#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oxf n ASP 2005N 0.00 0.55 -4.25 -3.46 8.00 -0.38 -4.91 116.55 112.10 2oxf n ASP 2005Ca 0.00 0.10 -0.16 0.00 0.71 0.00 0.00 54.79 55.45 2oxf n ASP 2005Cb 0.00 -0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 40.99 2oxf n ASP 2005CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2oxf s VAL 2006N -3.08 1.24 0.28 2.53 -7.23 -1.24 -5.06 120.40 107.83 2oxf s VAL 2006Ca 0.09 -1.93 0.04 0.00 -1.81 0.00 0.00 61.98 58.37 2oxf s VAL 2006Cb 0.15 -1.72 0.04 0.00 0.56 0.00 0.00 36.38 35.41 2oxf s VAL 2006CO 0.67 -0.62 1.68 -0.26 -0.31 0.00 0.00 175.10 176.27 2oxf h PHE 2007N 3.05 0.43 0.00 2.82 0.04 -1.95 -3.41 116.94 117.93 2oxf h PHE 2007Ca -0.38 -0.11 -0.03 0.00 2.80 0.00 0.00 57.97 60.25 2oxf h PHE 2007Cb 1.20 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 39.24 2oxf h PHE 2007CO 0.65 0.69 -1.12 0.72 -0.60 0.00 0.00 178.31 178.66 2oxf n HIS 2008N -4.05 0.00 0.33 -0.55 8.25 -1.26 -4.83 115.22 113.11 2oxf n HIS 2008Ca -0.01 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.58 2oxf n HIS 2008Cb 0.47 -0.08 0.34 0.00 1.12 0.00 0.00 29.99 31.84 2oxf n HIS 2008CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2oxf h LEU 2009N 0.00 0.00 0.48 2.41 3.38 -1.92 -3.45 115.31 116.21 2oxf h LEU 2009Ca -0.05 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 2oxf h LEU 2009Cb 1.08 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.84 2oxf h LEU 2009CO -0.01 0.00 -0.25 0.61 0.09 0.00 0.00 178.44 178.88 2oxf n GLY 2010N 0.86 0.11 3.35 0.83 0.00 -1.26 -4.70 105.19 104.38 2oxf n GLY 2010Ca 0.04 -0.43 -0.21 0.00 0.00 0.00 0.00 46.02 45.42 2oxf n GLY 2010CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oxf s LEU 2011N -2.97 2.49 0.36 0.99 1.43 -1.26 -4.86 118.68 114.85 2oxf s LEU 2011Ca 0.09 -0.92 0.08 0.00 -1.03 0.00 0.00 54.13 52.35 2oxf s LEU 2011Cb -0.04 -0.82 -0.06 0.00 0.03 0.00 0.00 46.19 45.31 2oxf s LEU 2011CO 0.11 -0.06 0.04 0.42 0.23 0.00 0.00 176.35 177.09 2oxf s THR 2012N -2.35 2.49 0.24 5.49 -4.23 -1.26 -1.25 115.64 114.76 2oxf s THR 2012Ca 0.19 -1.93 -0.07 0.00 -1.18 0.00 0.00 61.69 58.70 2oxf s THR 2012Cb -0.04 -2.85 0.23 0.00 1.34 0.00 0.00 72.50 71.17 2oxf s THR 2012CO 0.08 -0.14 1.90 0.11 -0.54 0.00 0.00 174.62 176.03 2oxf h LYS 2013N 1.74 1.17 -0.66 3.99 6.56 -1.96 -2.21 116.57 125.20 2oxf h LYS 2013Ca -0.43 -0.07 0.06 0.00 -1.06 0.00 0.00 60.65 59.15 2oxf h LYS 2013Cb 1.25 -0.26 -0.04 0.00 -0.57 0.00 0.00 32.23 32.61 2oxf h LYS 2013CO 0.69 0.78 0.43 -0.97 -2.06 0.00 0.00 179.45 178.32 2oxf h ASN 2014N 1.21 0.59 -0.50 0.86 -1.24 -1.95 -1.21 115.58 113.33 2oxf h ASN 2014Ca 0.35 0.00 0.11 0.00 0.71 0.00 0.00 56.30 57.47 2oxf h ASN 2014Cb -0.08 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 38.82 2oxf h ASN 2014CO -0.09 0.38 0.35 0.44 -1.29 0.00 0.00 177.43 177.22 2oxf h ASP 2015N 0.67 0.16 1.66 1.15 3.45 -1.80 -1.95 116.42 119.75 2oxf h ASP 2015Ca 0.28 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.74 2oxf h ASP 2015Cb 0.25 -0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 38.99 2oxf h ASP 2015CO -0.09 0.09 -0.01 -0.07 -1.57 0.00 0.00 179.24 177.60 2oxf h LEU 2016N 0.17 0.00 -1.32 1.55 3.38 -1.29 -3.48 115.31 114.34 2oxf h LEU 2016Ca 0.24 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.65 2oxf h LEU 2016Cb 0.70 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.25 2oxf h LEU 2016CO -0.04 0.01 -0.86 0.00 0.09 0.00 0.00 178.44 177.64 2oxf n GLN 2017N -3.10 -2.80 -0.52 1.13 6.02 -0.74 -1.27 117.38 116.10 2oxf n GLN 2017Ca 0.03 0.34 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 2oxf n GLN 2017Cb 0.46 -4.86 0.00 0.00 1.02 0.00 0.00 30.24 26.85 2oxf n GLN 2017CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oxf n GLY 2018N -1.54 0.75 3.74 1.08 0.00 -1.26 -4.61 105.19 103.35 2oxf n GLY 2018Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2oxf n GLY 2018CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oxf n ALA 2019N -0.44 1.94 -0.23 4.61 0.00 -0.40 -4.84 120.51 121.14 2oxf n ALA 2019Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2oxf n ALA 2019Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.10 2oxf n ALA 2019CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2oxf n GLN 2020N 0.48 -0.47 -4.54 0.00 6.02 -1.26 -4.26 117.38 113.35 2oxf n GLN 2020Ca 0.03 -0.36 -0.22 0.00 -0.01 0.00 0.00 57.00 56.44 2oxf n GLN 2020Cb 0.38 -0.85 -0.15 0.00 1.02 0.00 0.00 30.24 30.63 2oxf n GLN 2020CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2oxf s LEU 2021N -0.07 1.89 0.01 1.08 0.20 -1.26 -0.81 118.68 119.72 2oxf s LEU 2021Ca 0.00 -0.23 0.06 0.00 0.69 0.00 0.00 54.13 54.64 2oxf s LEU 2021Cb 0.00 -0.67 -0.02 0.00 -0.43 0.00 0.00 46.19 45.07 2oxf s LEU 2021CO 0.00 0.11 -0.18 0.00 -0.29 0.00 0.00 176.35 176.00 2oxf s ALA 2022N -0.01 1.49 -0.22 5.97 0.00 -0.23 -1.52 121.76 127.24 2oxf s ALA 2022Ca -0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 51.96 51.00 2oxf s ALA 2022Cb -0.08 -0.32 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 2oxf s ALA 2022CO 0.00 0.34 0.13 0.42 0.00 0.00 0.00 175.76 176.65 2oxf s ILE 2023N -0.61 5.21 -0.59 0.00 1.01 0.37 -1.35 121.20 125.24 2oxf s ILE 2023Ca 0.06 0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.88 2oxf s ILE 2023Cb -0.08 -3.40 0.16 0.00 0.01 0.00 0.00 42.46 39.15 2oxf s ILE 2023CO 0.00 0.39 0.40 0.68 0.00 0.00 0.00 174.94 176.41 2oxf s VAL 2024N 0.79 2.22 0.94 2.92 -7.23 0.49 -1.31 120.40 119.22 2oxf s VAL 2024Ca 0.07 -3.63 -0.14 0.00 -1.81 0.00 0.00 61.98 56.47 2oxf s VAL 2024Cb -0.13 -2.49 0.21 0.00 0.56 0.00 0.00 36.38 34.54 2oxf s VAL 2024CO 0.02 -1.00 1.28 -0.81 -0.31 0.00 0.00 175.10 174.28 2oxf n PRO 2025N 2.50 -1.11 0.09 4.82 -0.04 -1.24 -4.28 135.00 135.74 2oxf n PRO 2025Ca 0.18 -2.17 -0.18 0.00 -0.04 0.00 0.00 63.50 61.28 2oxf n PRO 2025Cb 0.37 -1.25 -0.14 0.00 -0.04 0.00 0.00 33.50 32.43 2oxf n PRO 2025CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2oxf h GLY 2026N -1.56 0.36 -3.17 0.55 0.00 -1.86 -1.20 103.07 96.19 2oxf h GLY 2026Ca -0.41 -0.92 -0.53 0.00 0.00 0.00 0.00 47.33 45.47 2oxf h GLY 2026CO 0.31 0.81 -0.78 0.51 0.00 0.00 0.00 176.54 177.39 2oxf s ASP 2027N -7.15 2.75 0.45 0.19 1.47 -1.26 -1.37 116.67 111.74 2oxf s ASP 2027Ca -0.08 -0.88 0.14 0.00 1.18 0.00 0.00 52.55 52.90 2oxf s ASP 2027Cb 0.06 -0.17 1.01 0.00 -0.34 0.00 0.00 42.92 43.49 2oxf s ASP 2027CO 0.88 -0.04 2.01 -0.65 0.68 0.00 0.00 175.17 178.05 2oxf h PRO 2028N 3.15 0.06 -0.84 2.11 0.11 -1.91 -2.45 132.00 132.22 2oxf h PRO 2028Ca -0.42 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 2oxf h PRO 2028Cb 1.21 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2oxf h PRO 2028CO 0.52 0.18 0.52 0.93 -0.21 0.00 0.00 178.00 179.95 2oxf h GLU 2029N 0.06 1.14 -0.06 1.05 3.07 -2.00 -2.11 114.58 115.73 2oxf h GLU 2029Ca 0.01 -0.09 -0.16 0.00 -0.50 0.00 0.00 59.36 58.62 2oxf h GLU 2029Cb 0.25 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 2oxf h GLU 2029CO 0.02 0.79 -0.65 -0.09 -1.40 0.00 0.00 179.01 177.67 2oxf h ARG 2030N 1.15 0.24 -0.21 2.33 2.43 -1.88 -2.91 114.38 115.53 2oxf h ARG 2030Ca 0.30 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 2oxf h ARG 2030Cb -0.07 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.48 2oxf h ARG 2030CO -0.06 0.81 -0.05 0.28 -1.51 0.00 0.00 179.97 179.44 2oxf h VAL 2031N 0.17 0.79 -0.87 0.20 2.07 -1.00 -1.24 116.25 116.39 2oxf h VAL 2031Ca -0.01 -0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 2oxf h VAL 2031Cb 1.18 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 2oxf h VAL 2031CO 0.10 0.00 0.43 -0.08 0.02 0.00 0.00 177.57 178.04 2oxf h GLU 2032N 0.00 1.24 -0.77 1.57 4.81 -1.32 -0.40 114.58 119.70 2oxf h GLU 2032Ca 0.10 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 2oxf h GLU 2032Cb 0.15 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 2oxf h GLU 2032CO -0.22 0.94 0.28 0.87 -0.73 0.00 0.00 179.01 180.15 2oxf h LYS 2033N 1.23 1.18 -0.18 1.92 1.57 -1.27 -0.75 116.57 120.26 2oxf h LYS 2033Ca 0.30 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 2oxf h LYS 2033Cb 0.10 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 2oxf h LYS 2033CO -0.04 0.97 -0.10 0.82 -0.57 0.00 0.00 179.45 180.53 2oxf h ILE 2034N 1.14 1.31 -0.93 1.86 2.04 -0.90 -3.08 117.51 118.95 2oxf h ILE 2034Ca 0.25 -1.17 0.03 0.00 1.00 0.00 0.00 64.86 64.98 2oxf h ILE 2034Cb 0.26 1.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 2oxf h ILE 2034CO -0.02 0.35 0.61 0.00 0.00 0.00 0.00 178.15 179.10 2oxf h ALA 2035N 0.68 1.39 -0.00 1.87 0.00 -0.85 -1.74 119.26 120.61 2oxf h ALA 2035Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2oxf h ALA 2035Cb 0.59 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2oxf h ALA 2035CO 0.03 0.52 0.01 0.00 0.00 0.00 0.00 179.25 179.82 2oxf h ALA 2036N 1.45 1.16 0.00 0.00 0.00 -1.04 -0.87 119.26 119.96 2oxf h ALA 2036Ca 0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2oxf h ALA 2036Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2oxf h ALA 2036CO -0.10 -0.01 -0.04 1.28 0.00 0.00 0.00 179.25 180.37 2oxf n LEU 2037N -3.29 0.30 -4.92 0.00 4.77 -0.65 -4.89 117.00 108.31 2oxf n LEU 2037Ca -0.03 0.50 -0.25 0.00 -0.03 0.00 0.00 56.01 56.20 2oxf n LEU 2037Cb 0.09 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 2oxf n LEU 2037CO 0.22 -0.05 0.10 -0.04 -1.33 0.00 0.00 177.39 176.29 2oxf s MET 2038N -3.04 2.29 0.32 3.23 -1.94 -0.33 -5.11 119.30 114.71 2oxf s MET 2038Ca 0.13 -1.91 -0.14 0.00 -1.71 0.00 0.00 55.69 52.06 2oxf s MET 2038Cb 0.17 -2.22 -0.09 0.00 2.01 0.00 0.00 34.83 34.70 2oxf s MET 2038CO 0.56 -0.63 0.72 -0.51 -0.01 0.00 0.00 175.02 175.15 2oxf s ASP 2039N -4.34 6.74 -1.40 3.03 -0.00 -0.35 -4.44 116.67 115.91 2oxf s ASP 2039Ca 0.40 1.23 -0.07 0.00 -0.00 0.00 0.00 52.55 54.11 2oxf s ASP 2039Cb -0.03 -2.35 0.01 0.00 -0.00 0.00 0.00 42.92 40.55 2oxf s ASP 2039CO 0.25 -0.20 0.36 0.29 -0.00 0.00 0.00 175.17 175.87 2oxf n LYS 2040N -0.40 -1.86 -2.27 8.23 5.02 -1.26 0.01 118.16 125.62 2oxf n LYS 2040Ca 0.03 0.26 -0.41 0.00 -2.02 0.00 0.00 58.31 56.17 2oxf n LYS 2040Cb 0.53 -3.89 -0.03 0.00 -0.02 0.00 0.00 35.03 31.62 2oxf n LYS 2040CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2oxf s PRO 2041N -6.89 4.43 -0.03 1.97 0.04 -1.26 -4.37 135.00 128.89 2oxf s PRO 2041Ca 0.12 2.00 -0.01 0.00 0.04 0.00 0.00 61.00 63.16 2oxf s PRO 2041Cb -0.06 -3.19 0.03 0.00 0.04 0.00 0.00 34.50 31.32 2oxf s PRO 2041CO 0.93 -0.16 0.06 0.08 0.04 0.00 0.00 177.00 177.95 2oxf s VAL 2042N -0.19 -0.09 0.08 -0.36 1.01 0.51 -4.99 120.40 116.37 2oxf s VAL 2042Ca 0.54 0.29 -0.30 0.00 0.00 0.00 0.00 61.98 62.51 2oxf s VAL 2042Cb -0.35 -0.13 -0.06 0.00 0.00 0.00 0.00 36.38 35.84 2oxf s VAL 2042CO 0.40 0.12 1.17 -0.75 0.00 0.00 0.00 175.10 176.04 2oxf s LYS 2043N 1.52 4.47 -0.24 2.72 2.20 -1.26 -0.28 119.74 128.87 2oxf s LYS 2043Ca -0.04 1.74 -0.05 0.00 -0.36 0.00 0.00 55.97 57.26 2oxf s LYS 2043Cb -0.12 -3.34 -0.13 0.00 -1.51 0.00 0.00 37.83 32.72 2oxf s LYS 2043CO -0.03 -0.18 -0.26 1.28 -0.36 0.00 0.00 175.35 175.79 2oxf n LEU 2044N 3.63 2.40 -3.51 5.43 4.77 0.45 -4.91 117.00 125.27 2oxf n LEU 2044Ca 0.08 0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 56.04 2oxf n LEU 2044Cb 0.47 -0.77 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 2oxf n LEU 2044CO 0.55 0.71 0.68 0.00 -1.33 0.00 0.00 177.39 178.01 2oxf s ALA 2045N -2.46 -1.83 -0.23 -1.18 0.00 -1.10 -5.00 121.76 109.96 2oxf s ALA 2045Ca -0.33 1.06 -0.03 0.00 0.00 0.00 0.00 51.96 52.66 2oxf s ALA 2045Cb 0.10 0.33 0.12 0.00 0.00 0.00 0.00 23.12 23.68 2oxf s ALA 2045CO 0.49 -0.65 0.35 0.45 0.00 0.00 0.00 175.76 176.39 2oxf s SER 2046N -2.35 0.47 -0.04 0.00 0.15 -1.26 -1.13 113.70 109.54 2oxf s SER 2046Ca 0.04 0.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.82 2oxf s SER 2046Cb -0.01 0.97 0.03 0.00 -1.71 0.00 0.00 66.02 65.30 2oxf s SER 2046CO -0.08 -0.30 0.04 -1.00 1.20 0.00 0.00 173.24 173.10 2oxf s HIS 2047N 2.50 0.15 0.00 3.44 3.76 -0.75 -4.98 115.29 119.41 2oxf s HIS 2047Ca 0.11 0.17 0.00 0.00 -0.15 0.00 0.00 55.06 55.20 2oxf s HIS 2047Cb -0.15 -0.48 0.00 0.00 1.11 0.00 0.00 32.58 33.05 2oxf s HIS 2047CO -0.15 -0.19 0.00 0.54 -0.85 0.00 0.00 174.74 174.09 2oxf n ARG 2048N 5.06 0.00 0.00 1.40 1.74 -1.26 -0.91 116.66 122.69 2oxf n ARG 2048Ca -0.08 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.06 2oxf n ARG 2048Cb 0.50 0.00 0.32 0.00 -1.02 0.00 0.00 32.46 32.26 2oxf n ARG 2048CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2oxf n GLU 2049N 14.00 0.07 -3.60 5.56 4.71 -1.26 -4.65 120.64 135.47 2oxf n GLU 2049Ca 0.00 0.22 -0.40 0.00 -0.01 0.00 0.00 57.16 56.97 2oxf n GLU 2049Cb 0.00 -1.50 -0.09 0.00 -1.01 0.00 0.00 31.44 28.84 2oxf n GLU 2049CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 2oxf s PHE 2050N -2.85 3.48 -0.23 -0.32 0.40 -0.09 -3.95 117.98 114.44 2oxf s PHE 2050Ca 0.09 -2.13 -0.07 0.00 -0.60 0.00 0.00 56.93 54.22 2oxf s PHE 2050Cb 0.09 -3.43 -0.03 0.00 0.51 0.00 0.00 43.02 40.16 2oxf s PHE 2050CO 0.24 -0.96 0.05 0.99 0.70 0.00 0.00 175.22 176.24 2oxf s THR 2051N 0.95 4.33 0.04 0.64 2.01 -1.26 -1.81 115.64 120.53 2oxf s THR 2051Ca 0.09 -0.18 0.09 0.00 0.31 0.00 0.00 61.69 62.00 2oxf s THR 2051Cb -0.23 -2.99 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 2oxf s THR 2051CO -0.03 0.38 -0.25 -0.94 -0.69 0.00 0.00 174.62 173.10 2oxf s SER 2052N 1.25 2.95 0.17 3.53 1.04 -0.28 -1.84 113.70 120.53 2oxf s SER 2052Ca 0.04 -0.56 0.07 0.00 0.48 0.00 0.00 55.95 55.99 2oxf s SER 2052Cb -0.15 -0.27 -0.04 0.00 0.10 0.00 0.00 66.02 65.66 2oxf s SER 2052CO 0.03 0.24 -0.15 0.26 0.98 0.00 0.00 173.24 174.60 2oxf s TRP 2053N -0.78 1.64 0.06 5.02 0.52 0.52 -0.41 118.94 125.53 2oxf s TRP 2053Ca 0.10 -0.56 0.05 0.00 0.02 0.00 0.00 56.10 55.72 2oxf s TRP 2053Cb -0.10 -0.80 -0.04 0.00 -1.15 0.00 0.00 33.47 31.39 2oxf s TRP 2053CO 0.02 0.29 -0.08 0.50 0.02 0.00 0.00 176.95 177.70 2oxf s ARG 2054N -3.25 2.33 0.17 4.98 3.52 0.61 -1.32 118.95 126.00 2oxf s ARG 2054Ca 0.18 -0.89 -0.03 0.00 -0.13 0.00 0.00 55.73 54.85 2oxf s ARG 2054Cb -0.03 -2.40 0.01 0.00 -1.56 0.00 0.00 34.95 30.98 2oxf s ARG 2054CO 0.06 0.55 0.28 0.00 -0.81 0.00 0.00 175.30 175.38 2oxf n ALA 2055N 1.03 -0.44 -2.77 6.12 0.00 -0.11 -0.36 120.51 123.97 2oxf n ALA 2055Ca -0.14 -0.68 -0.15 0.00 0.00 0.00 0.00 53.44 52.47 2oxf n ALA 2055Cb 0.52 0.54 -0.14 0.00 0.00 0.00 0.00 19.45 20.37 2oxf n ALA 2055CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2oxf s GLU 2056N -2.23 0.39 -0.10 0.00 2.02 0.10 -0.59 118.70 118.29 2oxf s GLU 2056Ca 0.11 -0.20 0.02 0.00 0.02 0.00 0.00 54.97 54.91 2oxf s GLU 2056Cb -0.01 -0.36 0.02 0.00 0.10 0.00 0.00 34.13 33.87 2oxf s GLU 2056CO 0.08 0.10 -0.14 -0.51 0.02 0.00 0.00 175.26 174.81 2oxf s LEU 2057N -0.19 1.63 -1.57 1.80 1.43 0.07 -1.22 118.68 120.64 2oxf s LEU 2057Ca 0.01 -0.39 -0.15 0.00 -1.03 0.00 0.00 54.13 52.58 2oxf s LEU 2057Cb -0.02 -1.00 0.10 0.00 0.03 0.00 0.00 46.19 45.29 2oxf s LEU 2057CO -0.00 -0.00 0.94 0.47 0.23 0.00 0.00 176.35 177.99 2oxf n ASP 2058N 4.23 -4.42 0.00 2.29 8.00 -1.26 -1.01 116.55 124.38 2oxf n ASP 2058Ca -0.19 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.48 2oxf n ASP 2058Cb 0.51 -3.65 0.00 0.00 -0.02 0.00 0.00 41.12 37.97 2oxf n ASP 2058CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oxf n GLY 2059N -1.63 0.77 3.51 0.44 0.00 -1.26 -5.02 105.19 102.00 2oxf n GLY 2059Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2oxf n GLY 2059CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oxf s LYS 2060N -0.15 2.81 0.41 1.61 1.02 -0.18 -5.07 119.74 120.19 2oxf s LYS 2060Ca 0.00 -0.62 -0.26 0.00 0.02 0.00 0.00 55.97 55.11 2oxf s LYS 2060Cb 0.00 -2.54 -0.08 0.00 -0.52 0.00 0.00 37.83 34.69 2oxf s LYS 2060CO 0.00 0.55 1.25 0.00 -0.92 0.00 0.00 175.35 176.24 2oxf s ALA 2061N -0.53 3.20 0.01 5.17 0.00 -1.26 -0.75 121.76 127.60 2oxf s ALA 2061Ca 0.08 1.14 0.01 0.00 0.00 0.00 0.00 51.96 53.18 2oxf s ALA 2061Cb -0.12 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 2oxf s ALA 2061CO 0.02 -0.73 -0.03 0.08 0.00 0.00 0.00 175.76 175.09 2oxf s VAL 2062N -1.32 0.22 0.00 0.00 1.01 0.24 -4.13 120.40 116.42 2oxf s VAL 2062Ca 0.57 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 62.09 2oxf s VAL 2062Cb -0.35 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 2oxf s VAL 2062CO 0.45 -0.17 0.05 -0.63 0.00 0.00 0.00 175.10 174.80 2oxf s ILE 2063N -0.64 4.48 -0.11 2.22 -1.09 -0.58 -0.93 121.20 124.55 2oxf s ILE 2063Ca -0.05 -0.51 0.03 0.00 -2.23 0.00 0.00 60.65 57.88 2oxf s ILE 2063Cb -0.05 -3.03 0.01 0.00 -1.58 0.00 0.00 42.46 37.81 2oxf s ILE 2063CO -0.00 0.35 -0.19 -0.69 -1.23 0.00 0.00 174.94 173.17 2oxf s VAL 2064N -1.16 1.75 -0.10 2.92 1.01 -0.43 -0.47 120.40 123.91 2oxf s VAL 2064Ca 0.22 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.33 2oxf s VAL 2064Cb -0.12 -1.56 0.04 0.00 0.00 0.00 0.00 36.38 34.75 2oxf s VAL 2064CO 0.13 0.49 0.24 0.00 0.00 0.00 0.00 175.10 175.96 2oxf s SER 2066N 1.19 6.07 -0.02 0.00 1.04 -0.76 -3.69 113.70 117.52 2oxf s SER 2066Ca -0.09 1.98 0.17 0.00 0.48 0.00 0.00 55.95 58.50 2oxf s SER 2066Cb -0.10 -2.56 -0.26 0.00 0.10 0.00 0.00 66.02 63.20 2oxf s SER 2066CO -0.08 -0.97 0.43 0.35 0.98 0.00 0.00 173.24 173.95 2oxf n THR 2067N -1.24 0.00 -4.21 2.02 -2.24 -0.45 -4.40 114.28 103.76 2oxf n THR 2067Ca 0.10 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2oxf n THR 2067Cb 0.52 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 2oxf n THR 2067CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oxf n GLY 2068N 1.50 -1.80 3.66 3.38 0.00 -0.47 -3.08 105.19 108.37 2oxf n GLY 2068Ca -0.02 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.29 2oxf n GLY 2068CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oxf s ILE 2069N 0.00 5.26 0.00 -0.61 -1.09 -1.26 -4.71 121.20 118.79 2oxf s ILE 2069Ca 0.00 0.49 0.00 0.00 -2.23 0.00 0.00 60.65 58.91 2oxf s ILE 2069Cb 0.00 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.24 2oxf s ILE 2069CO 0.00 0.28 0.00 0.61 -1.23 0.00 0.00 174.94 174.60 2oxf n GLY 2070N 4.14 0.90 0.32 6.18 0.00 -1.26 -4.37 105.19 111.11 2oxf n GLY 2070Ca -0.11 -1.84 0.03 0.00 0.00 0.00 0.00 46.02 44.11 2oxf n GLY 2070CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2oxf h GLY 2071N 0.00 1.37 0.99 -0.02 0.00 -1.86 -2.40 103.07 101.16 2oxf h GLY 2071Ca 0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2oxf h GLY 2071CO 0.00 0.17 -0.05 -2.55 0.00 0.00 0.00 176.54 174.10 2oxf h PRO 2072N 0.88 -0.15 -0.37 4.80 0.11 -1.94 0.29 132.00 135.62 2oxf h PRO 2072Ca 0.42 0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.40 2oxf h PRO 2072Cb 0.35 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 2oxf h PRO 2072CO -0.24 -0.09 -0.30 0.66 -0.21 0.00 0.00 178.00 177.82 2oxf h SER 2073N -0.16 0.85 -0.85 -2.05 4.64 -1.75 -2.56 113.55 111.67 2oxf h SER 2073Ca -0.02 -0.35 0.10 0.00 -0.47 0.00 0.00 61.79 61.06 2oxf h SER 2073Cb 0.12 -0.24 -0.08 0.00 -0.31 0.00 0.00 62.40 61.90 2oxf h SER 2073CO 0.03 1.09 0.49 0.74 -0.87 0.00 0.00 176.83 178.30 2oxf h THR 2074N 0.69 0.90 -0.14 2.95 2.02 -1.20 -2.16 112.91 115.97 2oxf h THR 2074Ca 0.08 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.93 2oxf h THR 2074Cb 0.85 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2oxf h THR 2074CO 0.07 0.15 -0.14 0.77 0.37 0.00 0.00 175.52 176.74 2oxf h SER 2075N 0.80 0.21 -0.00 4.18 4.64 -0.01 -1.58 113.55 121.79 2oxf h SER 2075Ca 0.41 -0.04 -0.00 0.00 -0.47 0.00 0.00 61.79 61.69 2oxf h SER 2075Cb 0.39 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2oxf h SER 2075CO -0.26 0.38 -0.00 0.40 -0.87 0.00 0.00 176.83 176.48 2oxf h ILE 2076N 0.21 1.38 -0.59 0.95 2.04 -1.25 -2.54 117.51 117.71 2oxf h ILE 2076Ca 0.04 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 64.82 2oxf h ILE 2076Cb 0.39 2.14 -0.05 0.00 -0.74 0.00 0.00 36.82 38.56 2oxf h ILE 2076CO 0.02 0.29 0.31 0.00 0.00 0.00 0.00 178.15 178.78 2oxf h ALA 2077N 0.52 0.77 -0.22 1.87 0.00 -1.12 -1.52 119.26 119.57 2oxf h ALA 2077Ca 0.00 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2oxf h ALA 2077Cb 0.48 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2oxf h ALA 2077CO 0.00 -0.02 -0.13 0.28 0.00 0.00 0.00 179.25 179.38 2oxf h VAL 2078N 0.59 1.31 -0.23 0.00 2.07 -1.35 -1.27 116.25 117.37 2oxf h VAL 2078Ca 0.26 -1.22 0.03 0.00 0.82 0.00 0.00 66.70 66.59 2oxf h VAL 2078Cb 0.16 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 2oxf h VAL 2078CO -0.17 0.37 0.07 -0.08 0.02 0.00 0.00 177.57 177.78 2oxf h GLU 2079N 0.17 0.17 -0.33 1.57 4.57 -1.32 -0.69 114.58 118.71 2oxf h GLU 2079Ca 0.05 -0.01 -0.13 0.00 -1.18 0.00 0.00 59.36 58.09 2oxf h GLU 2079Cb 0.64 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.18 2oxf h GLU 2079CO 0.04 0.11 -0.31 0.93 -1.18 0.00 0.00 179.01 178.60 2oxf h GLU 2080N 0.18 0.72 -0.60 1.92 5.08 -1.23 -0.20 114.58 120.45 2oxf h GLU 2080Ca 0.10 -0.33 -0.07 0.00 -1.00 0.00 0.00 59.36 58.06 2oxf h GLU 2080Cb 0.08 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 2oxf h GLU 2080CO -0.11 0.94 0.09 -0.07 -1.00 0.00 0.00 179.01 178.85 2oxf h LEU 2081N 0.61 0.92 -0.96 1.33 3.38 -1.14 -1.98 115.31 117.47 2oxf h LEU 2081Ca 0.07 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2oxf h LEU 2081Cb 0.83 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 2oxf h LEU 2081CO 0.07 0.93 0.59 0.00 0.09 0.00 0.00 178.44 180.12 2oxf h ALA 2082N 1.18 1.23 -0.27 1.53 0.00 -0.66 -1.50 119.26 120.77 2oxf h ALA 2082Ca 0.19 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2oxf h ALA 2082Cb 0.40 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2oxf h ALA 2082CO 0.01 0.67 0.16 1.96 0.00 0.00 0.00 179.25 182.05 2oxf h GLN 2083N 1.33 0.35 -0.00 0.00 4.20 -0.46 -1.68 115.11 118.85 2oxf h GLN 2083Ca 0.35 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.03 2oxf h GLN 2083Cb -0.08 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.63 2oxf h GLN 2083CO -0.07 0.25 -0.16 1.28 -0.67 0.00 0.00 178.83 179.47 2oxf n LEU 2084N -4.48 0.62 0.00 1.46 4.77 -0.71 -4.92 117.00 113.74 2oxf n LEU 2084Ca 0.01 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 2oxf n LEU 2084Cb 0.09 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2oxf n LEU 2084CO 0.35 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2oxf n GLY 2085N 1.31 1.10 3.73 -0.72 0.00 -0.63 -4.83 105.19 105.15 2oxf n GLY 2085Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2oxf n GLY 2085CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oxf s ILE 2086N -1.92 3.33 0.00 -0.61 -1.09 -0.65 -4.56 121.20 115.70 2oxf s ILE 2086Ca 0.00 1.06 0.00 0.00 -2.23 0.00 0.00 60.65 59.48 2oxf s ILE 2086Cb 0.00 -3.68 0.00 0.00 -1.58 0.00 0.00 42.46 37.20 2oxf s ILE 2086CO 0.00 0.14 0.07 0.54 -1.23 0.00 0.00 174.94 174.46 2oxf n ARG 2087N 2.96 4.67 -4.29 2.79 5.12 0.00 -4.17 116.66 123.75 2oxf n ARG 2087Ca 0.07 -0.07 -0.21 0.00 -1.93 0.00 0.00 57.85 55.71 2oxf n ARG 2087Cb 0.43 -0.51 -0.16 0.00 -1.16 0.00 0.00 32.46 31.06 2oxf n ARG 2087CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2oxf s THR 2088N -0.69 0.69 -0.08 0.55 2.01 -0.99 -1.23 115.64 115.91 2oxf s THR 2088Ca 0.00 -0.23 0.02 0.00 0.31 0.00 0.00 61.69 61.79 2oxf s THR 2088Cb 0.00 -0.68 0.01 0.00 0.01 0.00 0.00 72.50 71.85 2oxf s THR 2088CO 0.00 0.25 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.69 2oxf s PHE 2089N 0.73 1.64 -0.18 4.92 0.40 0.55 -1.07 117.98 124.98 2oxf s PHE 2089Ca -0.11 -0.66 0.01 0.00 -0.60 0.00 0.00 56.93 55.56 2oxf s PHE 2089Cb -0.14 -1.20 0.02 0.00 0.51 0.00 0.00 43.02 42.21 2oxf s PHE 2089CO 0.01 -0.34 -0.18 -0.51 0.70 0.00 0.00 175.22 174.89 2oxf s LEU 2090N 0.78 2.21 -0.07 -0.37 1.43 -0.46 -1.34 118.68 120.86 2oxf s LEU 2090Ca -0.12 -0.62 -0.10 0.00 -1.03 0.00 0.00 54.13 52.26 2oxf s LEU 2090Cb -0.16 -1.51 -0.05 0.00 0.03 0.00 0.00 46.19 44.51 2oxf s LEU 2090CO 0.02 0.00 0.25 -0.60 0.23 0.00 0.00 176.35 176.26 2oxf s ARG 2091N 1.29 3.65 -0.04 1.70 3.52 -0.42 -0.38 118.95 128.27 2oxf s ARG 2091Ca 0.05 0.10 0.05 0.00 -0.13 0.00 0.00 55.73 55.80 2oxf s ARG 2091Cb -0.13 -3.21 -0.01 0.00 -1.56 0.00 0.00 34.95 30.04 2oxf s ARG 2091CO -0.12 0.74 -0.20 -1.50 -0.81 0.00 0.00 175.30 173.41 2oxf s ILE 2092N -1.03 1.65 0.33 4.11 -1.16 -1.26 -1.45 121.20 122.39 2oxf s ILE 2092Ca 0.19 -0.86 0.07 0.00 -0.51 0.00 0.00 60.65 59.54 2oxf s ILE 2092Cb -0.14 -1.39 -0.03 0.00 0.61 0.00 0.00 42.46 41.51 2oxf s ILE 2092CO 0.08 0.47 0.27 0.61 -2.81 0.00 0.00 174.94 173.55 2oxf n GLY 2093N 2.90 2.95 3.19 1.50 0.00 -0.51 -4.47 105.19 110.75 2oxf n GLY 2093Ca -0.17 -1.91 -0.27 0.00 0.00 0.00 0.00 46.02 43.67 2oxf n GLY 2093CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2oxf s THR 2094N -3.32 1.61 0.27 2.61 -4.23 -1.26 -1.62 115.64 109.71 2oxf s THR 2094Ca 0.38 -0.84 -0.01 0.00 -1.18 0.00 0.00 61.69 60.03 2oxf s THR 2094Cb 0.02 -1.36 -0.02 0.00 1.34 0.00 0.00 72.50 72.47 2oxf s THR 2094CO 0.27 0.46 0.29 0.42 -0.54 0.00 0.00 174.62 175.52 2oxf s THR 2095N -0.23 0.00 0.56 3.99 -4.23 -0.61 -4.92 115.64 110.20 2oxf s THR 2095Ca 0.01 -1.83 -0.05 0.00 -1.18 0.00 0.00 61.69 58.65 2oxf s THR 2095Cb -0.10 -2.48 0.12 0.00 1.34 0.00 0.00 72.50 71.38 2oxf s THR 2095CO 0.01 0.00 0.76 0.61 -0.54 0.00 0.00 174.62 175.46 2oxf n GLY 2096N -0.43 -0.18 3.24 3.99 0.00 -1.26 -0.86 105.19 109.69 2oxf n GLY 2096Ca 0.03 -1.88 -0.14 0.00 0.00 0.00 0.00 46.02 44.03 2oxf n GLY 2096CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oxf s ALA 2097N -3.43 1.38 0.00 4.61 0.00 -0.38 -4.49 121.76 119.45 2oxf s ALA 2097Ca 0.47 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.98 2oxf s ALA 2097Cb -0.02 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2oxf s ALA 2097CO 0.32 -0.10 0.89 0.44 0.00 0.00 0.00 175.76 177.31 2oxf n ILE 2098N -0.10 0.79 -4.43 0.00 -5.35 -0.21 -4.38 119.36 105.68 2oxf n ILE 2098Ca -0.11 -0.84 -0.34 0.00 -0.27 0.00 0.00 62.75 61.18 2oxf n ILE 2098Cb 0.60 0.62 -0.11 0.00 -1.74 0.00 0.00 39.64 39.01 2oxf n ILE 2098CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2oxf s GLN 2099N -0.79 3.11 0.47 6.28 -1.52 -1.26 -4.87 119.66 121.08 2oxf s GLN 2099Ca 0.00 -0.47 0.18 0.00 -1.95 0.00 0.00 55.36 53.12 2oxf s GLN 2099Cb 0.00 -2.78 1.14 0.00 -0.22 0.00 0.00 33.01 31.15 2oxf s GLN 2099CO 0.00 0.58 2.02 -1.35 -0.25 0.00 0.00 175.29 176.29 2oxf h PRO 2100N 5.58 0.00 -0.01 2.91 0.11 -1.86 -2.47 132.00 136.25 2oxf h PRO 2100Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2oxf h PRO 2100Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2oxf h PRO 2100CO 0.56 0.16 0.00 -2.39 -0.21 0.00 0.00 178.00 176.12 2oxf n HIS 2101N -4.16 0.01 -3.45 0.65 1.44 -1.26 -4.66 115.22 103.78 2oxf n HIS 2101Ca -0.02 -0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.30 2oxf n HIS 2101Cb 0.23 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.26 2oxf n HIS 2101CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2oxf s ILE 2102N -1.99 5.23 -0.09 0.61 1.01 -0.93 -5.07 121.20 119.98 2oxf s ILE 2102Ca 0.43 0.57 -0.05 0.00 0.00 0.00 0.00 60.65 61.60 2oxf s ILE 2102Cb 0.21 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.97 2oxf s ILE 2102CO 0.35 0.27 0.12 0.20 0.00 0.00 0.00 174.94 175.87 2oxf s ASN 2103N 1.10 6.16 0.12 3.58 0.01 -1.26 -4.85 114.94 119.80 2oxf s ASN 2103Ca 0.16 0.37 -0.35 0.00 -0.71 0.00 0.00 52.86 52.33 2oxf s ASN 2103Cb -0.15 -1.94 -0.16 0.00 0.41 0.00 0.00 41.25 39.42 2oxf s ASN 2103CO 0.07 0.37 1.30 0.52 -1.51 0.00 0.00 177.10 177.85 2oxf n VAL 2104N 1.76 0.31 0.00 1.60 0.31 -1.26 -0.46 118.33 120.59 2oxf n VAL 2104Ca -0.18 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 2oxf n VAL 2104Cb 0.54 -0.88 0.00 0.00 -0.91 0.00 0.00 33.84 32.59 2oxf n VAL 2104CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2oxf n GLY 2105N 2.40 3.23 3.69 2.92 0.00 0.17 -5.00 105.19 112.61 2oxf n GLY 2105Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2oxf n GLY 2105CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oxf s ASP 2106N -0.68 3.27 -0.09 1.61 1.01 0.40 -4.71 116.67 117.47 2oxf s ASP 2106Ca 0.00 1.62 0.03 0.00 0.71 0.00 0.00 52.55 54.91 2oxf s ASP 2106Cb 0.00 -2.27 -0.01 0.00 1.01 0.00 0.00 42.92 41.65 2oxf s ASP 2106CO 0.00 -2.79 -0.19 -0.69 0.21 0.00 0.00 175.17 171.71 2oxf s VAL 2107N -2.85 2.51 -0.18 -1.27 1.01 0.56 -1.39 120.40 118.80 2oxf s VAL 2107Ca 0.64 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 2oxf s VAL 2107Cb -0.19 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 2oxf s VAL 2107CO 0.58 0.55 -0.02 -0.76 0.00 0.00 0.00 175.10 175.45 2oxf s LEU 2108N 0.10 3.26 -0.20 3.92 1.43 0.71 -0.92 118.68 126.98 2oxf s LEU 2108Ca -0.09 -0.16 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 2oxf s LEU 2108Cb -0.15 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 2oxf s LEU 2108CO 0.06 0.12 -0.02 -0.69 0.23 0.00 0.00 176.35 176.04 2oxf s VAL 2109N 0.69 3.77 -0.25 -1.59 1.01 -0.10 -0.60 120.40 123.33 2oxf s VAL 2109Ca -0.01 -0.38 -0.19 0.00 0.00 0.00 0.00 61.98 61.41 2oxf s VAL 2109Cb -0.14 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 2oxf s VAL 2109CO 0.02 0.44 0.55 -0.89 0.00 0.00 0.00 175.10 175.22 2oxf s THR 2110N 0.99 5.05 0.09 3.92 2.01 -0.54 -1.84 115.64 125.31 2oxf s THR 2110Ca 0.01 0.97 -0.00 0.00 0.31 0.00 0.00 61.69 62.98 2oxf s THR 2110Cb -0.14 -3.86 -0.26 0.00 0.01 0.00 0.00 72.50 68.25 2oxf s THR 2110CO 0.01 0.08 1.18 0.71 -0.69 0.00 0.00 174.62 175.91 2oxf h THR 2111N 5.37 1.56 -2.23 -0.82 1.35 -1.18 -3.41 112.91 113.56 2oxf h THR 2111Ca -0.29 -3.19 0.12 0.00 -0.55 0.00 0.00 66.41 62.51 2oxf h THR 2111Cb 1.14 2.90 -0.15 0.00 -1.73 0.00 0.00 68.15 70.31 2oxf h THR 2111CO 0.74 0.92 0.52 0.00 -0.25 0.00 0.00 175.52 177.44 2oxf s ALA 2112N -2.67 -1.83 0.09 6.62 0.00 -1.26 -0.97 121.76 121.74 2oxf s ALA 2112Ca -0.02 1.00 0.10 0.00 0.00 0.00 0.00 51.96 53.03 2oxf s ALA 2112Cb 0.08 0.39 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 2oxf s ALA 2112CO 0.86 -0.71 -0.25 -1.12 0.00 0.00 0.00 175.76 174.54 2oxf s SER 2113N -2.49 3.37 -0.06 0.00 0.01 0.07 -2.31 113.70 112.29 2oxf s SER 2113Ca 0.06 -0.65 -0.30 0.00 1.31 0.00 0.00 55.95 56.37 2oxf s SER 2113Cb -0.01 -0.31 -0.04 0.00 0.21 0.00 0.00 66.02 65.88 2oxf s SER 2113CO -0.08 0.21 1.33 -0.69 0.41 0.00 0.00 173.24 174.42 2oxf s VAL 2114N -0.98 4.00 -1.18 3.43 1.01 0.16 -4.30 120.40 122.54 2oxf s VAL 2114Ca 0.14 1.31 -0.15 0.00 0.00 0.00 0.00 61.98 63.28 2oxf s VAL 2114Cb -0.10 -3.84 0.15 0.00 0.00 0.00 0.00 36.38 32.59 2oxf s VAL 2114CO 0.05 -0.04 1.43 -0.13 0.00 0.00 0.00 175.10 176.41 2oxf s ARG 2115N 2.77 4.01 -0.22 2.72 0.52 -1.26 -1.96 118.95 125.53 2oxf s ARG 2115Ca 0.60 -2.38 0.15 0.00 -0.52 0.00 0.00 55.73 53.58 2oxf s ARG 2115Cb -0.27 -5.11 0.71 0.00 0.52 0.00 0.00 34.95 30.79 2oxf s ARG 2115CO 0.22 -1.84 1.63 1.28 0.02 0.00 0.00 175.30 176.61 2oxf n LEU 2116N 6.17 5.03 -4.90 2.53 4.77 -0.36 -4.97 117.00 125.27 2oxf n LEU 2116Ca 0.37 -2.99 -0.23 0.00 -0.03 0.00 0.00 56.01 53.13 2oxf n LEU 2116Cb 0.44 -0.63 -0.01 0.00 -2.33 0.00 0.00 43.42 40.89 2oxf n LEU 2116CO 0.63 0.66 0.06 1.51 -1.33 0.00 0.00 177.39 178.91 2oxf s ASP 2117N -1.26 4.85 -0.20 -1.43 3.84 -1.15 -3.82 116.67 117.50 2oxf s ASP 2117Ca 0.50 -0.98 0.08 0.00 -0.00 0.00 0.00 52.55 52.14 2oxf s ASP 2117Cb 0.39 -0.05 -0.22 0.00 -1.38 0.00 0.00 42.92 41.67 2oxf s ASP 2117CO 0.13 -0.92 0.03 0.61 -0.00 0.00 0.00 175.17 175.02 2oxf n GLY 2118N -1.71 -0.67 0.16 2.12 0.00 -1.26 -4.59 105.19 99.24 2oxf n GLY 2118Ca 0.03 -0.23 0.01 0.00 0.00 0.00 0.00 46.02 45.82 2oxf n GLY 2118CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oxf h ALA 2119N 0.46 1.20 -0.45 4.61 0.00 -1.97 -2.80 119.26 120.31 2oxf h ALA 2119Ca -0.52 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.01 2oxf h ALA 2119Cb 2.05 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.74 2oxf h ALA 2119CO -0.01 0.60 0.30 0.66 0.00 0.00 0.00 179.25 180.80 2oxf h SER 2120N 0.00 0.33 0.50 0.00 4.64 -1.87 0.05 113.55 117.20 2oxf h SER 2120Ca -0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2oxf h SER 2120Cb 0.86 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2oxf h SER 2120CO 0.06 0.22 0.00 -0.07 -0.87 0.00 0.00 176.83 176.17 2oxf h LEU 2121N 0.38 0.00 -0.01 5.97 3.38 -1.64 -1.21 115.31 122.17 2oxf h LEU 2121Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2oxf h LEU 2121Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2oxf h LEU 2121CO -0.05 0.00 -0.01 1.41 0.09 0.00 0.00 178.44 179.89 2oxf n HIS 2122N -2.45 0.00 -0.01 1.13 8.25 0.00 -3.92 115.22 118.22 2oxf n HIS 2122Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 2oxf n HIS 2122Cb 0.17 -0.24 -0.02 0.00 1.12 0.00 0.00 29.99 31.02 2oxf n HIS 2122CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2oxf n PHE 2123N -1.23 0.00 -3.58 4.41 3.01 -0.50 -5.08 117.46 114.48 2oxf n PHE 2123Ca 0.16 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.45 2oxf n PHE 2123Cb 0.23 -0.10 -0.07 0.00 -0.01 0.00 0.00 39.48 39.53 2oxf n PHE 2123CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2oxf s ALA 2124N -2.05 -1.59 0.91 4.37 0.00 -0.96 -4.99 121.76 117.46 2oxf s ALA 2124Ca -0.01 1.27 -0.11 0.00 0.00 0.00 0.00 51.96 53.11 2oxf s ALA 2124Cb 0.01 -0.20 0.14 0.00 0.00 0.00 0.00 23.12 23.07 2oxf s ALA 2124CO 0.08 -0.34 1.09 -1.25 0.00 0.00 0.00 175.76 175.34 2oxf s PRO 2125N -0.91 1.11 0.54 0.00 0.04 -1.26 -4.11 135.00 130.41 2oxf s PRO 2125Ca -0.09 1.04 0.24 0.00 0.04 0.00 0.00 61.00 62.22 2oxf s PRO 2125Cb -0.02 -1.77 1.41 0.00 0.04 0.00 0.00 34.50 34.16 2oxf s PRO 2125CO 0.07 -2.41 2.04 1.98 0.04 0.00 0.00 177.00 178.72 2oxf h MET 2126N -1.68 0.00 0.00 4.56 4.05 -1.94 -1.40 114.93 118.52 2oxf h MET 2126Ca -0.49 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 58.93 2oxf h MET 2126Cb 1.28 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.08 2oxf h MET 2126CO 0.51 0.00 -0.03 0.93 0.23 0.00 0.00 176.91 178.54 2oxf h GLU 2127N 0.00 0.00 -6.61 0.39 3.07 -2.04 -3.43 114.58 105.96 2oxf h GLU 2127Ca 0.18 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.53 2oxf h GLU 2127Cb 0.76 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.65 2oxf h GLU 2127CO -0.00 0.03 0.35 0.12 -1.40 0.00 0.00 179.01 178.11 2oxf s PHE 2128N -4.03 3.86 0.19 4.33 2.19 -0.53 -5.00 117.98 118.99 2oxf s PHE 2128Ca -0.02 1.82 -0.30 0.00 0.33 0.00 0.00 56.93 58.76 2oxf s PHE 2128Cb 0.12 -3.02 -0.08 0.00 -1.31 0.00 0.00 43.02 38.73 2oxf s PHE 2128CO 0.51 0.29 1.06 -1.25 1.83 0.00 0.00 175.22 177.65 2oxf s PRO 2129N -0.36 4.65 -1.42 10.12 0.04 -1.26 -4.94 135.00 141.82 2oxf s PRO 2129Ca 0.45 1.66 -0.15 0.00 0.04 0.00 0.00 61.00 63.00 2oxf s PRO 2129Cb -0.24 -3.28 0.05 0.00 0.04 0.00 0.00 34.50 31.07 2oxf s PRO 2129CO 0.30 0.16 2.12 0.00 0.04 0.00 0.00 177.00 179.62 2oxf n ALA 2130N 2.19 5.10 -2.78 8.56 0.00 -1.26 -4.76 120.51 127.56 2oxf n ALA 2130Ca 0.02 -3.88 -0.35 0.00 0.00 0.00 0.00 53.44 49.23 2oxf n ALA 2130Cb 0.47 -3.55 -0.08 0.00 0.00 0.00 0.00 19.45 16.29 2oxf n ALA 2130CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2oxf s VAL 2131N 3.41 4.83 0.53 0.00 0.11 -1.26 -0.75 120.40 127.27 2oxf s VAL 2131Ca 0.49 -0.14 -0.16 0.00 -2.93 0.00 0.00 61.98 59.23 2oxf s VAL 2131Cb 0.12 -3.11 -0.07 0.00 -1.53 0.00 0.00 36.38 31.79 2oxf s VAL 2131CO -0.05 0.53 1.00 0.00 -3.33 0.00 0.00 175.10 173.25 2oxf s ALA 2132N -1.03 3.03 0.33 1.54 0.00 -0.15 -4.65 121.76 120.83 2oxf s ALA 2132Ca 0.17 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 52.03 2oxf s ALA 2132Cb -0.12 -3.13 -0.10 0.00 0.00 0.00 0.00 23.12 19.77 2oxf s ALA 2132CO 0.06 -0.34 1.32 0.34 0.00 0.00 0.00 175.76 177.15 2oxf s ASP 2133N -3.10 6.75 0.10 0.00 2.15 -0.18 -4.94 116.67 117.44 2oxf s ASP 2133Ca 0.59 2.70 -0.16 0.00 0.43 0.00 0.00 52.55 56.11 2oxf s ASP 2133Cb -0.11 -2.65 -0.06 0.00 -0.30 0.00 0.00 42.92 39.80 2oxf s ASP 2133CO 0.33 -0.56 1.51 0.15 -0.17 0.00 0.00 175.17 176.44 2oxf h PHE 2134N 3.47 0.65 -0.60 -5.34 3.57 -1.96 -1.27 116.94 115.46 2oxf h PHE 2134Ca -0.49 -0.13 0.05 0.00 3.53 0.00 0.00 57.97 60.93 2oxf h PHE 2134Cb 1.23 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.75 2oxf h PHE 2134CO 0.56 0.75 0.32 0.00 -2.23 0.00 0.00 178.31 177.71 2oxf h ALA 2135N 0.81 0.79 -0.36 2.41 0.00 -1.96 -0.40 119.26 120.56 2oxf h ALA 2135Ca 0.08 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2oxf h ALA 2135Cb 0.52 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2oxf h ALA 2135CO 0.03 -0.01 0.11 0.00 0.00 0.00 0.00 179.25 179.38 2oxf h THR 2137N 0.43 1.24 -0.43 0.00 2.02 -0.96 -1.08 112.91 114.13 2oxf h THR 2137Ca 0.12 -0.64 -0.02 0.00 0.77 0.00 0.00 66.41 66.64 2oxf h THR 2137Cb 0.25 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 2oxf h THR 2137CO -0.00 0.28 0.21 0.74 0.37 0.00 0.00 175.52 177.11 2oxf h THR 2138N 1.08 1.18 -0.51 3.16 2.02 -0.90 -1.64 112.91 117.29 2oxf h THR 2138Ca 0.27 -0.51 -0.07 0.00 0.77 0.00 0.00 66.41 66.87 2oxf h THR 2138Cb 0.08 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 2oxf h THR 2138CO -0.04 0.20 0.03 0.00 0.37 0.00 0.00 175.52 176.07 2oxf h ALA 2139N 1.05 1.09 -0.30 6.16 0.00 -0.65 0.00 119.26 126.62 2oxf h ALA 2139Ca 0.15 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2oxf h ALA 2139Cb 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2oxf h ALA 2139CO -0.02 0.58 -0.13 -0.07 0.00 0.00 0.00 179.25 179.62 2oxf h LEU 2140N 0.78 0.63 -0.47 0.00 3.38 -0.97 -1.00 115.31 117.66 2oxf h LEU 2140Ca 0.16 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 2oxf h LEU 2140Cb 0.43 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2oxf h LEU 2140CO 0.02 0.89 0.23 0.58 0.09 0.00 0.00 178.44 180.25 2oxf h VAL 2141N 0.37 1.18 -0.83 1.22 2.07 -1.09 -0.52 116.25 118.65 2oxf h VAL 2141Ca 0.07 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 2oxf h VAL 2141Cb 0.64 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 2oxf h VAL 2141CO 0.04 0.20 0.37 -0.33 0.02 0.00 0.00 177.57 177.87 2oxf h GLU 2142N 0.62 1.21 -0.47 1.57 5.08 -0.97 -0.72 114.58 120.90 2oxf h GLU 2142Ca 0.16 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 2oxf h GLU 2142Cb 0.10 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2oxf h GLU 2142CO -0.02 0.95 -0.22 0.00 -1.00 0.00 0.00 179.01 178.71 2oxf h ALA 2143N 1.20 0.66 -0.43 3.43 0.00 -1.00 -1.60 119.26 121.51 2oxf h ALA 2143Ca 0.28 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2oxf h ALA 2143Cb 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2oxf h ALA 2143CO -0.03 0.65 0.20 0.00 0.00 0.00 0.00 179.25 180.07 2oxf h ALA 2144N 0.85 0.56 -0.62 0.00 0.00 -0.81 -2.54 119.26 116.71 2oxf h ALA 2144Ca 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2oxf h ALA 2144Cb 0.80 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2oxf h ALA 2144CO 0.07 0.13 0.32 -0.22 0.00 0.00 0.00 179.25 179.55 2oxf h LYS 2145N 0.56 0.86 0.00 0.00 3.64 -1.02 -1.48 116.57 119.13 2oxf h LYS 2145Ca 0.15 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2oxf h LYS 2145Cb 0.14 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2oxf h LYS 2145CO -0.02 0.64 0.00 0.66 -2.27 0.00 0.00 179.45 178.46 2oxf h SER 2146N 0.86 0.00 -0.36 4.20 4.64 -0.86 -1.48 113.55 120.55 2oxf h SER 2146Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2oxf h SER 2146Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2oxf h SER 2146CO -0.03 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.23 2oxf n ILE 2147N -2.68 1.36 -1.67 0.95 -5.35 -0.99 -4.98 119.36 105.99 2oxf n ILE 2147Ca 0.01 -1.22 -0.07 0.00 -0.27 0.00 0.00 62.75 61.20 2oxf n ILE 2147Cb 0.24 0.30 -0.02 0.00 -1.74 0.00 0.00 39.64 38.43 2oxf n ILE 2147CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2oxf n GLY 2148N 0.36 0.50 3.78 3.28 0.00 -0.56 -5.01 105.19 107.55 2oxf n GLY 2148Ca 0.15 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 2oxf n GLY 2148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oxf s ALA 2149N -2.31 3.18 -0.29 4.61 0.00 -0.59 -5.00 121.76 121.36 2oxf s ALA 2149Ca 0.00 0.63 -0.28 0.00 0.00 0.00 0.00 51.96 52.31 2oxf s ALA 2149Cb 0.00 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.90 2oxf s ALA 2149CO 0.00 -0.01 1.03 0.99 0.00 0.00 0.00 175.76 177.77 2oxf s THR 2150N -1.58 4.59 -0.01 0.00 2.01 -1.26 -4.62 115.64 114.76 2oxf s THR 2150Ca 0.52 1.74 0.08 0.00 0.31 0.00 0.00 61.69 64.35 2oxf s THR 2150Cb -0.21 -4.35 -0.02 0.00 0.01 0.00 0.00 72.50 67.92 2oxf s THR 2150CO 0.27 -0.37 -0.25 -0.89 -0.69 0.00 0.00 174.62 172.69 2oxf s THR 2151N 3.45 2.17 -0.02 -0.82 2.01 -1.26 -0.33 115.64 120.84 2oxf s THR 2151Ca 0.43 -1.11 0.07 0.00 0.31 0.00 0.00 61.69 61.40 2oxf s THR 2151Cb -0.13 -1.77 -0.02 0.00 0.01 0.00 0.00 72.50 70.59 2oxf s THR 2151CO 0.13 0.55 -0.23 -1.00 -0.69 0.00 0.00 174.62 173.38 2oxf s HIS 2152N -0.65 2.09 -0.13 4.92 3.76 -0.10 -4.95 115.29 120.24 2oxf s HIS 2152Ca 0.10 -0.43 0.01 0.00 -0.15 0.00 0.00 55.06 54.59 2oxf s HIS 2152Cb -0.10 -1.35 0.02 0.00 1.11 0.00 0.00 32.58 32.26 2oxf s HIS 2152CO -0.00 -0.06 -0.15 0.08 -0.85 0.00 0.00 174.74 173.76 2oxf s VAL 2153N -0.47 1.52 -2.07 -0.90 1.01 -1.26 -0.92 120.40 117.31 2oxf s VAL 2153Ca 0.07 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.42 2oxf s VAL 2153Cb -0.10 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.87 2oxf s VAL 2153CO -0.00 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2oxf n GLY 2154N 4.47 -0.68 3.85 4.51 0.00 -0.77 -4.92 105.19 111.65 2oxf n GLY 2154Ca -0.18 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 2oxf n GLY 2154CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oxf s VAL 2155N -3.98 5.12 -0.04 1.61 1.01 -1.26 -0.57 120.40 122.29 2oxf s VAL 2155Ca 0.00 0.67 0.07 0.00 0.00 0.00 0.00 61.98 62.72 2oxf s VAL 2155Cb 0.00 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 2oxf s VAL 2155CO 0.00 0.53 -0.25 -0.89 0.00 0.00 0.00 175.10 174.49 2oxf s THR 2156N -1.13 2.08 -0.06 3.92 2.01 -0.98 -0.34 115.64 121.14 2oxf s THR 2156Ca 0.24 -1.08 -0.17 0.00 0.31 0.00 0.00 61.69 60.99 2oxf s THR 2156Cb -0.15 -1.73 -0.05 0.00 0.01 0.00 0.00 72.50 70.57 2oxf s THR 2156CO 0.13 0.58 0.47 0.00 -0.69 0.00 0.00 174.62 175.10 2oxf s ALA 2157N -0.39 3.55 -0.15 7.40 0.00 0.07 -0.67 121.76 131.57 2oxf s ALA 2157Ca 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 51.96 51.82 2oxf s ALA 2157Cb -0.12 -2.58 0.04 0.00 0.00 0.00 0.00 23.12 20.46 2oxf s ALA 2157CO 0.01 0.17 -0.05 0.45 0.00 0.00 0.00 175.76 176.34 2oxf s SER 2158N -0.03 2.64 0.32 0.00 0.15 -0.83 -1.11 113.70 114.85 2oxf s SER 2158Ca 0.26 -0.57 0.03 0.00 0.70 0.00 0.00 55.95 56.37 2oxf s SER 2158Cb -0.16 -0.86 -0.04 0.00 -1.71 0.00 0.00 66.02 63.25 2oxf s SER 2158CO 0.12 -0.18 0.13 -0.94 1.20 0.00 0.00 173.24 173.58 2oxf s SER 2159N 1.67 1.87 0.17 5.45 1.04 -0.45 -1.22 113.70 122.22 2oxf s SER 2159Ca 0.02 -1.54 0.23 0.00 0.48 0.00 0.00 55.95 55.14 2oxf s SER 2159Cb -0.15 0.33 0.20 0.00 0.10 0.00 0.00 66.02 66.50 2oxf s SER 2159CO -0.08 -0.84 1.22 0.44 0.98 0.00 0.00 173.24 174.96 2oxf h ASP 2160N 2.13 0.00 -2.79 7.02 3.45 -1.85 -3.37 116.42 121.01 2oxf h ASP 2160Ca -0.35 -0.12 -0.65 0.00 0.43 0.00 0.00 57.03 56.33 2oxf h ASP 2160Cb 1.25 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 39.96 2oxf h ASP 2160CO 0.56 0.06 -0.50 0.42 -1.57 0.00 0.00 179.24 178.21 2oxf s THR 2161N -3.25 5.35 -1.08 0.35 -4.23 -1.26 -4.95 115.64 106.57 2oxf s THR 2161Ca 0.03 -0.05 0.26 0.00 -1.18 0.00 0.00 61.69 60.75 2oxf s THR 2161Cb 0.11 -3.42 0.26 0.00 1.34 0.00 0.00 72.50 70.79 2oxf s THR 2161CO 0.75 0.45 1.83 0.33 -0.54 0.00 0.00 174.62 177.44 2oxf n PHE 2162N 1.41 0.00 -2.03 3.99 -0.00 -1.26 -3.43 117.46 116.14 2oxf n PHE 2162Ca -0.15 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.00 2oxf n PHE 2162Cb 0.54 -0.46 0.03 0.00 -0.00 0.00 0.00 39.48 39.59 2oxf n PHE 2162CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.76 179.24 2oxf n TYR 2163N -1.46 3.11 0.00 -5.13 -0.00 -1.26 -5.06 117.16 107.36 2oxf n TYR 2163Ca 0.07 -2.68 0.00 0.00 -0.00 0.00 0.00 57.90 55.29 2oxf n TYR 2163Cb 0.28 -0.64 0.00 0.00 -0.00 0.00 0.00 39.34 38.99 2oxf n TYR 2163CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.86 174.56 2oxf n PRO 2164N -0.64 0.00 -1.10 -3.48 -0.02 -1.22 -4.63 135.00 123.91 2oxf n PRO 2164Ca 0.48 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2oxf n PRO 2164Cb 0.66 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.14 2oxf n PRO 2164CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oxf n GLY 2165N 0.00 -4.30 1.51 -1.23 0.00 -1.26 -4.86 105.19 95.05 2oxf n GLY 2165Ca 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 46.02 45.29 2oxf n GLY 2165CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2oxf n GLN 2166N -0.11 -1.43 0.00 1.61 1.13 -1.26 -5.07 117.38 112.25 2oxf n GLN 2166Ca 0.00 0.19 0.00 0.00 -1.94 0.00 0.00 57.00 55.25 2oxf n GLN 2166Cb 0.00 -4.34 0.00 0.00 0.11 0.00 0.00 30.24 26.01 2oxf n GLN 2166CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2oxf n SER 2183N 0.17 0.00 -0.01 1.08 7.64 -1.26 -5.14 113.62 116.10 2oxf n SER 2183Ca -0.03 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.71 2oxf n SER 2183Cb 0.20 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.38 2oxf n SER 2183CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 2oxf h MET 2184N 0.00 0.66 -0.60 1.43 -1.53 -1.98 0.21 114.93 113.12 2oxf h MET 2184Ca 0.00 -0.49 -0.04 0.00 -3.44 0.00 0.00 59.70 55.73 2oxf h MET 2184Cb 0.00 0.09 -0.03 0.00 -0.55 0.00 0.00 31.60 31.11 2oxf h MET 2184CO 0.00 1.11 0.21 0.93 0.14 0.00 0.00 176.91 179.31 2oxf h GLU 2185N 0.48 0.90 -0.35 0.39 5.08 -2.00 0.12 114.58 119.19 2oxf h GLU 2185Ca -0.02 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2oxf h GLU 2185Cb 1.28 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 2oxf h GLU 2185CO 0.13 0.76 0.22 1.49 -1.00 0.00 0.00 179.01 180.61 2oxf h GLU 2186N 0.88 0.47 -0.50 2.33 4.81 -1.85 -1.65 114.58 119.07 2oxf h GLU 2186Ca 0.20 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.27 2oxf h GLU 2186Cb 0.22 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2oxf h GLU 2186CO -0.01 0.33 -0.17 -1.49 -0.73 0.00 0.00 179.01 176.94 2oxf h TRP 2187N 0.47 1.12 -0.60 0.92 -0.00 0.02 -2.16 115.95 115.72 2oxf h TRP 2187Ca 0.13 -0.25 0.02 0.00 -0.00 0.00 0.00 58.89 58.79 2oxf h TRP 2187Cb -0.03 -0.27 -0.04 0.00 -0.00 0.00 0.00 29.16 28.83 2oxf h TRP 2187CO -0.05 1.07 0.38 0.37 -0.00 0.00 0.00 178.44 180.21 2oxf h GLN 2188N 0.86 0.73 0.00 0.49 4.15 -0.67 -1.30 115.11 119.37 2oxf h GLN 2188Ca 0.12 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.50 2oxf h GLN 2188Cb 0.74 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 28.27 2oxf h GLN 2188CO 0.06 0.48 -0.01 0.00 -1.93 0.00 0.00 178.83 177.43 2oxf h ALA 2189N 1.25 1.00 -0.32 3.38 0.00 -1.09 -1.91 119.26 121.58 2oxf h ALA 2189Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2oxf h ALA 2189Cb -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2oxf h ALA 2189CO -0.09 0.01 0.00 -1.33 0.00 0.00 0.00 179.25 177.84 2oxf n MET 2190N -3.10 2.09 -0.62 0.00 2.81 -0.71 -4.94 117.12 112.66 2oxf n MET 2190Ca 0.00 -1.66 0.00 0.00 -1.81 0.00 0.00 57.70 54.23 2oxf n MET 2190Cb 0.28 -1.43 0.00 0.00 -0.71 0.00 0.00 33.22 31.35 2oxf n MET 2190CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2oxf n GLY 2191N 1.30 0.73 3.74 3.03 0.00 -0.72 -5.02 105.19 108.24 2oxf n GLY 2191Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2oxf n GLY 2191CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oxf s VAL 2192N -2.36 2.14 0.07 1.61 1.01 -0.57 -4.63 120.40 117.66 2oxf s VAL 2192Ca 0.00 0.11 -0.10 0.00 0.00 0.00 0.00 61.98 61.99 2oxf s VAL 2192Cb 0.00 -3.07 -0.29 0.00 0.00 0.00 0.00 36.38 33.02 2oxf s VAL 2192CO 0.00 0.02 1.12 0.24 0.00 0.00 0.00 175.10 176.48 2oxf h MET 2193N 5.24 0.46 -2.22 2.72 0.00 -1.02 -3.42 114.93 116.69 2oxf h MET 2193Ca -0.46 -0.69 0.21 0.00 0.00 0.00 0.00 59.70 58.76 2oxf h MET 2193Cb 1.22 0.24 -0.07 0.00 0.00 0.00 0.00 31.60 32.99 2oxf h MET 2193CO 0.82 1.31 0.61 0.54 0.00 0.00 0.00 176.91 180.19 2oxf s ASN 2194N -7.34 -0.08 -0.00 1.22 4.22 -1.26 -1.04 114.94 110.67 2oxf s ASN 2194Ca -0.07 -0.44 0.06 0.00 -2.14 0.00 0.00 52.86 50.27 2oxf s ASN 2194Cb 0.06 0.41 -0.02 0.00 1.28 0.00 0.00 41.25 42.98 2oxf s ASN 2194CO 0.91 -0.78 -0.19 -0.31 -2.04 0.00 0.00 177.10 174.69 2oxf s TYR 2195N -2.64 1.70 0.00 1.54 2.02 -1.26 -0.75 117.35 117.96 2oxf s TYR 2195Ca 0.17 -0.33 0.00 0.00 -0.37 0.00 0.00 57.07 56.54 2oxf s TYR 2195Cb -0.01 -1.08 0.00 0.00 -0.40 0.00 0.00 41.96 40.48 2oxf s TYR 2195CO 0.02 -0.01 0.00 -0.85 -1.57 0.00 0.00 175.55 173.14 2oxf n GLU 2196N 2.47 0.00 0.00 -0.62 -0.00 -0.26 -4.63 120.64 117.59 2oxf n GLU 2196Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.01 2oxf n GLU 2196Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.97 2oxf n GLU 2196CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 2oxf n MET 2197N 0.00 5.13 -0.00 3.44 2.81 -1.26 -1.34 117.12 125.90 2oxf n MET 2197Ca 0.00 -0.02 0.01 0.00 -1.81 0.00 0.00 57.70 55.87 2oxf n MET 2197Cb 0.00 -0.42 -0.02 0.00 -0.71 0.00 0.00 33.22 32.07 2oxf n MET 2197CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2oxf n GLU 2198N -0.74 0.76 -0.30 0.03 4.71 -1.26 -3.47 120.64 120.37 2oxf n GLU 2198Ca 0.00 -0.02 -0.05 0.00 -0.01 0.00 0.00 57.16 57.09 2oxf n GLU 2198Cb 0.00 -1.05 0.07 0.00 -1.01 0.00 0.00 31.44 29.45 2oxf n GLU 2198CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2oxf h SER 2199N 0.00 1.04 -0.49 1.62 4.64 -1.96 -1.66 113.55 116.75 2oxf h SER 2199Ca -0.01 -0.11 0.04 0.00 -0.47 0.00 0.00 61.79 61.24 2oxf h SER 2199Cb 0.30 -0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 62.08 2oxf h SER 2199CO 0.00 0.86 0.25 0.00 -0.87 0.00 0.00 176.83 177.07 2oxf h ALA 2200N 1.23 0.62 0.09 5.18 0.00 -1.87 0.16 119.26 124.67 2oxf h ALA 2200Ca 0.29 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2oxf h ALA 2200Cb 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2oxf h ALA 2200CO -0.04 -0.10 -0.04 1.15 0.00 0.00 0.00 179.25 180.22 2oxf h THR 2201N 0.49 1.07 -0.10 0.00 2.02 -1.82 -1.84 112.91 112.73 2oxf h THR 2201Ca 0.21 -0.61 0.04 0.00 0.77 0.00 0.00 66.41 66.82 2oxf h THR 2201Cb 0.12 1.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.94 2oxf h THR 2201CO -0.15 0.15 -0.20 0.25 0.37 0.00 0.00 175.52 175.94 2oxf h LEU 2202N -0.40 -0.60 -0.52 2.58 5.85 -1.02 -0.30 115.31 120.89 2oxf h LEU 2202Ca -0.01 0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 2oxf h LEU 2202Cb 0.34 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 2oxf h LEU 2202CO 0.02 -0.25 -0.12 -0.07 -0.34 0.00 0.00 178.44 177.68 2oxf h LEU 2203N -0.27 1.01 -0.13 2.25 3.38 -0.72 -1.95 115.31 118.89 2oxf h LEU 2203Ca 0.09 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 2oxf h LEU 2203Cb 0.40 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2oxf h LEU 2203CO -0.25 1.13 -0.04 0.74 0.09 0.00 0.00 178.44 180.11 2oxf h THR 2204N 0.87 1.30 0.00 0.22 2.02 -1.21 0.22 112.91 116.34 2oxf h THR 2204Ca 0.13 -1.03 -0.06 0.00 0.77 0.00 0.00 66.41 66.23 2oxf h THR 2204Cb 0.69 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.81 2oxf h THR 2204CO 0.05 0.30 -0.27 0.00 0.37 0.00 0.00 175.52 175.97 2oxf h MET 2205N -0.07 0.00 0.04 6.66 -0.00 -1.00 -1.55 114.93 119.01 2oxf h MET 2205Ca 0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 59.70 59.67 2oxf h MET 2205Cb 0.48 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.09 2oxf h MET 2205CO 0.02 0.27 -0.27 0.00 -0.00 0.00 0.00 176.91 176.92 2oxf h ALA 2207N 0.04 1.05 -0.40 0.00 0.00 -0.81 -1.45 119.26 117.70 2oxf h ALA 2207Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2oxf h ALA 2207Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2oxf h ALA 2207CO 0.05 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.21 2oxf n SER 2208N -3.20 3.41 -0.23 0.00 3.41 -0.59 -4.45 113.62 111.96 2oxf n SER 2208Ca -0.01 -1.97 0.02 0.00 -0.26 0.00 0.00 58.87 56.65 2oxf n SER 2208Cb 0.22 -0.26 0.02 0.00 -0.26 0.00 0.00 64.21 63.94 2oxf n SER 2208CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oxf n GLN 2209N 1.40 0.55 -1.55 4.33 6.02 -0.69 -5.01 117.38 122.43 2oxf n GLN 2209Ca 0.19 -1.19 -0.05 0.00 -0.01 0.00 0.00 57.00 55.93 2oxf n GLN 2209Cb 0.58 -0.73 -0.01 0.00 1.02 0.00 0.00 30.24 31.10 2oxf n GLN 2209CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oxf n GLY 2210N -0.30 0.52 3.57 1.08 0.00 -1.06 -5.02 105.19 103.98 2oxf n GLY 2210Ca 0.03 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 2oxf n GLY 2210CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oxf s LEU 2211N -1.36 3.02 -0.03 0.99 1.43 -0.63 -5.04 118.68 117.06 2oxf s LEU 2211Ca 0.00 -0.30 -0.16 0.00 -1.03 0.00 0.00 54.13 52.64 2oxf s LEU 2211Cb 0.00 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 2oxf s LEU 2211CO 0.00 0.23 0.42 -0.13 0.23 0.00 0.00 176.35 177.10 2oxf s ARG 2212N -1.79 4.04 0.01 1.70 0.52 -0.37 -3.93 118.95 119.13 2oxf s ARG 2212Ca 0.19 0.42 -0.03 0.00 -0.52 0.00 0.00 55.73 55.78 2oxf s ARG 2212Cb -0.11 -3.28 -0.01 0.00 0.52 0.00 0.00 34.95 32.07 2oxf s ARG 2212CO 0.10 0.56 0.05 0.00 0.02 0.00 0.00 175.30 176.02 2oxf s ALA 2213N -0.65 -0.09 0.09 2.13 0.00 -1.26 -0.33 121.76 121.66 2oxf s ALA 2213Ca 0.24 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 2oxf s ALA 2213Cb -0.16 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2oxf s ALA 2213CO 0.12 -0.16 0.01 0.20 0.00 0.00 0.00 175.76 175.93 2oxf s GLY 2214N -1.26 0.74 -0.08 0.00 0.00 -0.45 -1.01 107.32 105.25 2oxf s GLY 2214Ca -0.14 -1.35 -0.03 0.00 0.00 0.00 0.00 44.72 43.20 2oxf s GLY 2214CO 0.00 -1.35 0.17 -0.29 0.00 0.00 0.00 173.10 171.63 2oxf s MET 2215N -3.97 0.10 0.05 2.90 1.75 -1.26 -1.31 119.30 117.55 2oxf s MET 2215Ca 0.15 0.48 0.04 0.00 -1.25 0.00 0.00 55.69 55.12 2oxf s MET 2215Cb 0.08 -0.19 -0.02 0.00 2.84 0.00 0.00 34.83 37.54 2oxf s MET 2215CO -0.04 -0.21 -0.12 0.54 -0.65 0.00 0.00 175.02 174.53 2oxf s VAL 2216N 1.60 0.97 -0.03 10.11 0.11 -0.53 -1.47 120.40 131.16 2oxf s VAL 2216Ca -0.05 -1.05 -0.07 0.00 -2.93 0.00 0.00 61.98 57.88 2oxf s VAL 2216Cb -0.12 -0.91 0.01 0.00 -1.53 0.00 0.00 36.38 33.83 2oxf s VAL 2216CO -0.06 -0.12 0.16 0.00 -3.33 0.00 0.00 175.10 171.74 2oxf s ALA 2217N -1.02 -0.38 -0.01 1.54 0.00 0.23 -1.42 121.76 120.70 2oxf s ALA 2217Ca -0.01 0.15 -0.15 0.00 0.00 0.00 0.00 51.96 51.94 2oxf s ALA 2217Cb -0.08 -0.07 -0.06 0.00 0.00 0.00 0.00 23.12 22.91 2oxf s ALA 2217CO 0.01 -0.15 0.43 0.20 0.00 0.00 0.00 175.76 176.25 2oxf s GLY 2218N -0.72 2.48 -0.20 0.00 0.00 -0.64 -0.21 107.32 108.03 2oxf s GLY 2218Ca -0.08 -0.20 -0.25 0.00 0.00 0.00 0.00 44.72 44.19 2oxf s GLY 2218CO 0.01 0.25 0.82 0.14 0.00 0.00 0.00 173.10 174.31 2oxf s VAL 2219N -0.87 4.87 -0.66 1.40 1.01 -0.48 -1.57 120.40 124.10 2oxf s VAL 2219Ca 0.24 1.57 0.06 0.00 0.00 0.00 0.00 61.98 63.86 2oxf s VAL 2219Cb -0.17 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.12 2oxf s VAL 2219CO 0.13 -0.01 0.57 2.30 0.00 0.00 0.00 175.10 178.09 2oxf n ILE 2220N 4.97 0.00 -3.54 2.22 -5.35 -0.04 -0.65 119.36 116.97 2oxf n ILE 2220Ca 0.05 -0.46 -0.13 0.00 -0.27 0.00 0.00 62.75 61.94 2oxf n ILE 2220Cb 0.48 1.10 -0.05 0.00 -1.74 0.00 0.00 39.64 39.43 2oxf n ILE 2220CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2oxf s VAL 2221N -0.84 0.00 -0.26 7.28 0.11 -1.25 -4.98 120.40 120.45 2oxf s VAL 2221Ca 0.06 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 58.85 2oxf s VAL 2221Cb 0.05 -1.00 0.15 0.00 -1.53 0.00 0.00 36.38 34.05 2oxf s VAL 2221CO 0.13 0.00 1.15 0.21 -3.33 0.00 0.00 175.10 173.26 2oxf s ASN 2222N -1.34 -0.30 -0.24 3.54 2.47 -1.26 -1.25 114.94 116.56 2oxf s ASN 2222Ca -0.04 0.52 -0.03 0.00 0.42 0.00 0.00 52.86 53.72 2oxf s ASN 2222Cb -0.00 0.50 0.00 0.00 -1.45 0.00 0.00 41.25 40.30 2oxf s ASN 2222CO 0.03 -0.15 -0.04 0.00 -3.72 0.00 0.00 177.10 173.22 2oxf s ARG 2223N -0.20 3.17 0.08 0.43 3.03 -1.26 -2.76 118.95 121.45 2oxf s ARG 2223Ca 0.04 -0.76 0.04 0.00 2.03 0.00 0.00 55.73 57.07 2oxf s ARG 2223Cb -0.04 -3.03 -0.04 0.00 -1.03 0.00 0.00 34.95 30.81 2oxf s ARG 2223CO -0.07 -0.29 0.02 0.95 -1.13 0.00 0.00 175.30 174.78 2oxf s THR 2224N 1.43 4.15 0.06 4.99 -4.23 -1.26 -4.66 115.64 116.11 2oxf s THR 2224Ca 0.04 -0.90 0.00 0.00 -1.18 0.00 0.00 61.69 59.65 2oxf s THR 2224Cb -0.15 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.72 2oxf s THR 2224CO -0.03 0.15 0.00 0.00 -0.54 0.00 0.00 174.62 174.19 2oxf n GLN 2225N 0.63 -3.15 0.00 3.99 3.00 -1.11 -4.78 117.38 115.96 2oxf n GLN 2225Ca -0.11 2.25 0.00 0.00 -0.01 0.00 0.00 57.00 59.14 2oxf n GLN 2225Cb 0.52 -2.85 0.00 0.00 0.00 0.00 0.00 30.24 27.90 2oxf n GLN 2225CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 2oxf n LYS 2235N 1.86 0.00 -0.03 -1.09 -0.00 -1.26 -4.25 118.16 113.39 2oxf n LYS 2235Ca 0.00 0.33 -0.10 0.00 -0.00 0.00 0.00 58.31 58.54 2oxf n LYS 2235Cb 0.00 -1.56 -0.04 0.00 -0.00 0.00 0.00 35.03 33.43 2oxf n LYS 2235CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 2oxf h GLN 2236N 0.00 0.22 -0.19 -1.58 5.75 -2.03 0.26 115.11 117.54 2oxf h GLN 2236Ca 0.00 -0.02 -0.17 0.00 -0.15 0.00 0.00 58.65 58.31 2oxf h GLN 2236Cb 0.11 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 28.61 2oxf h GLN 2236CO 0.00 0.16 -0.58 1.79 -2.65 0.00 0.00 178.83 177.55 2oxf h THR 2237N 0.22 1.31 -0.47 2.39 1.35 -1.93 -1.70 112.91 114.08 2oxf h THR 2237Ca 0.06 -1.83 -0.03 0.00 -0.55 0.00 0.00 66.41 64.06 2oxf h THR 2237Cb -0.01 1.79 -0.02 0.00 -1.73 0.00 0.00 68.15 68.18 2oxf h THR 2237CO -0.01 0.57 0.19 -0.08 -0.25 0.00 0.00 175.52 175.94 2oxf h GLU 2238N 0.47 0.70 -1.00 4.72 4.81 -1.90 -1.18 114.58 121.20 2oxf h GLU 2238Ca 0.00 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.14 2oxf h GLU 2238Cb 1.15 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 30.36 2oxf h GLU 2238CO 0.11 0.63 0.65 0.77 -0.73 0.00 0.00 179.01 180.45 2oxf h SER 2239N 0.62 1.10 -0.19 1.04 0.02 -0.31 -0.10 113.55 115.72 2oxf h SER 2239Ca 0.16 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.97 2oxf h SER 2239Cb 0.19 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.47 2oxf h SER 2239CO -0.01 0.76 -0.37 0.45 -1.14 0.00 0.00 176.83 176.52 2oxf h HIS 2240N 1.28 0.74 -0.80 3.45 3.86 -1.00 -1.28 115.15 121.40 2oxf h HIS 2240Ca 0.39 -0.27 0.01 0.00 -1.16 0.00 0.00 60.37 59.34 2oxf h HIS 2240Cb -0.03 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.26 2oxf h HIS 2240CO -0.00 1.01 0.53 0.00 0.86 0.00 0.00 177.93 180.33 2oxf h ALA 2241N 0.60 1.43 -0.57 2.45 0.00 -1.02 -0.71 119.26 121.43 2oxf h ALA 2241Ca 0.01 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2oxf h ALA 2241Cb 0.97 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2oxf h ALA 2241CO 0.08 0.52 0.13 0.28 0.00 0.00 0.00 179.25 180.27 2oxf h VAL 2242N 1.08 1.25 -0.67 0.00 2.07 -0.83 -1.27 116.25 117.88 2oxf h VAL 2242Ca 0.30 -0.91 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 2oxf h VAL 2242Cb -0.12 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 2oxf h VAL 2242CO -0.07 0.34 0.14 0.50 0.02 0.00 0.00 177.57 178.50 2oxf h LYS 2243N 0.83 1.10 -0.60 1.57 1.63 -0.82 -2.63 116.57 117.64 2oxf h LYS 2243Ca 0.18 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 2oxf h LYS 2243Cb 0.36 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.83 2oxf h LYS 2243CO 0.00 0.99 0.33 0.82 -3.45 0.00 0.00 179.45 178.14 2oxf h ILE 2244N 1.02 1.20 -0.33 2.00 2.04 -0.82 -0.70 117.51 121.92 2oxf h ILE 2244Ca 0.21 -0.50 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 2oxf h ILE 2244Cb 0.40 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2oxf h ILE 2244CO 0.01 0.21 -0.17 1.62 0.00 0.00 0.00 178.15 179.82 2oxf h VAL 2245N 0.81 1.25 -0.32 1.67 3.04 -1.10 -0.05 116.25 121.55 2oxf h VAL 2245Ca 0.21 -1.18 -0.07 0.00 -1.01 0.00 0.00 66.70 64.65 2oxf h VAL 2245Cb 0.05 1.19 -0.01 0.00 -2.01 0.00 0.00 31.29 30.51 2oxf h VAL 2245CO -0.03 0.39 -0.06 0.58 -1.01 0.00 0.00 177.57 177.43 2oxf h VAL 2246N 0.54 1.28 0.00 1.51 2.07 -1.20 -1.00 116.25 119.45 2oxf h VAL 2246Ca 0.09 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.46 2oxf h VAL 2246Cb 0.60 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2oxf h VAL 2246CO 0.04 0.35 -0.29 -0.33 0.02 0.00 0.00 177.57 177.37 2oxf h GLU 2247N 0.38 0.00 -0.28 1.57 4.39 -0.85 -1.79 114.58 118.00 2oxf h GLU 2247Ca 0.08 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.62 2oxf h GLU 2247Cb 0.55 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2oxf h GLU 2247CO 0.03 0.29 -0.45 0.00 -1.16 0.00 0.00 179.01 177.72 2oxf h ALA 2248N 1.71 0.43 -0.57 3.43 0.00 -0.87 -3.08 119.26 120.32 2oxf h ALA 2248Ca -0.00 -0.47 0.06 0.00 0.00 0.00 0.00 54.91 54.50 2oxf h ALA 2248Cb 0.67 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 2oxf h ALA 2248CO 0.04 0.57 0.27 0.00 0.00 0.00 0.00 179.25 180.13 2oxf h ALA 2249N 0.68 0.74 -0.81 0.00 0.00 -0.67 -1.38 119.26 117.81 2oxf h ALA 2249Ca 0.02 0.04 0.12 0.00 0.00 0.00 0.00 54.91 55.09 2oxf h ALA 2249Cb 1.05 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.71 2oxf h ALA 2249CO 0.10 -0.10 0.43 -0.09 0.00 0.00 0.00 179.25 179.59 2oxf h ARG 2250N 0.51 0.65 0.00 0.00 2.43 -1.30 -0.88 114.38 115.78 2oxf h ARG 2250Ca 0.26 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 2oxf h ARG 2250Cb 0.22 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2oxf h ARG 2250CO -0.21 0.43 0.00 0.00 -1.51 0.00 0.00 179.97 178.68 2oxf h ARG 2251N 0.67 0.00 -0.06 0.20 3.08 -1.17 -3.12 114.38 113.98 2oxf h ARG 2251Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2oxf h ARG 2251Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2oxf h ARG 2251CO -0.31 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 179.87 2oxf n LEU 2252N -2.42 2.70 -0.11 3.04 4.77 -0.35 -5.07 117.00 119.55 2oxf n LEU 2252Ca 0.02 -1.05 0.16 0.00 -0.03 0.00 0.00 56.01 55.10 2oxf n LEU 2252Cb 0.25 -0.02 0.85 0.00 -2.33 0.00 0.00 43.42 42.17 2oxf n LEU 2252CO 0.22 0.48 1.05 0.18 -1.33 0.00 0.00 177.39 177.99