#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 0.92 -3.70 1.61 3.41 -1.26 -5.18 113.62 109.43 2dbf n SER 2 Ca 0.00 -1.01 -0.14 0.00 -0.26 0.00 0.00 58.87 57.46 2dbf n SER 2 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.87 2dbf n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dbf s SER 3 N -1.01 -0.43 0.00 4.04 0.01 -1.26 -5.11 113.70 109.94 2dbf s SER 3 Ca 0.00 0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.91 2dbf s SER 3 Cb 0.00 0.70 0.00 0.00 0.21 0.00 0.00 66.02 66.93 2dbf s SER 3 CO 0.00 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 173.94 2dbf n GLY 4 N 2.06 0.37 3.15 3.44 0.00 -1.26 -5.13 105.19 107.82 2dbf n GLY 4 Ca -0.17 -1.12 0.05 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.54 0.78 1.61 0.15 -1.26 -5.12 113.70 109.31 2dbf s SER 5 Ca 0.00 0.06 -0.11 0.00 0.70 0.00 0.00 55.95 56.60 2dbf s SER 5 Cb 0.00 1.33 0.06 0.00 -1.71 0.00 0.00 66.02 65.70 2dbf s SER 5 CO 0.00 -0.10 1.10 -0.94 1.20 0.00 0.00 173.24 174.50 2dbf s SER 6 N 2.93 4.37 -0.29 5.45 1.04 -1.26 -4.74 113.70 121.19 2dbf s SER 6 Ca 0.26 1.89 -0.16 0.00 0.48 0.00 0.00 55.95 58.42 2dbf s SER 6 Cb -0.03 -2.53 0.15 0.00 0.10 0.00 0.00 66.02 63.71 2dbf s SER 6 CO -0.23 -2.13 0.95 -0.83 0.98 0.00 0.00 173.24 171.98 2dbf s GLY 7 N -3.23 -0.10 -0.46 7.32 0.00 -1.26 -4.42 107.32 105.17 2dbf s GLY 7 Ca 0.62 3.05 0.03 0.00 0.00 0.00 0.00 44.72 48.43 2dbf s GLY 7 CO 0.55 2.74 1.54 1.22 0.00 0.00 0.00 173.10 179.15 2dbf n ASP 8 N 4.08 6.09 0.06 1.64 8.00 -0.99 -4.61 116.55 130.82 2dbf n ASP 8 Ca -0.16 -3.77 -0.01 0.00 0.71 0.00 0.00 54.79 51.56 2dbf n ASP 8 Cb 0.56 -0.61 -0.07 0.00 -0.02 0.00 0.00 41.12 40.98 2dbf n ASP 8 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2dbf h MET 9 N 2.14 0.00 -0.40 -1.24 2.86 -1.83 -3.33 114.93 113.13 2dbf h MET 9 Ca 0.47 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 58.20 2dbf h MET 9 Cb 1.20 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.84 2dbf h MET 9 CO 1.11 0.43 0.28 0.87 1.06 0.00 0.00 176.91 180.66 2dbf h LYS 10 N 0.00 0.14 -0.02 1.72 1.79 -1.92 0.02 116.57 118.30 2dbf h LYS 10 Ca -0.12 -0.01 -0.16 0.00 -2.18 0.00 0.00 60.65 58.18 2dbf h LYS 10 Cb 1.60 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 32.20 2dbf h LYS 10 CO 0.06 0.09 -0.70 -0.56 -1.08 0.00 0.00 179.45 177.26 2dbf h GLN 11 N 0.14 0.10 -6.70 3.15 3.07 -1.94 -3.44 115.11 109.49 2dbf h GLN 11 Ca 0.19 -0.08 -0.52 0.00 0.09 0.00 0.00 58.65 58.32 2dbf h GLN 11 Cb 0.55 0.02 0.04 0.00 0.08 0.00 0.00 27.48 28.18 2dbf h GLN 11 CO -0.03 0.76 0.72 -0.51 0.09 0.00 0.00 178.83 179.86 2dbf s LEU 12 N -7.56 4.40 0.49 0.06 1.43 -0.01 -5.00 118.68 112.48 2dbf s LEU 12 Ca -0.02 2.54 -0.18 0.00 -1.03 0.00 0.00 54.13 55.44 2dbf s LEU 12 Cb 0.12 -3.61 -0.09 0.00 0.03 0.00 0.00 46.19 42.63 2dbf s LEU 12 CO 0.79 -0.63 0.98 0.00 0.23 0.00 0.00 176.35 177.71 2dbf s ALA 13 N 0.14 3.04 0.47 4.21 0.00 -1.26 -4.95 121.76 123.42 2dbf s ALA 13 Ca 0.59 0.28 0.13 0.00 0.00 0.00 0.00 51.96 52.96 2dbf s ALA 13 Cb -0.39 -3.14 1.11 0.00 0.00 0.00 0.00 23.12 20.70 2dbf s ALA 13 CO 0.40 -0.12 2.10 1.49 0.00 0.00 0.00 175.76 179.62 2dbf h GLU 14 N 1.28 0.23 -0.07 0.00 4.81 -1.96 -0.88 114.58 117.99 2dbf h GLU 14 Ca -0.48 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.70 2dbf h GLU 14 Cb 1.18 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2dbf h GLU 14 CO 0.61 0.15 -0.14 -0.44 -0.73 0.00 0.00 179.01 178.46 2dbf h ASP 15 N 0.23 0.10 0.05 1.04 5.19 -1.99 -0.25 116.42 120.80 2dbf h ASP 15 Ca 0.09 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.48 2dbf h ASP 15 Cb 0.07 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.56 2dbf h ASP 15 CO -0.02 0.26 -0.02 0.58 -3.12 0.00 0.00 179.24 176.92 2dbf h VAL 16 N 0.10 1.19 0.00 -1.35 2.07 -1.51 -3.07 116.25 113.69 2dbf h VAL 16 Ca 0.02 -0.80 -0.09 0.00 0.82 0.00 0.00 66.70 66.65 2dbf h VAL 16 Cb 0.32 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 2dbf h VAL 16 CO 0.02 0.20 -0.44 0.11 0.02 0.00 0.00 177.57 177.48 2dbf h LYS 17 N -0.42 0.00 -0.85 1.57 6.56 -1.48 -2.97 116.57 118.98 2dbf h LYS 17 Ca -0.01 0.00 0.06 0.00 -1.06 0.00 0.00 60.65 59.64 2dbf h LYS 17 Cb 0.38 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 31.99 2dbf h LYS 17 CO 0.01 0.44 0.56 -0.07 -2.06 0.00 0.00 179.45 178.33 2dbf h LEU 18 N 0.00 0.86 -0.36 2.94 3.38 -0.97 -1.67 115.31 119.48 2dbf h LEU 18 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 2dbf h LEU 18 Cb 0.82 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 2dbf h LEU 18 CO 0.06 0.56 -0.77 1.56 0.09 0.00 0.00 178.44 179.93 2dbf h GLN 19 N 0.98 0.38 -0.09 1.13 4.20 -1.43 -3.11 115.11 117.17 2dbf h GLN 19 Ca 0.36 -0.33 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2dbf h GLN 19 Cb 0.17 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 2dbf h GLN 19 CO -0.12 0.98 0.05 -0.07 -0.67 0.00 0.00 178.83 179.00 2dbf h LEU 20 N 0.25 0.10 -0.24 1.46 3.38 -1.27 -2.04 115.31 116.95 2dbf h LEU 20 Ca -0.04 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2dbf h LEU 20 Cb 1.36 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 2dbf h LEU 20 CO 0.13 0.08 0.00 1.88 0.09 0.00 0.00 178.44 180.63 2dbf h TYR 21 N 0.12 0.46 -0.51 1.13 0.05 -1.39 -1.67 116.97 115.17 2dbf h TYR 21 Ca 0.03 -0.08 -0.07 0.00 0.05 0.00 0.00 58.73 58.66 2dbf h TYR 21 Cb 0.00 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.60 2dbf h TYR 21 CO 0.00 0.59 0.04 0.87 -1.05 0.00 0.00 178.16 178.61 2dbf h LYS 22 N 0.20 0.83 0.64 4.88 1.57 -1.49 -1.28 116.57 121.93 2dbf h LYS 22 Ca 0.07 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 2dbf h LYS 22 Cb 0.40 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.62 2dbf h LYS 22 CO 0.01 0.81 -0.31 -0.07 -0.57 0.00 0.00 179.45 179.32 2dbf h LEU 23 N 0.78 -0.73 -2.22 2.94 3.38 -1.27 -2.98 115.31 115.21 2dbf h LEU 23 Ca 0.16 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.13 2dbf h LEU 23 Cb 0.42 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2dbf h LEU 23 CO 0.01 -0.39 0.06 -0.07 0.09 0.00 0.00 178.44 178.15 2dbf h LEU 24 N -1.10 0.00 -2.28 1.67 3.38 -1.30 -1.07 115.31 114.62 2dbf h LEU 24 Ca -0.09 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.92 2dbf h LEU 24 Cb 0.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2dbf h LEU 24 CO 0.15 0.00 0.15 -0.08 0.09 0.00 0.00 178.44 178.75 2dbf h GLU 25 N 0.00 0.00 -6.41 1.13 4.81 -1.06 -2.61 114.58 110.43 2dbf h GLU 25 Ca 0.03 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.73 2dbf h GLU 25 Cb 0.16 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.56 2dbf h GLU 25 CO -0.00 0.00 1.19 0.42 -0.73 0.00 0.00 179.01 179.89 2dbf s ILE 26 N -4.65 2.84 -1.23 2.32 1.01 -0.41 -4.86 121.20 116.23 2dbf s ILE 26 Ca -0.05 0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.56 2dbf s ILE 26 Cb 0.15 -3.03 -0.07 0.00 0.01 0.00 0.00 42.46 39.53 2dbf s ILE 26 CO 0.55 -0.00 2.48 -0.81 0.00 0.00 0.00 174.94 177.15 2dbf n PRO 27 N 6.84 2.78 -4.01 2.79 -0.04 -1.26 -3.89 135.00 138.21 2dbf n PRO 27 Ca 0.19 -1.81 -0.22 0.00 -0.04 0.00 0.00 63.50 61.62 2dbf n PRO 27 Cb 0.40 -2.63 -0.05 0.00 -0.04 0.00 0.00 33.50 31.18 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 2.91 5.01 0.06 3.54 1.11 -1.26 -5.02 116.67 123.02 2dbf s ASP 28 Ca 0.53 -0.59 -0.18 0.00 0.18 0.00 0.00 52.55 52.49 2dbf s ASP 28 Cb 0.14 -0.92 -0.12 0.00 1.07 0.00 0.00 42.92 43.09 2dbf s ASP 28 CO -0.04 -0.26 1.39 1.55 1.18 0.00 0.00 175.17 178.98 2dbf h PRO 29 N 1.45 0.47 -0.54 8.23 0.13 -1.99 -3.18 132.00 136.58 2dbf h PRO 29 Ca -0.45 -0.24 -0.35 0.00 -0.87 0.00 0.00 66.00 64.09 2dbf h PRO 29 Cb 1.25 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.16 2dbf h PRO 29 CO 0.61 0.80 -0.20 -0.25 -0.23 0.00 0.00 178.00 178.73 2dbf n ASP 30 N -4.47 3.88 -1.26 1.44 9.92 -1.26 -4.52 116.55 120.27 2dbf n ASP 30 Ca -0.05 -3.79 -0.04 0.00 -0.53 0.00 0.00 54.79 50.38 2dbf n ASP 30 Cb 0.38 -0.59 -0.03 0.00 -0.64 0.00 0.00 41.12 40.24 2dbf n ASP 30 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2dbf n LYS 31 N -0.97 0.11 -4.24 -1.24 5.02 -1.24 -4.48 118.16 111.12 2dbf n LYS 31 Ca 0.40 -1.31 -0.27 0.00 -2.02 0.00 0.00 58.31 55.11 2dbf n LYS 31 Cb 0.94 0.33 -0.08 0.00 -0.02 0.00 0.00 35.03 36.20 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 -1.32 4.53 0.36 4.39 3.04 -1.20 -4.15 114.94 120.60 2dbf s ASN 32 Ca 0.10 -0.48 0.04 0.00 0.04 0.00 0.00 52.86 52.56 2dbf s ASN 32 Cb 0.13 -0.88 0.70 0.00 -1.54 0.00 0.00 41.25 39.66 2dbf s ASN 32 CO -0.05 0.10 1.98 4.11 -3.04 0.00 0.00 177.10 180.19 2dbf h TRP 33 N 2.80 0.62 -0.80 0.43 5.08 -1.74 -2.15 115.95 120.19 2dbf h TRP 33 Ca -0.47 -0.01 0.02 0.00 1.08 0.00 0.00 58.89 59.51 2dbf h TRP 33 Cb 1.20 -0.20 -0.04 0.00 -3.00 0.00 0.00 29.16 27.12 2dbf h TRP 33 CO 0.64 0.46 0.53 0.00 -1.28 0.00 0.00 178.44 178.78 2dbf h ALA 34 N 1.61 1.46 -0.31 0.11 0.00 -1.95 -1.27 119.26 118.91 2dbf h ALA 34 Ca 0.16 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2dbf h ALA 34 Cb 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2dbf h ALA 34 CO -0.02 0.49 -0.29 1.15 0.00 0.00 0.00 179.25 180.57 2dbf h THR 35 N 1.05 1.28 -0.22 0.00 2.02 -1.72 -2.95 112.91 112.36 2dbf h THR 35 Ca 0.30 -1.40 -0.13 0.00 0.77 0.00 0.00 66.41 65.96 2dbf h THR 35 Cb -0.07 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 2dbf h THR 35 CO -0.07 0.45 -0.40 0.25 0.37 0.00 0.00 175.52 176.12 2dbf h LEU 36 N 0.55 0.55 -1.63 2.58 5.85 -1.18 -2.61 115.31 119.42 2dbf h LEU 36 Ca 0.07 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 2dbf h LEU 36 Cb 0.78 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 2dbf h LEU 36 CO 0.06 0.89 0.21 0.00 -0.34 0.00 0.00 178.44 179.27 2dbf h ALA 37 N 1.14 1.73 0.13 1.25 0.00 -1.09 0.15 119.26 122.56 2dbf h ALA 37 Ca 0.04 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.62 2dbf h ALA 37 Cb 0.89 -0.14 0.03 0.00 0.00 0.00 0.00 17.79 18.56 2dbf h ALA 37 CO 0.08 0.25 -1.25 1.96 0.00 0.00 0.00 179.25 180.28 2dbf h GLN 38 N 0.47 0.56 -0.16 0.00 1.08 -1.46 0.66 115.11 116.27 2dbf h GLN 38 Ca 0.13 -0.78 -0.04 0.00 -1.45 0.00 0.00 58.65 56.51 2dbf h GLN 38 Cb -0.03 0.26 -0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2dbf h GLN 38 CO -0.02 1.35 -0.07 0.87 -0.95 0.00 0.00 178.83 180.01 2dbf h LYS 39 N 0.24 0.33 0.15 1.46 6.56 -1.05 -3.35 116.57 120.90 2dbf h LYS 39 Ca -0.18 -0.14 -0.01 0.00 -1.06 0.00 0.00 60.65 59.26 2dbf h LYS 39 Cb 1.93 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 33.58 2dbf h LYS 39 CO 0.23 0.63 -0.07 -0.07 -2.06 0.00 0.00 179.45 178.11 2dbf h LEU 40 N 0.01 -0.17 0.00 2.94 3.38 -0.84 -3.47 115.31 117.16 2dbf h LEU 40 Ca 0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2dbf h LEU 40 Cb 0.53 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2dbf h LEU 40 CO 0.02 -0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.06 2dbf n GLY 41 N -0.44 0.00 1.55 0.83 0.00 -0.96 -5.06 105.19 101.12 2dbf n GLY 41 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 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 0.14 0.27 0.99 4.77 0.22 -4.91 117.00 118.48 2dbf n LEU 42 Ca 0.00 -2.20 0.16 0.00 -0.03 0.00 0.00 56.01 53.94 2dbf n LEU 42 Cb 0.00 0.06 0.70 0.00 -2.33 0.00 0.00 43.42 41.84 2dbf n LEU 42 CO 0.00 1.01 0.98 1.23 -1.33 0.00 0.00 177.39 179.28 2dbf h GLY 43 N 0.80 0.00 2.00 -0.72 0.00 -1.45 -2.83 103.07 100.88 2dbf h GLY 43 Ca -0.36 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 2dbf h GLY 43 CO -0.06 0.00 -0.22 1.19 0.00 0.00 0.00 176.54 177.45 2dbf h ILE 44 N 0.00 1.07 -0.73 2.60 6.09 -1.91 -2.58 117.51 122.06 2dbf h ILE 44 Ca -0.00 -0.78 -0.46 0.00 -1.37 0.00 0.00 64.86 62.26 2dbf h ILE 44 Cb 0.50 1.43 -0.26 0.00 0.47 0.00 0.00 36.82 38.96 2dbf h ILE 44 CO 0.00 0.22 0.16 0.18 -3.07 0.00 0.00 178.15 175.64 2dbf n LEU 45 N -4.15 5.76 0.12 2.19 4.77 -1.07 -4.63 117.00 119.99 2dbf n LEU 45 Ca -0.02 -4.10 -0.00 0.00 -0.03 0.00 0.00 56.01 51.86 2dbf n LEU 45 Cb 0.28 -0.71 0.28 0.00 -2.33 0.00 0.00 43.42 40.94 2dbf n LEU 45 CO 0.36 1.46 0.69 -1.13 -1.33 0.00 0.00 177.39 177.44 2dbf h ASN 46 N 1.52 0.18 0.72 -1.43 -0.73 -1.54 -2.80 115.58 111.49 2dbf h ASN 46 Ca 0.44 -0.07 -0.18 0.00 1.87 0.00 0.00 56.30 58.35 2dbf h ASN 46 Cb 1.62 -0.05 -0.02 0.00 0.27 0.00 0.00 38.32 40.14 2dbf h ASN 46 CO 0.93 0.54 -0.85 -1.13 -0.37 0.00 0.00 177.43 176.55 2dbf h ASN 47 N 0.15 0.11 0.14 1.15 -1.24 -1.84 -2.87 115.58 111.18 2dbf h ASN 47 Ca 0.02 -0.09 -0.06 0.00 0.71 0.00 0.00 56.30 56.88 2dbf h ASN 47 Cb 0.73 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.73 2dbf h ASN 47 CO 0.05 0.90 -0.21 0.00 -1.29 0.00 0.00 177.43 176.89 2dbf h ALA 48 N 1.09 1.48 0.12 1.57 0.00 -1.84 -2.76 119.26 118.93 2dbf h ALA 48 Ca -0.02 -0.24 -0.28 0.00 0.00 0.00 0.00 54.91 54.36 2dbf h ALA 48 Cb 1.48 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2dbf h ALA 48 CO 0.12 0.37 -1.31 0.74 0.00 0.00 0.00 179.25 179.17 2dbf h PHE 49 N 0.14 0.48 -0.25 0.00 0.04 -1.51 -3.25 116.94 112.60 2dbf h PHE 49 Ca 0.03 -0.35 0.01 0.00 2.80 0.00 0.00 57.97 60.46 2dbf h PHE 49 Cb 0.46 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 2dbf h PHE 49 CO 0.00 1.30 0.16 -0.09 -0.60 0.00 0.00 178.31 179.09 2dbf h ARG 50 N 0.07 0.30 -0.02 1.51 2.43 -1.26 -1.44 114.38 115.97 2dbf h ARG 50 Ca -0.16 -0.02 -0.18 0.00 -0.81 0.00 0.00 59.98 58.82 2dbf h ARG 50 Cb 1.98 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 31.45 2dbf h ARG 50 CO 0.19 0.20 -0.78 -0.07 -1.51 0.00 0.00 179.97 178.00 2dbf h LEU 51 N 0.30 0.22-10.28 3.80 3.38 -1.57 -3.46 115.31 107.70 2dbf h LEU 51 Ca 0.09 -0.16 -0.52 0.00 0.09 0.00 0.00 57.88 57.39 2dbf h LEU 51 Cb 0.01 -0.07 0.16 0.00 0.09 0.00 0.00 40.66 40.85 2dbf h LEU 51 CO -0.02 0.91 0.29 -0.44 0.09 0.00 0.00 178.44 179.27 2dbf s SER 52 N -6.90 3.88 0.44 -0.43 0.01 -0.54 -4.93 113.70 105.24 2dbf s SER 52 Ca -0.03 2.02 0.19 0.00 1.31 0.00 0.00 55.95 59.44 2dbf s SER 52 Cb 0.11 -2.55 1.04 0.00 0.21 0.00 0.00 66.02 64.83 2dbf s SER 52 CO 0.81 -2.46 1.93 1.55 0.41 0.00 0.00 173.24 175.49 2dbf h PRO 53 N -1.30 0.00 -2.44 12.44 0.13 -1.88 -3.37 132.00 135.58 2dbf h PRO 53 Ca -0.44 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.13 2dbf h PRO 53 Cb 1.25 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 32.00 2dbf h PRO 53 CO 0.47 0.24 -0.87 0.00 -0.23 0.00 0.00 178.00 177.61 2dbf s ALA 54 N -4.18 0.91 0.26 -0.56 0.00 -1.26 -5.00 121.76 111.93 2dbf s ALA 54 Ca -0.03 -1.95 -0.01 0.00 0.00 0.00 0.00 51.96 49.98 2dbf s ALA 54 Cb 0.14 -1.65 0.55 0.00 0.00 0.00 0.00 23.12 22.15 2dbf s ALA 54 CO 0.66 -2.07 1.76 -1.35 0.00 0.00 0.00 175.76 174.76 2dbf h PRO 55 N 6.55 0.59 -0.48 0.00 0.11 -1.73 0.13 132.00 137.15 2dbf h PRO 55 Ca 0.13 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.17 2dbf h PRO 55 Cb 0.96 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.91 2dbf h PRO 55 CO 0.29 0.39 0.16 0.66 -0.21 0.00 0.00 178.00 179.29 2dbf h SER 56 N 0.60 0.65 0.09 -2.05 4.64 -1.90 -0.69 113.55 114.89 2dbf h SER 56 Ca 0.47 -0.09 -0.25 0.00 -0.47 0.00 0.00 61.79 61.45 2dbf h SER 56 Cb 0.68 -0.17 0.02 0.00 -0.31 0.00 0.00 62.40 62.62 2dbf h SER 56 CO -0.37 0.61 -1.01 0.50 -0.87 0.00 0.00 176.83 175.69 2dbf h LYS 57 N 0.70 0.63 -0.40 4.77 3.64 -1.37 -3.17 116.57 121.36 2dbf h LYS 57 Ca 0.16 -0.67 -0.08 0.00 -1.27 0.00 0.00 60.65 58.79 2dbf h LYS 57 Cb 0.19 0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 2dbf h LYS 57 CO -0.01 1.27 -0.09 1.15 -2.27 0.00 0.00 179.45 179.49 2dbf h THR 58 N 0.36 1.25 -0.24 1.00 2.02 -0.52 -2.87 112.91 113.90 2dbf h THR 58 Ca -0.11 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 65.97 2dbf h THR 58 Cb 1.65 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 2dbf h THR 58 CO 0.19 0.37 0.16 0.25 0.37 0.00 0.00 175.52 176.86 2dbf h LEU 59 N 0.64 0.28 -1.85 2.58 5.85 -1.16 -2.02 115.31 119.62 2dbf h LEU 59 Ca 0.11 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2dbf h LEU 59 Cb 0.53 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 2dbf h LEU 59 CO 0.03 0.21 0.02 0.24 -0.34 0.00 0.00 178.44 178.60 2dbf h MET 60 N 0.32 0.11 -0.19 1.25 2.86 -1.50 -0.25 114.93 117.52 2dbf h MET 60 Ca 0.09 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.60 2dbf h MET 60 Cb -0.02 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 2dbf h MET 60 CO -0.02 0.11 -0.38 0.22 1.06 0.00 0.00 176.91 177.90 2dbf h ASP 61 N 0.11 0.45 0.51 1.22 1.82 -1.16 -0.44 116.42 118.93 2dbf h ASP 61 Ca 0.03 -0.19 -0.30 0.00 -0.39 0.00 0.00 57.03 56.19 2dbf h ASP 61 Cb 0.05 -0.12 0.02 0.00 0.68 0.00 0.00 39.33 39.95 2dbf h ASP 61 CO -0.00 0.79 -1.33 0.78 -1.61 0.00 0.00 179.24 177.87 2dbf h ASN 62 N 0.36 0.56 -0.11 2.28 -0.26 -0.79 -3.12 115.58 114.50 2dbf h ASN 62 Ca 0.04 -0.60 -0.16 0.00 -0.56 0.00 0.00 56.30 55.01 2dbf h ASN 62 Cb 0.83 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.90 2dbf h ASN 62 CO 0.07 1.47 -0.49 0.22 -1.06 0.00 0.00 177.43 177.64 2dbf h TYR 63 N 0.10 0.84 -0.43 1.19 3.20 -1.02 -2.31 116.97 118.54 2dbf h TYR 63 Ca -0.18 -0.28 -0.02 0.00 3.14 0.00 0.00 58.73 61.39 2dbf h TYR 63 Cb 2.04 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 40.12 2dbf h TYR 63 CO 0.08 1.03 0.17 1.49 -1.64 0.00 0.00 178.16 179.30 2dbf h GLU 64 N 0.54 0.64 -0.37 1.82 4.81 -1.17 0.29 114.58 121.14 2dbf h GLU 64 Ca 0.02 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.10 2dbf h GLU 64 Cb 1.05 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 2dbf h GLU 64 CO 0.10 0.59 0.06 0.28 -0.73 0.00 0.00 179.01 179.31 2dbf h VAL 65 N 0.55 1.24 -0.12 0.32 2.07 -1.52 -2.74 116.25 116.05 2dbf h VAL 65 Ca 0.14 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2dbf h VAL 65 Cb 0.19 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2dbf h VAL 65 CO -0.01 0.28 0.01 0.28 0.02 0.00 0.00 177.57 178.15 2dbf h SER 66 N 0.45 0.15 0.00 0.57 0.02 -1.28 -3.46 113.55 109.99 2dbf h SER 66 Ca 0.11 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2dbf h SER 66 Cb 0.35 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.86 2dbf h SER 66 CO 0.01 0.17 0.00 0.61 -1.14 0.00 0.00 176.83 176.48 2dbf n GLY 67 N -1.32 2.21 1.92 -3.77 0.00 -0.60 -4.81 105.19 98.82 2dbf n GLY 67 Ca -0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.77 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 -4.25 3.38 -0.02 0.00 0.92 -4.11 105.19 101.12 2dbf n GLY 68 Ca 0.00 0.38 -0.33 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.33 3.06 -0.01 2.61 -4.23 -1.26 -2.36 115.64 113.11 2dbf s THR 69 Ca -0.09 -0.67 -0.23 0.00 -1.18 0.00 0.00 61.69 59.52 2dbf s THR 69 Cb 0.01 -2.27 -0.20 0.00 1.34 0.00 0.00 72.50 71.37 2dbf s THR 69 CO 0.25 0.53 1.15 0.58 -0.54 0.00 0.00 174.62 176.60 2dbf h VAL 70 N 5.27 1.46 -0.33 2.29 2.07 -1.96 -2.18 116.25 122.86 2dbf h VAL 70 Ca -0.28 -1.69 0.01 0.00 0.82 0.00 0.00 66.70 65.56 2dbf h VAL 70 Cb 1.21 2.42 -0.02 0.00 -1.52 0.00 0.00 31.29 33.38 2dbf h VAL 70 CO 0.55 0.47 0.22 0.03 0.02 0.00 0.00 177.57 178.87 2dbf h ARG 71 N -0.31 0.39 0.02 1.57 3.08 -1.97 0.21 114.38 117.38 2dbf h ARG 71 Ca -0.02 -0.02 -0.21 0.00 0.07 0.00 0.00 59.98 59.81 2dbf h ARG 71 Cb 0.89 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 2dbf h ARG 71 CO 0.05 0.26 -0.93 0.93 -1.07 0.00 0.00 179.97 179.20 2dbf h GLU 72 N 0.40 0.15 -0.15 0.04 5.08 -1.98 -2.81 114.58 115.31 2dbf h GLU 72 Ca 0.13 -0.19 -0.22 0.00 -1.00 0.00 0.00 59.36 58.09 2dbf h GLU 72 Cb 0.03 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.35 2dbf h GLU 72 CO -0.03 0.97 -0.75 1.25 -1.00 0.00 0.00 179.01 179.45 2dbf h LEU 73 N 0.07 0.92 -0.99 1.33 5.85 -0.62 -1.89 115.31 119.99 2dbf h LEU 73 Ca -0.05 -0.63 -0.09 0.00 0.84 0.00 0.00 57.88 57.95 2dbf h LEU 73 Cb 1.59 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 2dbf h LEU 73 CO 0.14 1.40 -0.26 0.58 -0.34 0.00 0.00 178.44 179.97 2dbf h VAL 74 N 0.50 1.26 -0.06 1.05 2.07 -1.06 -2.43 116.25 117.58 2dbf h VAL 74 Ca -0.05 -1.24 -0.12 0.00 0.82 0.00 0.00 66.70 66.10 2dbf h VAL 74 Cb 1.39 1.37 0.01 0.00 -1.52 0.00 0.00 31.29 32.54 2dbf h VAL 74 CO 0.16 0.39 -0.44 -0.33 0.02 0.00 0.00 177.57 177.37 2dbf h GLU 75 N 0.37 0.41 -0.16 1.57 5.08 -1.49 -3.05 114.58 117.32 2dbf h GLU 75 Ca 0.06 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.07 2dbf h GLU 75 Cb 0.65 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2dbf h GLU 75 CO 0.05 1.00 0.11 0.00 -1.00 0.00 0.00 179.01 179.17 2dbf h ALA 76 N 0.41 1.91 -0.04 3.43 0.00 -1.27 -0.92 119.26 122.79 2dbf h ALA 76 Ca -0.04 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 2dbf h ALA 76 Cb 1.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2dbf h ALA 76 CO 0.09 0.07 -0.58 -0.07 0.00 0.00 0.00 179.25 178.76 2dbf h LEU 77 N 0.20 0.15 -0.11 0.00 3.38 -1.43 -3.01 115.31 114.49 2dbf h LEU 77 Ca 0.06 -0.08 -0.24 0.00 0.09 0.00 0.00 57.88 57.71 2dbf h LEU 77 Cb 0.01 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2dbf h LEU 77 CO -0.01 0.70 -1.01 -0.09 0.09 0.00 0.00 178.44 178.11 2dbf h ARG 78 N 0.10 0.39 -0.15 1.13 2.43 -1.10 0.42 114.38 117.60 2dbf h ARG 78 Ca -0.00 -0.46 -0.03 0.00 -0.81 0.00 0.00 59.98 58.67 2dbf h ARG 78 Cb 1.06 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.74 2dbf h ARG 78 CO 0.08 1.14 -0.07 1.96 -1.51 0.00 0.00 179.97 181.58 2dbf h GLN 79 N 0.20 0.22 0.10 0.20 4.20 -1.22 -2.72 115.11 116.08 2dbf h GLN 79 Ca -0.09 -0.04 -0.30 0.00 0.06 0.00 0.00 58.65 58.27 2dbf h GLN 79 Cb 1.67 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.40 2dbf h GLN 79 CO 0.17 0.30 -1.55 0.52 -0.67 0.00 0.00 178.83 177.61 2dbf h MET 80 N 0.21 0.20 0.00 1.46 2.86 -1.53 -3.48 114.93 114.66 2dbf h MET 80 Ca 0.05 -0.35 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 2dbf h MET 80 Cb 0.26 0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.05 2dbf h MET 80 CO 0.01 1.04 0.00 0.41 1.06 0.00 0.00 176.91 179.43 2dbf n GLY 81 N 1.65 1.93 3.76 8.32 0.00 -0.79 -4.79 105.19 115.28 2dbf n GLY 81 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 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 3.92 0.00 1.61 2.02 0.14 -4.96 117.35 118.08 2dbf s TYR 82 Ca 0.00 1.74 -0.01 0.00 -0.37 0.00 0.00 57.07 58.44 2dbf s TYR 82 Cb 0.00 -2.87 -0.00 0.00 -0.40 0.00 0.00 41.96 38.69 2dbf s TYR 82 CO 0.00 0.46 -0.01 2.41 -1.57 0.00 0.00 175.55 176.84 2dbf n THR 83 N 1.70 0.23 -0.10 -0.71 -1.04 -1.26 -4.56 114.28 108.55 2dbf n THR 83 Ca -0.04 0.05 -0.06 0.00 -2.04 0.00 0.00 64.05 61.96 2dbf n THR 83 Cb 0.48 -1.53 0.12 0.00 -1.82 0.00 0.00 70.33 67.58 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 -0.04 0.79 -0.42 -2.82 4.81 -1.99 -2.30 114.58 112.61 2dbf h GLU 84 Ca -0.02 -0.27 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 2dbf h GLU 84 Cb 0.88 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.18 2dbf h GLU 84 CO -0.01 0.87 0.23 0.00 -0.73 0.00 0.00 179.01 179.37 2dbf h ALA 85 N 1.15 0.54 -0.01 2.92 0.00 -1.97 -2.21 119.26 119.69 2dbf h ALA 85 Ca 0.12 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2dbf h ALA 85 Cb 0.60 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2dbf h ALA 85 CO 0.04 0.07 -0.37 0.82 0.00 0.00 0.00 179.25 179.81 2dbf h ILE 86 N 0.55 1.27 -0.06 0.00 2.04 -1.77 -2.61 117.51 116.92 2dbf h ILE 86 Ca 0.15 -1.28 -0.10 0.00 1.00 0.00 0.00 64.86 64.63 2dbf h ILE 86 Cb 0.06 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 2dbf h ILE 86 CO -0.02 0.37 -0.42 -0.33 0.00 0.00 0.00 178.15 177.74 2dbf h GLU 87 N 0.02 0.12 -0.37 2.37 5.08 -0.94 -0.79 114.58 120.08 2dbf h GLU 87 Ca -0.00 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 2dbf h GLU 87 Cb 0.66 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2dbf h GLU 87 CO 0.05 0.53 -0.35 0.28 -1.00 0.00 0.00 179.01 178.52 2dbf h VAL 88 N 0.10 1.28 0.04 3.13 2.07 -1.02 0.29 116.25 122.14 2dbf h VAL 88 Ca 0.01 -1.52 -0.22 0.00 0.82 0.00 0.00 66.70 65.79 2dbf h VAL 88 Cb 0.79 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 2dbf h VAL 88 CO 0.06 0.50 -1.03 0.40 0.02 0.00 0.00 177.57 177.53 2dbf h ILE 89 N 0.70 1.61 0.17 4.57 2.04 -1.44 -3.22 117.51 121.94 2dbf h ILE 89 Ca 0.07 -3.14 -0.30 0.00 1.00 0.00 0.00 64.86 62.49 2dbf h ILE 89 Cb 0.91 2.78 0.02 0.00 -0.74 0.00 0.00 36.82 39.79 2dbf h ILE 89 CO 0.08 0.90 -1.31 1.56 0.00 0.00 0.00 178.15 179.39 2dbf h GLN 90 N 0.04 0.43 -0.15 2.37 4.20 -1.09 -1.78 115.11 119.12 2dbf h GLN 90 Ca -0.05 -0.69 0.01 0.00 0.06 0.00 0.00 58.65 57.98 2dbf h GLN 90 Cb 1.75 0.25 -0.01 0.00 0.30 0.00 0.00 27.48 29.77 2dbf h GLN 90 CO 0.15 1.32 0.10 0.00 -0.67 0.00 0.00 178.83 179.72 2dbf h ALA 91 N 0.40 1.92 0.00 3.87 0.00 -0.50 -3.19 119.26 121.76 2dbf h ALA 91 Ca -0.18 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 2dbf h ALA 91 Cb 2.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 2dbf h ALA 91 CO 0.23 0.07 -0.78 0.00 0.00 0.00 0.00 179.25 178.77 2dbf h ALA 92 N 1.91 0.11 -2.36 0.00 0.00 -1.60 -3.46 119.26 113.87 2dbf h ALA 92 Ca 0.06 -0.78 -0.55 0.00 0.00 0.00 0.00 54.91 53.64 2dbf h ALA 92 Cb 0.01 0.56 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2dbf h ALA 92 CO -0.01 0.55 0.44 0.45 0.00 0.00 0.00 179.25 180.68 2dbf s SER 93 N -6.22 7.32 0.27 0.00 0.15 -0.67 -5.03 113.70 109.52 2dbf s SER 93 Ca -0.20 1.62 0.02 0.00 0.70 0.00 0.00 55.95 58.09 2dbf s SER 93 Cb 0.03 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.75 2dbf s SER 93 CO 0.38 -0.33 0.23 -0.94 1.20 0.00 0.00 173.24 173.78 2dbf s SER 94 N 1.04 0.90 -0.26 5.45 1.04 -1.26 -4.56 113.70 116.05 2dbf s SER 94 Ca 0.51 -1.55 -0.02 0.00 0.48 0.00 0.00 55.95 55.36 2dbf s SER 94 Cb -0.20 0.49 0.15 0.00 0.10 0.00 0.00 66.02 66.55 2dbf s SER 94 CO 0.24 -0.98 0.44 -0.55 0.98 0.00 0.00 173.24 173.37 2dbf s SER 95 N -3.26 -0.22 0.00 7.02 0.15 -1.26 -5.06 113.70 111.07 2dbf s SER 95 Ca 0.39 0.42 0.00 0.00 0.70 0.00 0.00 55.95 57.46 2dbf s SER 95 Cb 0.04 1.41 0.00 0.00 -1.71 0.00 0.00 66.02 65.77 2dbf s SER 95 CO 0.20 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 174.96 2dbf n GLY 96 N 5.38 -1.75 3.67 9.45 0.00 -1.26 -5.13 105.19 115.56 2dbf n GLY 96 Ca -0.03 0.73 -0.51 0.00 0.00 0.00 0.00 46.02 46.21 2dbf n GLY 96 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dbf n PRO 97 N 0.00 1.74 -0.04 1.61 -0.02 -1.26 -4.91 135.00 132.12 2dbf n PRO 97 Ca 0.00 0.63 -0.04 0.00 -2.02 0.00 0.00 63.50 62.07 2dbf n PRO 97 Cb 0.00 -2.38 -0.01 0.00 -0.02 0.00 0.00 33.50 31.08 2dbf n PRO 97 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2dbf n SER 98 N 4.77 0.87 -4.82 2.55 7.64 -1.26 -5.01 113.62 118.37 2dbf n SER 98 Ca 0.21 0.15 -0.33 0.00 1.01 0.00 0.00 58.87 59.91 2dbf n SER 98 Cb 0.23 -0.58 -0.02 0.00 -1.01 0.00 0.00 64.21 62.84 2dbf n SER 98 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dbf s SER 99 N -4.93 6.24 0.00 6.43 1.04 -1.26 -5.36 113.70 115.86 2dbf s SER 99 Ca -0.13 1.74 0.00 0.00 0.48 0.00 0.00 55.95 58.05 2dbf s SER 99 Cb 0.02 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.61 2dbf s SER 99 CO 0.19 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.17