 1.02 0.00 0.00 1.31 0.00 0.00 55.95 58.25 2dbf s SER 99 Cb -0.03 1.17 0.00 0.00 0.21 0.00 0.00 66.02 67.38 2dbf s SER 99 CO -0.00 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.04