#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sj9 n ASP 2005N 0.00 2.07 -3.69 6.43 8.00 -1.12 -4.86 116.55 123.37 1sj9 n ASP 2005Ca 0.00 -1.55 -0.15 0.00 0.71 0.00 0.00 54.79 53.81 1sj9 n ASP 2005Cb 0.00 0.22 -0.14 0.00 -0.02 0.00 0.00 41.12 41.17 1sj9 n ASP 2005CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1sj9 s VAL 2006N -2.28 -0.21 -0.10 2.53 1.01 -0.54 -4.96 120.40 115.85 1sj9 s VAL 2006Ca 0.25 0.27 0.16 0.00 0.00 0.00 0.00 61.98 62.66 1sj9 s VAL 2006Cb 0.19 -0.32 -0.24 0.00 0.00 0.00 0.00 36.38 36.01 1sj9 s VAL 2006CO 0.45 0.11 0.22 0.33 0.00 0.00 0.00 175.10 176.21 1sj9 n PHE 2007N 4.90 0.00 0.40 5.22 -0.00 -1.26 -1.49 117.46 125.23 1sj9 n PHE 2007Ca -0.13 0.00 -0.17 0.00 -0.00 0.00 0.00 57.45 57.15 1sj9 n PHE 2007Cb 0.51 -0.62 -0.08 0.00 -0.00 0.00 0.00 39.48 39.28 1sj9 n PHE 2007CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1sj9 h HIS 2008N 0.00 -1.09 0.00 -5.13 2.76 -1.97 -3.21 115.15 106.51 1sj9 h HIS 2008Ca -0.23 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1sj9 h HIS 2008Cb 1.44 0.38 0.00 0.00 1.55 0.00 0.00 27.41 30.78 1sj9 h HIS 2008CO 0.00 -0.64 -1.32 1.28 -1.30 0.00 0.00 177.93 175.95 1sj9 n LEU 2009N -5.05 0.52 -2.45 0.26 4.77 -1.26 -4.47 117.00 109.32 1sj9 n LEU 2009Ca -0.13 -0.09 -0.04 0.00 -0.03 0.00 0.00 56.01 55.72 1sj9 n LEU 2009Cb 0.43 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.50 1sj9 n LEU 2009CO 0.31 0.06 0.12 0.61 -1.33 0.00 0.00 177.39 177.16 1sj9 n GLY 2010N 1.35 -0.59 1.35 -0.72 0.00 -0.86 -4.73 105.19 100.99 1sj9 n GLY 2010Ca 0.00 0.20 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 1sj9 n GLY 2010CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1sj9 n LEU 2011N -1.91 0.00 -3.90 0.99 -0.00 -0.55 -4.80 117.00 106.83 1sj9 n LEU 2011Ca -0.02 -0.51 -0.09 0.00 -0.00 0.00 0.00 56.01 55.39 1sj9 n LEU 2011Cb 0.53 0.99 -0.02 0.00 -0.00 0.00 0.00 43.42 44.92 1sj9 n LEU 2011CO 0.32 -0.17 0.39 0.28 -0.00 0.00 0.00 177.39 178.21 1sj9 s THR 2012N -2.39 0.00 0.18 1.47 -1.32 -1.26 -1.47 115.64 110.85 1sj9 s THR 2012Ca 0.08 -1.15 -0.13 0.00 -1.21 0.00 0.00 61.69 59.29 1sj9 s THR 2012Cb -0.01 -2.31 0.08 0.00 -1.51 0.00 0.00 72.50 68.75 1sj9 s THR 2012CO 0.02 0.00 1.78 0.11 -2.21 0.00 0.00 174.62 174.32 1sj9 h LYS 2013N 2.07 0.47 -0.75 7.08 1.57 -1.92 0.22 116.57 125.30 1sj9 h LYS 2013Ca -0.25 -0.03 0.14 0.00 -1.87 0.00 0.00 60.65 58.65 1sj9 h LYS 2013Cb 1.25 -0.11 -0.09 0.00 0.08 0.00 0.00 32.23 33.36 1sj9 h LYS 2013CO 0.31 0.31 0.30 -0.97 -0.57 0.00 0.00 179.45 178.83 1sj9 h ASN 2014N 0.48 0.27 -0.15 0.86 -0.73 -1.96 -0.64 115.58 113.71 1sj9 h ASN 2014Ca 0.23 0.11 -0.01 0.00 1.87 0.00 0.00 56.30 58.50 1sj9 h ASN 2014Cb 0.16 0.09 -0.01 0.00 0.27 0.00 0.00 38.32 38.83 1sj9 h ASN 2014CO -0.17 0.10 0.05 0.44 -0.37 0.00 0.00 177.43 177.48 1sj9 h ASP 2015N 0.44 0.22 0.00 1.15 3.32 -1.51 -2.62 116.42 117.42 1sj9 h ASP 2015Ca 0.41 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1sj9 h ASP 2015Cb 0.62 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1sj9 h ASP 2015CO -0.40 0.37 0.01 0.18 -1.72 0.00 0.00 179.24 177.68 1sj9 n LEU 2016N -4.84 0.00 0.00 1.55 7.99 -0.10 -4.72 117.00 116.88 1sj9 n LEU 2016Ca -0.05 0.05 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 1sj9 n LEU 2016Cb 0.14 -0.05 0.00 0.00 -0.11 0.00 0.00 43.42 43.40 1sj9 n LEU 2016CO 0.35 -0.05 0.00 1.67 -1.51 0.00 0.00 177.39 177.85 1sj9 n GLN 2017N -0.97 0.00 -1.92 3.23 -0.06 -0.99 -2.60 117.38 114.08 1sj9 n GLN 2017Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1sj9 n GLN 2017Cb 0.01 -3.61 0.00 0.00 -4.06 0.00 0.00 30.24 22.58 1sj9 n GLN 2017CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1sj9 n GLY 2018N -2.00 0.76 3.26 1.69 0.00 -1.22 -4.93 105.19 102.75 1sj9 n GLY 2018Ca 0.00 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 1sj9 n GLY 2018CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sj9 s ALA 2019N -2.77 2.17 -1.05 4.61 0.00 -1.07 -4.91 121.76 118.74 1sj9 s ALA 2019Ca 0.00 -1.04 -0.05 0.00 0.00 0.00 0.00 51.96 50.87 1sj9 s ALA 2019Cb 0.00 -0.69 0.29 0.00 0.00 0.00 0.00 23.12 22.71 1sj9 s ALA 2019CO 0.00 0.40 1.23 0.00 0.00 0.00 0.00 175.76 177.39 1sj9 n GLN 2020N 3.01 3.82 0.00 0.00 10.64 -1.26 -3.98 117.38 129.61 1sj9 n GLN 2020Ca -0.18 -4.52 0.00 0.00 -1.83 0.00 0.00 57.00 50.47 1sj9 n GLN 2020Cb 0.52 -2.50 0.00 0.00 -0.86 0.00 0.00 30.24 27.40 1sj9 n GLN 2020CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 1sj9 n LEU 2021N 1.88 0.00 -3.69 2.61 0.00 -1.26 -3.87 117.00 112.67 1sj9 n LEU 2021Ca 0.25 0.00 -0.24 0.00 0.00 0.00 0.00 56.01 56.02 1sj9 n LEU 2021Cb 0.36 0.00 -0.17 0.00 0.00 0.00 0.00 43.42 43.61 1sj9 n LEU 2021CO 0.57 0.00 -0.35 0.00 0.00 0.00 0.00 177.39 177.61 1sj9 s ALA 2022N 0.00 0.55 -0.02 1.96 0.00 0.13 -2.91 121.76 121.47 1sj9 s ALA 2022Ca 0.00 -0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.47 1sj9 s ALA 2022Cb 0.00 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.22 1sj9 s ALA 2022CO 0.00 -0.79 1.14 0.42 0.00 0.00 0.00 175.76 176.53 1sj9 s ILE 2023N 2.05 4.35 -0.20 0.00 1.09 -1.26 -2.17 121.20 125.07 1sj9 s ILE 2023Ca 0.03 1.68 0.01 0.00 -1.10 0.00 0.00 60.65 61.27 1sj9 s ILE 2023Cb -0.14 -4.08 0.04 0.00 -1.06 0.00 0.00 42.46 37.22 1sj9 s ILE 2023CO -0.06 0.06 -0.10 0.68 -0.10 0.00 0.00 174.94 175.42 1sj9 s VAL 2024N 1.63 1.61 0.58 2.92 -7.23 -0.59 -2.36 120.40 116.97 1sj9 s VAL 2024Ca 0.55 -0.99 0.09 0.00 -1.81 0.00 0.00 61.98 59.82 1sj9 s VAL 2024Cb -0.25 -1.69 0.09 0.00 0.56 0.00 0.00 36.38 35.09 1sj9 s VAL 2024CO 0.25 0.16 0.81 -2.16 -0.31 0.00 0.00 175.10 173.84 1sj9 s PRO 2025N 1.41 2.27 -0.11 4.82 0.04 -1.25 -3.13 135.00 139.06 1sj9 s PRO 2025Ca -0.01 -1.62 0.20 0.00 0.04 0.00 0.00 61.00 59.61 1sj9 s PRO 2025Cb -0.16 -2.63 -0.29 0.00 0.04 0.00 0.00 34.50 31.45 1sj9 s PRO 2025CO -0.08 -0.90 0.29 0.41 0.04 0.00 0.00 177.00 176.76 1sj9 n GLY 2026N -2.28 -1.00 3.70 0.56 0.00 -1.25 0.17 105.19 105.09 1sj9 n GLY 2026Ca 0.16 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 1sj9 n GLY 2026CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sj9 s ASP 2027N -5.00 6.84 0.47 1.61 3.68 -1.26 -2.83 116.67 120.19 1sj9 s ASP 2027Ca -0.09 1.02 0.26 0.00 2.13 0.00 0.00 52.55 55.87 1sj9 s ASP 2027Cb 0.10 -2.37 0.67 0.00 -1.45 0.00 0.00 42.92 39.88 1sj9 s ASP 2027CO 0.87 -0.14 1.73 1.55 0.13 0.00 0.00 175.17 179.31 1sj9 h PRO 2028N 6.94 0.00 -0.67 4.34 0.13 -1.91 -3.20 132.00 137.63 1sj9 h PRO 2028Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1sj9 h PRO 2028Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1sj9 h PRO 2028CO 0.76 0.03 0.00 -1.91 -0.23 0.00 0.00 178.00 176.65 1sj9 n GLU 2029N -3.11 2.15 0.00 0.86 2.13 -1.26 -3.50 120.64 117.91 1sj9 n GLU 2029Ca 0.03 -1.06 0.00 0.00 0.66 0.00 0.00 57.16 56.78 1sj9 n GLU 2029Cb 0.46 -1.60 0.00 0.00 0.27 0.00 0.00 31.44 30.58 1sj9 n GLU 2029CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1sj9 n ARG 2030N 0.24 1.14 -0.03 5.31 0.63 -1.21 -4.66 116.66 118.08 1sj9 n ARG 2030Ca 0.09 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.98 1sj9 n ARG 2030Cb 0.47 -0.90 -0.03 0.00 0.45 0.00 0.00 32.46 32.45 1sj9 n ARG 2030CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1sj9 h VAL 2031N 0.00 0.00 -0.92 5.15 2.07 -1.67 0.42 116.25 121.30 1sj9 h VAL 2031Ca 0.00 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.68 1sj9 h VAL 2031Cb 0.00 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.67 1sj9 h VAL 2031CO 0.00 0.00 0.52 -0.08 0.02 0.00 0.00 177.57 178.03 1sj9 h GLU 2032N -0.13 0.70 -0.18 1.57 4.81 -1.88 -0.66 114.58 118.82 1sj9 h GLU 2032Ca 0.02 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.26 1sj9 h GLU 2032Cb 0.18 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 1sj9 h GLU 2032CO -0.17 0.47 0.16 -0.22 -0.73 0.00 0.00 179.01 178.51 1sj9 h LYS 2033N 0.72 0.00 0.06 1.92 3.64 -1.27 -0.28 116.57 121.36 1sj9 h LYS 2033Ca 0.51 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 59.52 1sj9 h LYS 2033Cb 0.71 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.48 1sj9 h LYS 2033CO -0.35 0.00 -2.17 -0.89 -2.27 0.00 0.00 179.45 173.77 1sj9 n ILE 2034N -4.09 1.63 0.29 2.00 5.41 -0.16 -4.15 119.36 120.29 1sj9 n ILE 2034Ca 0.01 -0.66 0.18 0.00 1.00 0.00 0.00 62.75 63.28 1sj9 n ILE 2034Cb 0.29 -1.44 0.81 0.00 -0.71 0.00 0.00 39.64 38.59 1sj9 n ILE 2034CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1sj9 h ALA 2035N 0.23 1.03 -0.22 -1.39 0.00 -0.94 -2.41 119.26 115.55 1sj9 h ALA 2035Ca -0.47 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.30 1sj9 h ALA 2035Cb 2.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 1sj9 h ALA 2035CO 0.02 0.04 -0.33 0.00 0.00 0.00 0.00 179.25 178.98 1sj9 h ALA 2036N 1.97 1.03 -0.00 0.00 0.00 -1.21 -2.21 119.26 118.83 1sj9 h ALA 2036Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1sj9 h ALA 2036Cb 0.38 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1sj9 h ALA 2036CO 0.00 0.59 -0.06 1.28 0.00 0.00 0.00 179.25 181.07 1sj9 n LEU 2037N -4.07 0.29 0.00 0.00 4.32 -0.91 -4.69 117.00 111.93 1sj9 n LEU 2037Ca -0.01 0.08 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 1sj9 n LEU 2037Cb 0.45 -0.18 0.00 0.00 -1.62 0.00 0.00 43.42 42.07 1sj9 n LEU 2037CO 0.43 0.05 0.00 0.23 -1.22 0.00 0.00 177.39 176.88 1sj9 n MET 2038N -1.03 0.00 -3.69 3.23 2.81 -0.83 -5.11 117.12 112.51 1sj9 n MET 2038Ca 0.16 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.94 1sj9 n MET 2038Cb 0.25 0.00 -0.12 0.00 -0.71 0.00 0.00 33.22 32.64 1sj9 n MET 2038CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1sj9 s ASP 2039N -1.00 -0.19 -1.43 7.83 1.01 -0.96 -4.92 116.67 117.00 1sj9 s ASP 2039Ca 0.00 0.75 -0.02 0.00 0.71 0.00 0.00 52.55 54.00 1sj9 s ASP 2039Cb 0.00 0.79 0.01 0.00 1.01 0.00 0.00 42.92 44.73 1sj9 s ASP 2039CO 0.00 -0.21 0.44 0.29 0.21 0.00 0.00 175.17 175.91 1sj9 n LYS 2040N 4.75 -3.28 -2.38 8.23 5.02 -1.26 -2.03 118.16 127.21 1sj9 n LYS 2040Ca -0.17 0.40 -0.42 0.00 -2.02 0.00 0.00 58.31 56.11 1sj9 n LYS 2040Cb 0.52 -4.57 -0.03 0.00 -0.02 0.00 0.00 35.03 30.93 1sj9 n LYS 2040CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1sj9 s PRO 2041N -6.59 4.44 -0.13 1.97 0.04 -1.26 -4.60 135.00 128.86 1sj9 s PRO 2041Ca 0.07 1.84 0.02 0.00 0.04 0.00 0.00 61.00 62.97 1sj9 s PRO 2041Cb -0.04 -3.30 0.01 0.00 0.04 0.00 0.00 34.50 31.22 1sj9 s PRO 2041CO 0.89 -0.21 -0.20 0.54 0.04 0.00 0.00 177.00 178.05 1sj9 s VAL 2042N 0.66 1.93 0.15 -0.36 0.11 -0.31 -4.97 120.40 117.61 1sj9 s VAL 2042Ca 0.57 -0.90 -0.33 0.00 -2.93 0.00 0.00 61.98 58.39 1sj9 s VAL 2042Cb -0.31 -1.72 -0.16 0.00 -1.53 0.00 0.00 36.38 32.65 1sj9 s VAL 2042CO 0.32 0.53 1.12 1.17 -3.33 0.00 0.00 175.10 174.91 1sj9 n LYS 2043N 4.13 0.98 -0.06 1.54 4.81 -1.26 -2.73 118.16 125.56 1sj9 n LYS 2043Ca -0.20 0.35 -0.09 0.00 -0.87 0.00 0.00 58.31 57.50 1sj9 n LYS 2043Cb 0.51 -1.82 -0.05 0.00 0.02 0.00 0.00 35.03 33.69 1sj9 n LYS 2043CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1sj9 n LEU 2044N 2.00 2.57 -3.66 3.14 4.77 -0.99 -4.87 117.00 119.96 1sj9 n LEU 2044Ca 0.16 -0.02 0.03 0.00 -0.03 0.00 0.00 56.01 56.15 1sj9 n LEU 2044Cb 0.23 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1sj9 n LEU 2044CO 0.61 0.60 1.16 0.00 -1.33 0.00 0.00 177.39 178.43 1sj9 s ALA 2045N -2.22 -2.45 -0.47 -1.18 0.00 -1.23 -4.99 121.76 109.22 1sj9 s ALA 2045Ca -0.15 0.72 0.06 0.00 0.00 0.00 0.00 51.96 52.59 1sj9 s ALA 2045Cb 0.04 0.40 0.25 0.00 0.00 0.00 0.00 23.12 23.81 1sj9 s ALA 2045CO 0.25 -1.08 0.83 0.43 0.00 0.00 0.00 175.76 176.19 1sj9 n SER 2046N -0.60 -2.29 0.00 0.00 7.64 -1.26 -3.67 113.62 113.44 1sj9 n SER 2046Ca -0.07 -3.21 0.00 0.00 1.01 0.00 0.00 58.87 56.60 1sj9 n SER 2046Cb 0.63 1.37 0.00 0.00 -1.01 0.00 0.00 64.21 65.20 1sj9 n SER 2046CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1sj9 n HIS 2047N 1.53 0.00 0.00 1.43 8.25 -1.23 -4.99 115.22 120.21 1sj9 n HIS 2047Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 1sj9 n HIS 2047Cb 0.62 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.73 1sj9 n HIS 2047CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1sj9 n ARG 2048N 0.00 2.67 -0.00 -0.41 5.12 -1.26 -4.73 116.66 118.05 1sj9 n ARG 2048Ca 0.00 0.00 0.14 0.00 -1.93 0.00 0.00 57.85 56.06 1sj9 n ARG 2048Cb 0.00 0.00 0.70 0.00 -1.16 0.00 0.00 32.46 32.00 1sj9 n ARG 2048CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1sj9 n GLU 2049N 0.00 1.35 -2.76 5.56 2.13 -1.26 -4.67 120.64 120.99 1sj9 n GLU 2049Ca 0.00 -0.52 -0.43 0.00 0.66 0.00 0.00 57.16 56.88 1sj9 n GLU 2049Cb 0.00 -1.48 -0.04 0.00 0.27 0.00 0.00 31.44 30.20 1sj9 n GLU 2049CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1sj9 s PHE 2050N -1.99 2.75 -0.29 4.31 2.99 -1.26 -4.38 117.98 120.11 1sj9 s PHE 2050Ca 0.42 0.14 0.01 0.00 0.00 0.00 0.00 56.93 57.49 1sj9 s PHE 2050Cb 0.21 -4.20 0.09 0.00 0.00 0.00 0.00 43.02 39.12 1sj9 s PHE 2050CO 0.34 -1.40 0.04 0.99 -0.00 0.00 0.00 175.22 175.19 1sj9 s THR 2051N 4.23 1.36 0.39 0.64 2.01 -1.26 -3.57 115.64 119.44 1sj9 s THR 2051Ca 0.35 -1.51 -0.18 0.00 0.31 0.00 0.00 61.69 60.66 1sj9 s THR 2051Cb -0.11 -1.89 -0.10 0.00 0.01 0.00 0.00 72.50 70.41 1sj9 s THR 2051CO 0.22 -0.46 0.85 -0.94 -0.69 0.00 0.00 174.62 173.59 1sj9 s SER 2052N 1.41 6.84 -0.35 3.53 1.04 -1.24 -2.87 113.70 122.06 1sj9 s SER 2052Ca 0.05 1.48 0.00 0.00 0.48 0.00 0.00 55.95 57.96 1sj9 s SER 2052Cb -0.18 -2.46 0.14 0.00 0.10 0.00 0.00 66.02 63.62 1sj9 s SER 2052CO -0.15 -0.30 0.23 0.26 0.98 0.00 0.00 173.24 174.27 1sj9 s TRP 2053N -2.12 0.44 0.92 5.02 0.52 0.79 -2.34 118.94 122.17 1sj9 s TRP 2053Ca 0.58 -1.35 -0.10 0.00 0.02 0.00 0.00 56.10 55.25 1sj9 s TRP 2053Cb -0.10 -0.80 0.14 0.00 -1.15 0.00 0.00 33.47 31.57 1sj9 s TRP 2053CO 0.16 -0.86 1.07 -2.13 0.02 0.00 0.00 176.95 175.22 1sj9 n ARG 2054N 4.25 -0.45 0.00 4.98 0.63 -1.11 -3.07 116.66 121.89 1sj9 n ARG 2054Ca 0.10 -0.07 0.00 0.00 -0.92 0.00 0.00 57.85 56.96 1sj9 n ARG 2054Cb 0.39 -2.33 0.00 0.00 0.45 0.00 0.00 32.46 30.98 1sj9 n ARG 2054CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1sj9 n ALA 2055N -4.20 0.00 -3.61 5.13 0.00 0.22 -1.16 120.51 116.88 1sj9 n ALA 2055Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.41 1sj9 n ALA 2055Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 1sj9 n ALA 2055CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1sj9 s GLU 2056N 1.47 0.87 -0.03 0.00 -6.30 -0.86 -2.62 118.70 111.24 1sj9 s GLU 2056Ca 0.00 0.87 0.01 0.00 -2.50 0.00 0.00 54.97 53.34 1sj9 s GLU 2056Cb 0.00 0.42 0.02 0.00 0.00 0.00 0.00 34.13 34.58 1sj9 s GLU 2056CO 0.00 -0.14 -0.01 -1.17 0.02 0.00 0.00 175.26 173.96 1sj9 s LEU 2057N 0.11 1.26 -0.40 2.70 1.98 0.76 -2.27 118.68 122.83 1sj9 s LEU 2057Ca -0.02 -0.05 0.00 0.00 -2.89 0.00 0.00 54.13 51.18 1sj9 s LEU 2057Cb -0.04 -0.25 0.00 0.00 0.66 0.00 0.00 46.19 46.56 1sj9 s LEU 2057CO 0.02 -0.08 0.00 0.47 -1.89 0.00 0.00 176.35 174.87 1sj9 n ASP 2058N 4.02 -2.08 0.00 3.68 10.43 -1.26 -0.87 116.55 130.47 1sj9 n ASP 2058Ca -0.26 0.38 0.00 0.00 2.57 0.00 0.00 54.79 57.48 1sj9 n ASP 2058Cb 0.51 -1.87 0.00 0.00 1.84 0.00 0.00 41.12 41.60 1sj9 n ASP 2058CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1sj9 n GLY 2059N -0.61 0.91 2.89 0.44 0.00 -1.26 -5.09 105.19 102.47 1sj9 n GLY 2059Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 1sj9 n GLY 2059CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sj9 s LYS 2060N -1.00 0.07 0.59 1.61 3.01 -0.05 -5.15 119.74 118.82 1sj9 s LYS 2060Ca 0.00 -0.11 -0.19 0.00 -1.01 0.00 0.00 55.97 54.65 1sj9 s LYS 2060Cb 0.00 0.01 -0.04 0.00 -1.01 0.00 0.00 37.83 36.79 1sj9 s LYS 2060CO 0.00 -0.01 1.24 0.00 0.51 0.00 0.00 175.35 177.09 1sj9 s ALA 2061N -0.26 2.58 0.02 5.17 0.00 -1.26 -0.17 121.76 127.83 1sj9 s ALA 2061Ca -0.03 1.07 -0.08 0.00 0.00 0.00 0.00 51.96 52.93 1sj9 s ALA 2061Cb -0.02 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1sj9 s ALA 2061CO -0.00 -1.22 0.15 0.14 0.00 0.00 0.00 175.76 174.83 1sj9 s VAL 2062N -1.52 0.10 -0.48 0.00 -7.23 -1.08 -4.52 120.40 105.66 1sj9 s VAL 2062Ca 0.77 -0.80 0.04 0.00 -1.81 0.00 0.00 61.98 60.17 1sj9 s VAL 2062Cb -0.32 -0.64 0.17 0.00 0.56 0.00 0.00 36.38 36.14 1sj9 s VAL 2062CO 0.36 -0.44 0.37 -0.63 -0.31 0.00 0.00 175.10 174.45 1sj9 s ILE 2063N -1.89 0.96 0.04 -0.62 1.09 -1.15 -0.61 121.20 119.02 1sj9 s ILE 2063Ca -0.11 -3.01 -0.34 0.00 -1.10 0.00 0.00 60.65 56.09 1sj9 s ILE 2063Cb -0.05 -1.65 -0.13 0.00 -1.06 0.00 0.00 42.46 39.57 1sj9 s ILE 2063CO -0.01 -1.17 1.72 0.52 -0.10 0.00 0.00 174.94 175.90 1sj9 n VAL 2064N 2.68 0.28 -3.75 2.92 0.31 -1.18 -4.39 118.33 115.20 1sj9 n VAL 2064Ca 0.27 -0.05 -0.23 0.00 -0.01 0.00 0.00 64.34 64.31 1sj9 n VAL 2064Cb 0.44 -1.68 -0.17 0.00 -0.91 0.00 0.00 33.84 31.51 1sj9 n VAL 2064CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1sj9 n SER 2066N 5.16 0.96 -0.00 0.00 2.88 -1.14 -3.77 113.62 117.71 1sj9 n SER 2066Ca -0.07 0.93 0.05 0.00 -1.33 0.00 0.00 58.87 58.45 1sj9 n SER 2066Cb 0.50 -1.36 -0.07 0.00 -0.75 0.00 0.00 64.21 62.53 1sj9 n SER 2066CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1sj9 n THR 2067N -1.00 0.00 0.00 2.46 5.66 0.46 -3.99 114.28 117.87 1sj9 n THR 2067Ca 0.11 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 1sj9 n THR 2067Cb 0.43 0.46 0.00 0.00 -1.55 0.00 0.00 70.33 69.67 1sj9 n THR 2067CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1sj9 n GLY 2068N 1.78 -0.43 3.70 1.09 0.00 -1.13 -2.73 105.19 107.48 1sj9 n GLY 2068Ca -0.01 -1.77 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 1sj9 n GLY 2068CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sj9 s ILE 2069N -1.55 5.09 0.00 -0.61 1.09 -1.26 -4.59 121.20 119.37 1sj9 s ILE 2069Ca 0.00 1.22 0.00 0.00 -1.10 0.00 0.00 60.65 60.77 1sj9 s ILE 2069Cb 0.00 -3.94 0.00 0.00 -1.06 0.00 0.00 42.46 37.46 1sj9 s ILE 2069CO 0.00 0.24 0.00 0.61 -0.10 0.00 0.00 174.94 175.69 1sj9 n GLY 2070N 3.34 0.37 0.39 6.18 0.00 -1.26 -4.42 105.19 109.78 1sj9 n GLY 2070Ca -0.03 -1.44 0.20 0.00 0.00 0.00 0.00 46.02 44.74 1sj9 n GLY 2070CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1sj9 h GLY 2071N 0.00 0.22 2.00 -0.02 0.00 -1.87 0.06 103.07 103.46 1sj9 h GLY 2071Ca 0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 47.33 47.19 1sj9 h GLY 2071CO 0.00 0.02 -0.41 -0.56 0.00 0.00 0.00 176.54 175.58 1sj9 h PRO 2072N 0.13 0.00 0.42 4.80 0.13 -1.94 0.46 132.00 135.99 1sj9 h PRO 2072Ca 0.31 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.42 1sj9 h PRO 2072Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1sj9 h PRO 2072CO -0.04 0.41 -0.20 1.03 -0.23 0.00 0.00 178.00 178.97 1sj9 h SER 2073N 0.00 -0.47 -0.01 1.44 0.87 -1.24 -3.20 113.55 110.93 1sj9 h SER 2073Ca -0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1sj9 h SER 2073Cb 1.02 0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1sj9 h SER 2073CO 0.05 -0.06 0.01 0.74 -0.53 0.00 0.00 176.83 177.04 1sj9 h THR 2074N -1.00 0.69 0.59 2.23 2.02 -1.05 -2.77 112.91 113.63 1sj9 h THR 2074Ca -0.06 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 1sj9 h THR 2074Cb 0.55 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 1sj9 h THR 2074CO 0.09 0.00 -0.51 0.28 0.37 0.00 0.00 175.52 175.75 1sj9 h SER 2075N 0.00 -1.37 0.05 4.18 0.02 -0.89 -0.97 113.55 114.57 1sj9 h SER 2075Ca 0.01 0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1sj9 h SER 2075Cb 0.03 0.44 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 1sj9 h SER 2075CO -0.00 -0.70 -0.32 0.40 -1.14 0.00 0.00 176.83 175.07 1sj9 h ILE 2076N -1.08 0.00 0.00 3.27 1.08 -1.55 0.11 117.51 119.35 1sj9 h ILE 2076Ca -0.08 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.39 1sj9 h ILE 2076Cb 0.91 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.66 1sj9 h ILE 2076CO -0.02 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.44 1sj9 n ALA 2077N -2.75 0.00 -0.35 1.87 0.00 -1.07 -0.94 120.51 117.28 1sj9 n ALA 2077Ca -0.05 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.56 1sj9 n ALA 2077Cb 0.24 0.14 0.38 0.00 0.00 0.00 0.00 19.45 20.21 1sj9 n ALA 2077CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sj9 h VAL 2078N 0.00 0.59 -0.38 0.00 2.07 -1.20 -2.08 116.25 115.25 1sj9 h VAL 2078Ca 0.00 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.32 1sj9 h VAL 2078Cb 0.00 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 29.66 1sj9 h VAL 2078CO 0.00 0.11 0.22 -0.08 0.02 0.00 0.00 177.57 177.84 1sj9 h GLU 2079N 0.63 0.43 0.02 1.57 4.57 0.11 -1.33 114.58 120.57 1sj9 h GLU 2079Ca 0.62 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.69 1sj9 h GLU 2079Cb 1.14 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 29.64 1sj9 h GLU 2079CO -0.43 0.28 -0.32 0.93 -1.18 0.00 0.00 179.01 178.30 1sj9 h GLU 2080N 0.44 0.18 -0.89 1.92 5.08 -0.70 -2.96 114.58 117.66 1sj9 h GLU 2080Ca 0.15 -0.22 0.20 0.00 -1.00 0.00 0.00 59.36 58.49 1sj9 h GLU 2080Cb 0.02 0.07 -0.11 0.00 0.50 0.00 0.00 28.75 29.23 1sj9 h GLU 2080CO -0.08 0.99 0.43 -0.07 -1.00 0.00 0.00 179.01 179.28 1sj9 h LEU 2081N -0.53 0.45 -0.41 1.33 3.38 -1.40 -1.81 115.31 116.33 1sj9 h LEU 2081Ca -0.04 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1sj9 h LEU 2081Cb 1.11 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1sj9 h LEU 2081CO 0.06 0.10 0.11 0.00 0.09 0.00 0.00 178.44 178.80 1sj9 h ALA 2082N 1.66 0.54 -0.05 1.53 0.00 -1.26 -1.86 119.26 119.81 1sj9 h ALA 2082Ca 0.53 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1sj9 h ALA 2082Cb 0.93 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1sj9 h ALA 2082CO -0.46 0.20 0.00 0.00 0.00 0.00 0.00 179.25 178.99 1sj9 n GLN 2083N -4.57 1.19 -0.00 0.00 10.64 -0.73 -1.51 117.38 122.40 1sj9 n GLN 2083Ca -0.00 -0.20 0.04 0.00 -1.83 0.00 0.00 57.00 55.00 1sj9 n GLN 2083Cb 0.19 -1.27 -0.06 0.00 -0.86 0.00 0.00 30.24 28.24 1sj9 n GLN 2083CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 1sj9 n LEU 2084N -0.17 0.08 0.00 2.61 7.94 -0.76 -4.94 117.00 121.76 1sj9 n LEU 2084Ca 0.02 -0.11 0.00 0.00 -1.11 0.00 0.00 56.01 54.81 1sj9 n LEU 2084Cb 0.17 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.12 1sj9 n LEU 2084CO 0.02 0.02 0.00 0.61 -1.11 0.00 0.00 177.39 176.93 1sj9 n GLY 2085N 1.87 3.03 3.56 -3.96 0.00 -0.57 -4.39 105.19 104.73 1sj9 n GLY 2085Ca -0.01 -0.42 -0.54 0.00 0.00 0.00 0.00 46.02 45.05 1sj9 n GLY 2085CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1sj9 n ILE 2086N 0.00 0.09 -0.20 -0.61 2.08 -1.16 -4.62 119.36 114.95 1sj9 n ILE 2086Ca 0.00 -0.02 0.00 0.00 0.56 0.00 0.00 62.75 63.29 1sj9 n ILE 2086Cb 0.00 -0.56 0.00 0.00 -0.75 0.00 0.00 39.64 38.33 1sj9 n ILE 2086CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1sj9 n ARG 2087N 2.13 0.92 -3.75 0.38 5.12 -1.25 -4.37 116.66 115.83 1sj9 n ARG 2087Ca 0.19 -0.88 -0.14 0.00 -1.93 0.00 0.00 57.85 55.08 1sj9 n ARG 2087Cb 0.16 -0.90 -0.15 0.00 -1.16 0.00 0.00 32.46 30.41 1sj9 n ARG 2087CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1sj9 s THR 2088N -0.43 -0.05 -0.03 0.55 2.01 -1.25 -0.87 115.64 115.57 1sj9 s THR 2088Ca 0.00 0.19 0.04 0.00 0.31 0.00 0.00 61.69 62.23 1sj9 s THR 2088Cb 0.00 -0.19 -0.00 0.00 0.01 0.00 0.00 72.50 72.31 1sj9 s THR 2088CO 0.00 0.08 -0.14 -0.36 -0.69 0.00 0.00 174.62 173.51 1sj9 s PHE 2089N 1.14 1.35 -0.27 4.92 0.40 0.37 0.19 117.98 126.08 1sj9 s PHE 2089Ca -0.09 -0.34 -0.01 0.00 -0.60 0.00 0.00 56.93 55.90 1sj9 s PHE 2089Cb -0.12 -0.91 0.08 0.00 0.51 0.00 0.00 43.02 42.58 1sj9 s PHE 2089CO -0.05 -0.10 0.06 -0.51 0.70 0.00 0.00 175.22 175.31 1sj9 s LEU 2090N -0.02 2.21 0.10 -0.37 1.43 -0.92 0.85 118.68 121.95 1sj9 s LEU 2090Ca -0.01 -1.41 -0.28 0.00 -1.03 0.00 0.00 54.13 51.40 1sj9 s LEU 2090Cb -0.09 -0.90 -0.06 0.00 0.03 0.00 0.00 46.19 45.17 1sj9 s LEU 2090CO 0.01 -0.36 0.88 -0.60 0.23 0.00 0.00 176.35 176.50 1sj9 s ARG 2091N 1.59 4.63 -0.04 1.70 3.52 -0.01 -1.53 118.95 128.81 1sj9 s ARG 2091Ca 0.05 1.29 0.01 0.00 -0.13 0.00 0.00 55.73 56.96 1sj9 s ARG 2091Cb -0.18 -3.36 0.02 0.00 -1.56 0.00 0.00 34.95 29.88 1sj9 s ARG 2091CO -0.17 0.29 -0.06 -1.50 -0.81 0.00 0.00 175.30 173.05 1sj9 s ILE 2092N -0.19 0.60 0.00 4.11 2.07 -1.18 -0.52 121.20 126.08 1sj9 s ILE 2092Ca 0.43 -0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.48 1sj9 s ILE 2092Cb -0.22 -0.60 0.00 0.00 0.13 0.00 0.00 42.46 41.77 1sj9 s ILE 2092CO 0.27 0.23 0.00 0.61 -1.91 0.00 0.00 174.94 174.14 1sj9 n GLY 2093N 3.85 1.54 3.89 1.50 0.00 -1.17 -3.95 105.19 110.85 1sj9 n GLY 2093Ca -0.24 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 1sj9 n GLY 2093CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sj9 s THR 2094N -2.53 5.11 -0.01 2.61 -4.23 -1.26 -1.95 115.64 113.38 1sj9 s THR 2094Ca 0.00 0.21 -0.17 0.00 -1.18 0.00 0.00 61.69 60.55 1sj9 s THR 2094Cb 0.00 -3.63 0.03 0.00 1.34 0.00 0.00 72.50 70.24 1sj9 s THR 2094CO 0.00 0.08 0.36 0.28 -0.54 0.00 0.00 174.62 174.81 1sj9 s THR 2095N -1.62 0.05 -0.20 3.99 -1.32 -1.09 -4.85 115.64 110.60 1sj9 s THR 2095Ca 0.40 -0.43 -0.12 0.00 -1.21 0.00 0.00 61.69 60.33 1sj9 s THR 2095Cb -0.12 -0.72 -0.05 0.00 -1.51 0.00 0.00 72.50 70.10 1sj9 s THR 2095CO 0.22 -0.24 0.22 -0.83 -2.21 0.00 0.00 174.62 171.79 1sj9 s GLY 2096N -1.43 2.08 0.12 6.08 0.00 -1.08 -2.14 107.32 110.96 1sj9 s GLY 2096Ca -0.12 -0.65 -0.08 0.00 0.00 0.00 0.00 44.72 43.88 1sj9 s GLY 2096CO 0.04 0.38 0.41 0.00 0.00 0.00 0.00 173.10 173.92 1sj9 s ALA 2097N 0.68 3.73 -0.25 3.20 0.00 -0.81 0.99 121.76 129.31 1sj9 s ALA 2097Ca 0.12 -0.43 -0.10 0.00 0.00 0.00 0.00 51.96 51.54 1sj9 s ALA 2097Cb -0.13 -2.24 -0.16 0.00 0.00 0.00 0.00 23.12 20.60 1sj9 s ALA 2097CO 0.03 0.60 -0.15 -0.89 0.00 0.00 0.00 175.76 175.34 1sj9 n ILE 2098N 0.45 1.55 -1.84 0.00 5.41 -1.20 -1.13 119.36 122.60 1sj9 n ILE 2098Ca -0.05 -0.40 -0.41 0.00 1.00 0.00 0.00 62.75 62.89 1sj9 n ILE 2098Cb 0.52 -1.77 -0.01 0.00 -0.71 0.00 0.00 39.64 37.67 1sj9 n ILE 2098CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 1sj9 s GLN 2099N -2.49 4.15 0.34 0.38 -1.52 -1.26 -4.73 119.66 114.53 1sj9 s GLN 2099Ca -0.34 2.51 0.02 0.00 -1.95 0.00 0.00 55.36 55.60 1sj9 s GLN 2099Cb 0.11 -3.01 0.60 0.00 -0.22 0.00 0.00 33.01 30.49 1sj9 s GLN 2099CO 0.57 -0.53 2.00 -1.35 -0.25 0.00 0.00 175.29 175.73 1sj9 h PRO 2100N 3.91 0.87 0.00 2.91 0.11 -1.94 -2.93 132.00 134.92 1sj9 h PRO 2100Ca -0.49 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1sj9 h PRO 2100Cb 1.23 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1sj9 h PRO 2100CO 0.71 0.58 -0.34 0.72 -0.21 0.00 0.00 178.00 179.47 1sj9 n HIS 2101N -4.43 0.57 -2.52 0.65 8.25 -1.26 -4.76 115.22 111.72 1sj9 n HIS 2101Ca 0.07 0.17 -0.43 0.00 -0.26 0.00 0.00 57.72 57.27 1sj9 n HIS 2101Cb 0.05 -0.70 -0.02 0.00 1.12 0.00 0.00 29.99 30.43 1sj9 n HIS 2101CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1sj9 s ILE 2102N -3.11 4.41 0.13 1.59 1.09 -1.11 -5.01 121.20 119.19 1sj9 s ILE 2102Ca 0.09 1.71 0.03 0.00 -1.10 0.00 0.00 60.65 61.39 1sj9 s ILE 2102Cb 0.14 -4.10 -0.04 0.00 -1.06 0.00 0.00 42.46 37.40 1sj9 s ILE 2102CO 0.66 -0.06 0.19 0.20 -0.10 0.00 0.00 174.94 175.83 1sj9 s ASN 2103N 1.50 5.93 0.23 3.58 -0.87 -1.26 -4.93 114.94 119.13 1sj9 s ASN 2103Ca 0.53 0.05 -0.31 0.00 -1.57 0.00 0.00 52.86 51.56 1sj9 s ASN 2103Cb -0.21 -1.69 -0.11 0.00 -0.02 0.00 0.00 41.25 39.22 1sj9 s ASN 2103CO 0.17 0.09 1.59 -0.69 -2.57 0.00 0.00 177.10 175.70 1sj9 s VAL 2104N -1.66 2.29 0.00 1.60 1.01 -1.26 -1.19 120.40 121.18 1sj9 s VAL 2104Ca 0.33 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.53 1sj9 s VAL 2104Cb -0.11 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1sj9 s VAL 2104CO 0.26 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1sj9 n GLY 2105N 2.99 2.64 3.59 4.51 0.00 -0.13 -4.99 105.19 113.81 1sj9 n GLY 2105Ca 0.11 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1sj9 n GLY 2105CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sj9 n ASP 2106N 0.12 0.39 -4.76 1.61 10.43 -0.34 -4.68 116.55 119.32 1sj9 n ASP 2106Ca 0.00 0.73 -0.35 0.00 2.57 0.00 0.00 54.79 57.74 1sj9 n ASP 2106Cb 0.00 -1.37 -0.08 0.00 1.84 0.00 0.00 41.12 41.51 1sj9 n ASP 2106CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1sj9 s VAL 2107N -1.67 4.73 -0.06 2.53 0.11 0.02 -2.35 120.40 123.70 1sj9 s VAL 2107Ca 0.74 -0.21 0.05 0.00 -2.93 0.00 0.00 61.98 59.63 1sj9 s VAL 2107Cb -0.38 -3.07 -0.00 0.00 -1.53 0.00 0.00 36.38 31.39 1sj9 s VAL 2107CO 0.49 0.51 -0.21 -0.76 -3.33 0.00 0.00 175.10 171.80 1sj9 s LEU 2108N -1.24 1.99 -0.12 2.54 1.43 0.69 -1.80 118.68 122.16 1sj9 s LEU 2108Ca 0.17 -0.45 -0.01 0.00 -1.03 0.00 0.00 54.13 52.82 1sj9 s LEU 2108Cb -0.12 -1.20 -0.02 0.00 0.03 0.00 0.00 46.19 44.88 1sj9 s LEU 2108CO 0.07 0.18 -0.11 -0.69 0.23 0.00 0.00 176.35 176.04 1sj9 s VAL 2109N 0.05 3.27 -0.25 -1.59 1.01 -0.28 -0.31 120.40 122.31 1sj9 s VAL 2109Ca -0.07 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.18 1sj9 s VAL 2109Cb -0.14 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1sj9 s VAL 2109CO 0.04 0.53 0.31 -0.89 0.00 0.00 0.00 175.10 175.09 1sj9 s THR 2110N 0.18 5.23 -0.17 3.92 2.01 -0.98 -2.08 115.64 123.76 1sj9 s THR 2110Ca -0.06 0.46 -0.19 0.00 0.31 0.00 0.00 61.69 62.21 1sj9 s THR 2110Cb -0.15 -3.64 -0.16 0.00 0.01 0.00 0.00 72.50 68.56 1sj9 s THR 2110CO 0.04 0.22 0.27 0.71 -0.69 0.00 0.00 174.62 175.18 1sj9 h THR 2111N 5.25 0.90 -3.43 -0.82 1.35 -1.50 -3.41 112.91 111.26 1sj9 h THR 2111Ca -0.34 -1.91 -0.05 0.00 -0.55 0.00 0.00 66.41 63.56 1sj9 h THR 2111Cb 1.17 1.94 -0.12 0.00 -1.73 0.00 0.00 68.15 69.40 1sj9 h THR 2111CO 0.64 0.31 -0.08 0.00 -0.25 0.00 0.00 175.52 176.14 1sj9 s ALA 2112N -2.41 -0.83 0.10 6.62 0.00 -1.26 0.67 121.76 124.66 1sj9 s ALA 2112Ca -0.21 -0.18 0.03 0.00 0.00 0.00 0.00 51.96 51.60 1sj9 s ALA 2112Cb 0.02 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 1sj9 s ALA 2112CO 0.49 -0.68 -0.09 -1.54 0.00 0.00 0.00 175.76 173.95 1sj9 s SER 2113N -2.84 1.35 0.26 0.00 1.04 -0.59 -1.40 113.70 111.53 1sj9 s SER 2113Ca 0.06 -0.86 -0.29 0.00 0.48 0.00 0.00 55.95 55.33 1sj9 s SER 2113Cb 0.01 0.03 -0.09 0.00 0.10 0.00 0.00 66.02 66.07 1sj9 s SER 2113CO -0.09 -0.32 1.20 -0.69 0.98 0.00 0.00 173.24 174.33 1sj9 s VAL 2114N -2.73 3.27 -0.48 5.02 1.01 0.28 -4.50 120.40 122.26 1sj9 s VAL 2114Ca 0.07 1.19 -0.22 0.00 0.00 0.00 0.00 61.98 63.02 1sj9 s VAL 2114Cb -0.01 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.65 1sj9 s VAL 2114CO -0.01 0.25 0.75 -0.13 0.00 0.00 0.00 175.10 175.96 1sj9 s ARG 2115N -1.08 3.30 -0.19 2.72 0.52 -1.26 -2.36 118.95 120.60 1sj9 s ARG 2115Ca 0.49 -0.36 0.15 0.00 -0.52 0.00 0.00 55.73 55.49 1sj9 s ARG 2115Cb -0.35 -4.00 0.45 0.00 0.52 0.00 0.00 34.95 31.57 1sj9 s ARG 2115CO 0.43 -1.19 1.19 1.28 0.02 0.00 0.00 175.30 177.02 1sj9 n LEU 2116N 6.67 2.77 0.00 2.53 4.77 -0.26 -5.01 117.00 128.47 1sj9 n LEU 2116Ca -0.01 -3.60 0.00 0.00 -0.03 0.00 0.00 56.01 52.37 1sj9 n LEU 2116Cb 0.47 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1sj9 n LEU 2116CO 0.58 1.35 0.00 -0.90 -1.33 0.00 0.00 177.39 177.08 1sj9 n ASP 2117N -0.60 1.59 0.00 -1.43 3.85 -1.24 -0.25 116.55 118.46 1sj9 n ASP 2117Ca 0.21 -0.31 0.00 0.00 -0.71 0.00 0.00 54.79 53.98 1sj9 n ASP 2117Cb 0.87 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.64 1sj9 n ASP 2117CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1sj9 n GLY 2118N 3.97 0.00 0.35 6.12 0.00 -1.26 -4.78 105.19 109.59 1sj9 n GLY 2118Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1sj9 n GLY 2118CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sj9 h ALA 2119N 0.00 1.46 -0.88 4.61 0.00 -1.99 -0.72 119.26 121.74 1sj9 h ALA 2119Ca 0.00 -0.05 0.23 0.00 0.00 0.00 0.00 54.91 55.08 1sj9 h ALA 2119Cb 0.38 -0.31 -0.13 0.00 0.00 0.00 0.00 17.79 17.74 1sj9 h ALA 2119CO 0.00 0.50 0.31 1.03 0.00 0.00 0.00 179.25 181.09 1sj9 h SER 2120N 1.03 0.17 1.04 0.00 0.87 -1.86 0.27 113.55 115.06 1sj9 h SER 2120Ca 0.28 0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 61.00 1sj9 h SER 2120Cb -0.11 0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1sj9 h SER 2120CO -0.06 -0.08 -0.05 -0.07 -0.53 0.00 0.00 176.83 176.03 1sj9 h LEU 2121N 0.30 0.00 -0.36 2.23 3.38 -1.30 -1.34 115.31 118.22 1sj9 h LEU 2121Ca 0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.52 1sj9 h LEU 2121Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1sj9 h LEU 2121CO -0.59 0.05 0.00 1.41 0.09 0.00 0.00 178.44 179.41 1sj9 n HIS 2122N -3.17 0.00 0.00 1.13 8.25 0.94 -3.68 115.22 118.69 1sj9 n HIS 2122Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1sj9 n HIS 2122Cb 0.34 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1sj9 n HIS 2122CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1sj9 n PHE 2123N -0.31 0.00 -3.65 4.41 3.01 -0.71 -5.11 117.46 115.11 1sj9 n PHE 2123Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.31 1sj9 n PHE 2123Cb 0.08 0.05 -0.08 0.00 -0.01 0.00 0.00 39.48 39.53 1sj9 n PHE 2123CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1sj9 s ALA 2124N -1.29 -1.37 0.92 4.37 0.00 -0.59 -4.99 121.76 118.81 1sj9 s ALA 2124Ca 0.00 1.23 -0.12 0.00 0.00 0.00 0.00 51.96 53.07 1sj9 s ALA 2124Cb 0.00 -0.43 0.07 0.00 0.00 0.00 0.00 23.12 22.76 1sj9 s ALA 2124CO 0.00 -0.30 0.67 -2.30 0.00 0.00 0.00 175.76 173.83 1sj9 n PRO 2125N 1.89 -0.27 0.00 0.00 -0.02 -1.26 -4.23 135.00 131.10 1sj9 n PRO 2125Ca -0.17 -0.03 0.13 0.00 -2.02 0.00 0.00 63.50 61.41 1sj9 n PRO 2125Cb 0.56 -2.04 0.69 0.00 -0.02 0.00 0.00 33.50 32.70 1sj9 n PRO 2125CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1sj9 n MET 2126N -2.45 0.50 0.10 -0.52 2.81 -1.26 -1.92 117.12 114.38 1sj9 n MET 2126Ca 0.09 0.03 -0.02 0.00 -1.81 0.00 0.00 57.70 55.99 1sj9 n MET 2126Cb 0.53 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.49 1sj9 n MET 2126CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 1sj9 h GLU 2127N 0.00 0.00 -6.89 0.03 9.09 -2.05 -3.44 114.58 111.32 1sj9 h GLU 2127Ca 0.00 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 58.89 1sj9 h GLU 2127Cb 0.17 0.00 0.06 0.00 -1.65 0.00 0.00 28.75 27.33 1sj9 h GLU 2127CO 0.00 0.72 0.58 0.12 0.05 0.00 0.00 179.01 180.48 1sj9 s PHE 2128N -2.84 3.12 0.44 2.06 2.19 -0.81 -5.00 117.98 117.14 1sj9 s PHE 2128Ca 0.02 1.49 -0.20 0.00 0.33 0.00 0.00 56.93 58.58 1sj9 s PHE 2128Cb 0.09 -3.55 -0.11 0.00 -1.31 0.00 0.00 43.02 38.14 1sj9 s PHE 2128CO 0.78 -1.54 0.95 -1.25 1.83 0.00 0.00 175.22 175.98 1sj9 s PRO 2129N -1.87 4.19 -1.11 10.12 0.04 -1.26 -4.93 135.00 140.17 1sj9 s PRO 2129Ca 0.50 1.09 -0.04 0.00 0.04 0.00 0.00 61.00 62.59 1sj9 s PRO 2129Cb -0.36 -2.18 0.28 0.00 0.04 0.00 0.00 34.50 32.27 1sj9 s PRO 2129CO 0.48 -0.05 1.76 0.00 0.04 0.00 0.00 177.00 179.23 1sj9 n ALA 2130N -0.75 5.73 -2.78 8.56 0.00 -1.26 -4.74 120.51 125.27 1sj9 n ALA 2130Ca 0.07 -4.60 -0.35 0.00 0.00 0.00 0.00 53.44 48.56 1sj9 n ALA 2130Cb 0.54 -2.41 -0.09 0.00 0.00 0.00 0.00 19.45 17.49 1sj9 n ALA 2130CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1sj9 s VAL 2131N -2.82 5.11 0.36 0.00 0.11 -1.26 -1.54 120.40 120.36 1sj9 s VAL 2131Ca 0.38 0.08 -0.26 0.00 -2.93 0.00 0.00 61.98 59.25 1sj9 s VAL 2131Cb 0.12 -3.31 -0.09 0.00 -1.53 0.00 0.00 36.38 31.57 1sj9 s VAL 2131CO -0.01 0.47 1.03 0.00 -3.33 0.00 0.00 175.10 173.26 1sj9 s ALA 2132N 0.20 3.18 0.12 1.54 0.00 0.21 -4.73 121.76 122.28 1sj9 s ALA 2132Ca 0.07 0.69 -0.33 0.00 0.00 0.00 0.00 51.96 52.39 1sj9 s ALA 2132Cb -0.12 -3.26 -0.12 0.00 0.00 0.00 0.00 23.12 19.62 1sj9 s ALA 2132CO -0.00 -0.11 1.74 -3.47 0.00 0.00 0.00 175.76 173.91 1sj9 n ASP 2133N 0.32 3.60 0.04 0.00 -0.08 -0.88 -4.81 116.55 114.75 1sj9 n ASP 2133Ca 0.03 1.03 -0.13 0.00 -1.51 0.00 0.00 54.79 54.21 1sj9 n ASP 2133Cb 0.49 -1.48 -0.06 0.00 2.34 0.00 0.00 41.12 42.41 1sj9 n ASP 2133CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1sj9 h PHE 2134N 7.44 -1.12 -0.67 -0.67 3.57 -1.93 0.95 116.94 124.50 1sj9 h PHE 2134Ca -0.46 0.04 0.15 0.00 3.53 0.00 0.00 57.97 61.23 1sj9 h PHE 2134Cb 1.24 0.50 -0.11 0.00 2.79 0.00 0.00 35.95 40.36 1sj9 h PHE 2134CO 0.72 -0.47 0.01 0.00 -2.23 0.00 0.00 178.31 176.34 1sj9 h ALA 2135N 0.09 0.68 -0.21 2.41 0.00 -1.96 1.56 119.26 121.83 1sj9 h ALA 2135Ca 0.06 0.21 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 1sj9 h ALA 2135Cb 0.62 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1sj9 h ALA 2135CO -0.33 -0.40 -0.47 0.00 0.00 0.00 0.00 179.25 178.04 1sj9 h THR 2137N 0.43 1.19 -0.05 0.00 2.02 0.46 0.08 112.91 117.04 1sj9 h THR 2137Ca 0.02 -0.56 -0.01 0.00 0.77 0.00 0.00 66.41 66.63 1sj9 h THR 2137Cb 0.99 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1sj9 h THR 2137CO 0.09 0.20 0.00 0.71 0.37 0.00 0.00 175.52 176.90 1sj9 h THR 2138N 0.43 1.23 -0.23 3.16 1.35 0.23 0.44 112.91 119.52 1sj9 h THR 2138Ca 0.12 -0.69 0.04 0.00 -0.55 0.00 0.00 66.41 65.34 1sj9 h THR 2138Cb 0.18 1.60 -0.04 0.00 -1.73 0.00 0.00 68.15 68.15 1sj9 h THR 2138CO -0.01 0.19 -0.05 0.00 -0.25 0.00 0.00 175.52 175.40 1sj9 h ALA 2139N 0.74 0.16 0.35 6.62 0.00 0.59 0.32 119.26 128.03 1sj9 h ALA 2139Ca 0.01 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1sj9 h ALA 2139Cb 0.30 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1sj9 h ALA 2139CO 0.00 -0.47 -0.17 -0.07 0.00 0.00 0.00 179.25 178.54 1sj9 h LEU 2140N 0.01 -0.40 -1.27 0.00 3.38 -0.97 0.65 115.31 116.71 1sj9 h LEU 2140Ca 0.11 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.07 1sj9 h LEU 2140Cb 0.16 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 1sj9 h LEU 2140CO -0.23 -0.19 0.52 0.58 0.09 0.00 0.00 178.44 179.21 1sj9 h VAL 2141N -0.59 1.08 0.11 1.22 2.07 -0.74 0.20 116.25 119.60 1sj9 h VAL 2141Ca -0.05 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1sj9 h VAL 2141Cb 0.43 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1sj9 h VAL 2141CO 0.08 0.17 -0.05 -0.08 0.02 0.00 0.00 177.57 177.70 1sj9 h GLU 2142N 0.91 -0.14 0.00 1.57 4.81 -0.11 -2.53 114.58 119.09 1sj9 h GLU 2142Ca 0.33 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.56 1sj9 h GLU 2142Cb 0.15 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 1sj9 h GLU 2142CO -0.11 0.03 -0.03 0.00 -0.73 0.00 0.00 179.01 178.17 1sj9 h ALA 2143N 0.59 1.22 0.16 2.92 0.00 -0.20 -2.75 119.26 121.20 1sj9 h ALA 2143Ca -0.02 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1sj9 h ALA 2143Cb 0.24 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1sj9 h ALA 2143CO 0.02 0.04 -0.28 0.00 0.00 0.00 0.00 179.25 179.04 1sj9 h ALA 2144N 1.97 -0.50 0.00 0.00 0.00 -0.52 -1.72 119.26 118.48 1sj9 h ALA 2144Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1sj9 h ALA 2144Cb 0.15 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1sj9 h ALA 2144CO 0.00 -0.83 0.00 -0.22 0.00 0.00 0.00 179.25 178.21 1sj9 h LYS 2145N -0.52 0.00 0.00 0.00 3.64 -1.52 -3.07 116.57 115.10 1sj9 h LYS 2145Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1sj9 h LYS 2145Cb 0.53 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1sj9 h LYS 2145CO -0.14 0.00 0.00 0.45 -2.27 0.00 0.00 179.45 177.49 1sj9 n SER 2146N -2.86 0.00 0.00 4.20 2.88 -0.65 -2.33 113.62 114.86 1sj9 n SER 2146Ca 0.02 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1sj9 n SER 2146Cb 0.33 -0.29 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 1sj9 n SER 2146CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1sj9 n ILE 2147N -1.29 0.00 -0.02 2.46 2.08 -1.18 -5.05 119.36 116.35 1sj9 n ILE 2147Ca 0.01 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.32 1sj9 n ILE 2147Cb 0.03 0.03 0.00 0.00 -0.75 0.00 0.00 39.64 38.95 1sj9 n ILE 2147CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1sj9 n GLY 2148N 1.00 0.99 3.77 7.39 0.00 -0.98 -5.09 105.19 112.27 1sj9 n GLY 2148Ca 0.00 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1sj9 n GLY 2148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sj9 s ALA 2149N -2.00 2.49 -0.69 4.61 0.00 -1.17 -4.95 121.76 120.06 1sj9 s ALA 2149Ca 0.00 0.52 -0.22 0.00 0.00 0.00 0.00 51.96 52.26 1sj9 s ALA 2149Cb 0.00 -3.31 0.08 0.00 0.00 0.00 0.00 23.12 19.89 1sj9 s ALA 2149CO 0.00 -1.25 0.98 0.99 0.00 0.00 0.00 175.76 176.48 1sj9 s THR 2150N -2.38 4.36 0.38 0.00 2.01 -1.26 -4.73 115.64 114.02 1sj9 s THR 2150Ca 0.66 -0.47 0.07 0.00 0.31 0.00 0.00 61.69 62.26 1sj9 s THR 2150Cb -0.20 -4.70 -0.01 0.00 0.01 0.00 0.00 72.50 67.61 1sj9 s THR 2150CO 0.42 -1.47 0.44 -0.89 -0.69 0.00 0.00 174.62 172.43 1sj9 s THR 2151N 3.95 3.34 -0.13 -0.82 2.01 -1.26 -0.80 115.64 121.93 1sj9 s THR 2151Ca 0.23 -1.15 -0.15 0.00 0.31 0.00 0.00 61.69 60.93 1sj9 s THR 2151Cb -0.16 -3.15 0.04 0.00 0.01 0.00 0.00 72.50 69.24 1sj9 s THR 2151CO 0.08 -0.08 0.41 -1.00 -0.69 0.00 0.00 174.62 173.35 1sj9 s HIS 2152N -2.32 -0.42 -0.01 4.92 3.76 -0.74 -4.91 115.29 115.57 1sj9 s HIS 2152Ca 0.48 0.98 0.08 0.00 -0.15 0.00 0.00 55.06 56.45 1sj9 s HIS 2152Cb -0.08 0.16 -0.02 0.00 1.11 0.00 0.00 32.58 33.75 1sj9 s HIS 2152CO 0.30 -0.27 -0.25 0.08 -0.85 0.00 0.00 174.74 173.75 1sj9 s VAL 2153N -0.10 2.02 -4.93 -0.90 1.01 -1.26 -1.12 120.40 115.12 1sj9 s VAL 2153Ca -0.03 -1.14 0.00 0.00 0.00 0.00 0.00 61.98 60.81 1sj9 s VAL 2153Cb -0.03 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.66 1sj9 s VAL 2153CO 0.02 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1sj9 n GLY 2154N 2.32 -1.35 3.74 4.51 0.00 -0.88 -4.97 105.19 108.56 1sj9 n GLY 2154Ca -0.16 -1.22 -0.41 0.00 0.00 0.00 0.00 46.02 44.23 1sj9 n GLY 2154CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sj9 s VAL 2155N -3.00 3.92 0.22 1.61 1.01 -1.24 -1.21 120.40 121.72 1sj9 s VAL 2155Ca 0.00 1.66 0.08 0.00 0.00 0.00 0.00 61.98 63.72 1sj9 s VAL 2155Cb 0.00 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1sj9 s VAL 2155CO 0.00 0.28 0.03 -0.89 0.00 0.00 0.00 175.10 174.52 1sj9 s THR 2156N -0.22 3.75 -0.30 3.92 2.01 -0.49 -1.19 115.64 123.11 1sj9 s THR 2156Ca 0.49 -1.61 -0.05 0.00 0.31 0.00 0.00 61.69 60.83 1sj9 s THR 2156Cb -0.29 -2.96 0.03 0.00 0.01 0.00 0.00 72.50 69.29 1sj9 s THR 2156CO 0.34 -0.25 0.06 0.00 -0.69 0.00 0.00 174.62 174.08 1sj9 s ALA 2157N -2.03 2.97 -0.59 7.40 0.00 0.63 -0.56 121.76 129.59 1sj9 s ALA 2157Ca 0.30 -1.60 -0.17 0.00 0.00 0.00 0.00 51.96 50.49 1sj9 s ALA 2157Cb -0.08 -2.10 0.13 0.00 0.00 0.00 0.00 23.12 21.07 1sj9 s ALA 2157CO 0.20 -1.10 0.62 -1.12 0.00 0.00 0.00 175.76 174.36 1sj9 s SER 2158N 1.41 6.24 0.15 0.00 0.01 -0.99 -0.92 113.70 119.59 1sj9 s SER 2158Ca -0.00 -1.72 -0.06 0.00 1.31 0.00 0.00 55.95 55.47 1sj9 s SER 2158Cb -0.18 -2.25 -0.06 0.00 0.21 0.00 0.00 66.02 63.74 1sj9 s SER 2158CO 0.01 -0.95 0.40 -0.55 0.41 0.00 0.00 173.24 172.56 1sj9 s SER 2159N 3.50 6.53 0.00 2.44 0.15 0.23 -1.10 113.70 125.44 1sj9 s SER 2159Ca 0.08 0.66 0.09 0.00 0.70 0.00 0.00 55.95 57.48 1sj9 s SER 2159Cb -0.25 -2.12 0.26 0.00 -1.71 0.00 0.00 66.02 62.20 1sj9 s SER 2159CO 0.03 0.05 1.22 0.47 1.20 0.00 0.00 173.24 176.21 1sj9 n ASP 2160N 0.16 1.55 -3.75 5.45 8.00 0.65 -4.01 116.55 124.60 1sj9 n ASP 2160Ca -0.03 -2.00 -0.12 0.00 0.71 0.00 0.00 54.79 53.35 1sj9 n ASP 2160Cb 0.52 -0.19 -0.11 0.00 -0.02 0.00 0.00 41.12 41.31 1sj9 n ASP 2160CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1sj9 s THR 2161N -1.61 -0.01 0.14 -3.53 -4.23 -1.26 -4.99 115.64 100.15 1sj9 s THR 2161Ca 0.19 0.04 -0.11 0.00 -1.18 0.00 0.00 61.69 60.63 1sj9 s THR 2161Cb 0.10 -0.44 -0.03 0.00 1.34 0.00 0.00 72.50 73.47 1sj9 s THR 2161CO 0.13 0.01 1.49 0.15 -0.54 0.00 0.00 174.62 175.87 1sj9 h PHE 2162N 6.10 1.13 0.00 3.99 3.04 -1.95 -3.17 116.94 126.07 1sj9 h PHE 2162Ca -0.30 -0.32 0.00 0.00 3.98 0.00 0.00 57.97 61.33 1sj9 h PHE 2162Cb 1.18 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 39.45 1sj9 h PHE 2162CO 0.38 1.16 -0.00 0.66 -2.02 0.00 0.00 178.31 178.48 1sj9 n TYR 2163N -4.08 0.00 -0.19 0.41 4.02 -1.26 -3.83 117.16 112.22 1sj9 n TYR 2163Ca -0.02 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.82 1sj9 n TYR 2163Cb 0.53 -0.19 0.11 0.00 -0.02 0.00 0.00 39.34 39.77 1sj9 n TYR 2163CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1sj9 h PRO 2164N -0.00 0.99 0.00 -0.72 0.13 -1.80 0.99 132.00 131.59 1sj9 h PRO 2164Ca 0.00 -0.23 -0.05 0.00 -0.87 0.00 0.00 66.00 64.85 1sj9 h PRO 2164Cb 0.00 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 30.99 1sj9 h PRO 2164CO 0.00 0.89 -0.23 0.78 -0.23 0.00 0.00 178.00 179.21 1sj9 h GLY 2165N 1.04 0.00 -1.83 1.56 0.00 -1.83 -2.80 103.07 99.21 1sj9 h GLY 2165Ca 0.20 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.42 1sj9 h GLY 2165CO 0.00 0.00 -0.03 -1.06 0.00 0.00 0.00 176.54 175.46 1sj9 n GLN 2166N -3.32 2.23 -3.50 4.80 6.02 -1.12 -4.82 117.38 117.67 1sj9 n GLN 2166Ca 0.01 -3.02 -0.23 0.00 -0.01 0.00 0.00 57.00 53.75 1sj9 n GLN 2166Cb 0.47 -1.82 0.01 0.00 1.02 0.00 0.00 30.24 29.92 1sj9 n GLN 2166CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1sj9 n GLU 2167N -0.91 -1.33 -4.28 -1.09 2.13 -0.46 -4.92 120.64 109.77 1sj9 n GLU 2167Ca 0.29 0.70 -0.34 0.00 0.66 0.00 0.00 57.16 58.47 1sj9 n GLU 2167Cb 0.98 -1.80 -0.11 0.00 0.27 0.00 0.00 31.44 30.79 1sj9 n GLU 2167CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1sj9 s ARG 2168N -4.07 3.55 -0.02 5.31 0.52 0.33 -5.00 118.95 119.57 1sj9 s ARG 2168Ca 0.05 -0.43 0.15 0.00 -0.52 0.00 0.00 55.73 54.98 1sj9 s ARG 2168Cb -0.01 -2.96 -0.22 0.00 0.52 0.00 0.00 34.95 32.28 1sj9 s ARG 2168CO 0.74 0.40 0.38 0.66 0.02 0.00 0.00 175.30 177.50 1sj9 n TYR 2169N 3.09 0.00 -0.88 -0.53 4.02 -1.26 -4.46 117.16 117.14 1sj9 n TYR 2169Ca -0.18 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.62 1sj9 n TYR 2169Cb 0.53 -0.28 -0.14 0.00 -0.02 0.00 0.00 39.34 39.43 1sj9 n TYR 2169CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1sj9 n ASP 2170N -1.90 5.06 -3.20 7.72 10.43 -1.26 -4.08 116.55 129.31 1sj9 n ASP 2170Ca -0.02 -2.43 -0.10 0.00 2.57 0.00 0.00 54.79 54.81 1sj9 n ASP 2170Cb 0.36 -1.32 0.01 0.00 1.84 0.00 0.00 41.12 42.01 1sj9 n ASP 2170CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1sj9 n THR 2171N 2.35 0.00 0.14 -3.53 -2.24 -1.26 -5.02 114.28 104.72 1sj9 n THR 2171Ca 0.34 -0.90 -0.12 0.00 -2.27 0.00 0.00 64.05 61.11 1sj9 n THR 2171Cb 0.82 -0.40 -0.07 0.00 -2.10 0.00 0.00 70.33 68.58 1sj9 n THR 2171CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1sj9 h TYR 2172N 0.46 -0.98 -0.10 4.78 -0.00 -1.99 -3.26 116.97 115.88 1sj9 h TYR 2172Ca -0.14 0.02 -0.12 0.00 -0.00 0.00 0.00 58.73 58.48 1sj9 h TYR 2172Cb 0.53 0.40 0.00 0.00 -0.00 0.00 0.00 36.73 37.67 1sj9 h TYR 2172CO 0.00 -0.43 -0.42 0.66 -0.00 0.00 0.00 178.16 177.97 1sj9 h SER 2173N -0.60 0.55 0.00 -2.11 4.64 -1.97 -3.48 113.55 110.58 1sj9 h SER 2173Ca -0.02 -0.63 0.00 0.00 -0.47 0.00 0.00 61.79 60.67 1sj9 h SER 2173Cb 0.55 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1sj9 h SER 2173CO -0.11 1.08 0.00 0.61 -0.87 0.00 0.00 176.83 177.54 1sj9 n GLY 2174N 0.65 0.75 3.61 -0.77 0.00 -1.23 -5.07 105.19 103.12 1sj9 n GLY 2174Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 1sj9 n GLY 2174CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1sj9 s ARG 2175N -0.67 2.00 -0.05 1.61 1.04 -1.26 -4.83 118.95 116.80 1sj9 s ARG 2175Ca 0.00 -1.80 0.01 0.00 -1.04 0.00 0.00 55.73 52.90 1sj9 s ARG 2175Cb 0.00 -1.86 0.02 0.00 -2.04 0.00 0.00 34.95 31.06 1sj9 s ARG 2175CO 0.00 0.14 -0.06 0.08 -0.04 0.00 0.00 175.30 175.41 1sj9 s VAL 2176N -2.54 0.67 0.08 4.99 1.01 -1.26 -4.96 120.40 118.39 1sj9 s VAL 2176Ca 0.34 -0.21 -0.37 0.00 0.00 0.00 0.00 61.98 61.74 1sj9 s VAL 2176Cb 0.01 -0.66 -0.17 0.00 0.00 0.00 0.00 36.38 35.56 1sj9 s VAL 2176CO 0.19 0.25 1.35 0.55 0.00 0.00 0.00 175.10 177.44 1sj9 n VAL 2177N 3.93 0.00 -0.50 2.92 3.14 -1.26 -4.50 118.33 122.06 1sj9 n VAL 2177Ca -0.25 -0.00 0.42 0.00 -2.96 0.00 0.00 64.34 61.55 1sj9 n VAL 2177Cb 0.51 -0.84 0.69 0.00 -1.06 0.00 0.00 33.84 33.14 1sj9 n VAL 2177CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 1sj9 n ARG 2178N 2.57 -0.03 -0.18 1.45 1.85 -1.26 0.49 116.66 121.55 1sj9 n ARG 2178Ca 0.18 1.21 -0.00 0.00 -1.00 0.00 0.00 57.85 58.24 1sj9 n ARG 2178Cb 0.19 -2.44 0.09 0.00 -1.05 0.00 0.00 32.46 29.25 1sj9 n ARG 2178CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 1sj9 h ARG 2179N 0.00 0.15 -0.11 2.89 2.43 -2.01 -1.41 114.38 116.32 1sj9 h ARG 2179Ca 0.88 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 60.04 1sj9 h ARG 2179Cb 2.95 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 32.47 1sj9 h ARG 2179CO -0.39 0.10 0.00 1.19 -1.51 0.00 0.00 179.97 179.36 1sj9 n PHE 2180N -5.22 0.12 -2.58 2.20 3.01 0.18 -4.72 117.46 110.46 1sj9 n PHE 2180Ca 0.08 -0.06 -0.42 0.00 1.01 0.00 0.00 57.45 58.05 1sj9 n PHE 2180Cb 0.31 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.75 1sj9 n PHE 2180CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1sj9 s LYS 2181N -1.88 4.47 0.00 -1.08 2.20 -0.53 -3.05 119.74 119.88 1sj9 s LYS 2181Ca 0.34 1.56 0.00 0.00 -0.36 0.00 0.00 55.97 57.51 1sj9 s LYS 2181Cb 0.20 -3.45 0.00 0.00 -1.51 0.00 0.00 37.83 33.07 1sj9 s LYS 2181CO 0.31 -0.21 0.00 0.41 -0.36 0.00 0.00 175.35 175.50 1sj9 n GLY 2182N 3.09 3.14 0.35 5.54 0.00 -1.26 -4.91 105.19 111.15 1sj9 n GLY 2182Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 1sj9 n GLY 2182CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1sj9 h SER 2183N 0.00 -1.19 -0.89 1.61 0.02 -1.82 -0.44 113.55 110.84 1sj9 h SER 2183Ca 0.00 0.27 0.14 0.00 -0.84 0.00 0.00 61.79 61.36 1sj9 h SER 2183Cb 0.00 0.64 -0.09 0.00 0.14 0.00 0.00 62.40 63.09 1sj9 h SER 2183CO 0.00 -0.29 0.50 -0.03 -1.14 0.00 0.00 176.83 175.87 1sj9 h MET 2184N -0.06 0.72 0.05 3.45 -1.53 -1.91 0.77 114.93 116.43 1sj9 h MET 2184Ca 0.32 -0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.54 1sj9 h MET 2184Cb 0.59 -0.16 -0.01 0.00 -0.55 0.00 0.00 31.60 31.47 1sj9 h MET 2184CO -0.86 0.48 -0.05 0.93 0.14 0.00 0.00 176.91 177.55 1sj9 h GLU 2185N 0.74 -0.12 -0.89 0.39 5.08 -1.50 0.47 114.58 118.76 1sj9 h GLU 2185Ca 0.47 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.83 1sj9 h GLU 2185Cb 0.60 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 1sj9 h GLU 2185CO -0.32 -0.08 0.51 1.49 -1.00 0.00 0.00 179.01 179.61 1sj9 h GLU 2186N -0.12 1.22 0.01 2.33 4.81 -0.30 0.16 114.58 122.70 1sj9 h GLU 2186Ca 0.01 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1sj9 h GLU 2186Cb 0.12 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.25 1sj9 h GLU 2186CO -0.02 0.88 -0.00 -1.49 -0.73 0.00 0.00 179.01 177.64 1sj9 h TRP 2187N 1.23 -0.01 -0.24 0.92 -0.00 0.57 0.32 115.95 118.74 1sj9 h TRP 2187Ca 0.31 -0.00 0.06 0.00 -0.00 0.00 0.00 58.89 59.26 1sj9 h TRP 2187Cb -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 29.16 29.10 1sj9 h TRP 2187CO 0.01 0.20 -0.16 0.37 -0.00 0.00 0.00 178.44 178.85 1sj9 h GLN 2188N -0.22 -0.15 -0.73 0.49 4.15 -0.19 -0.87 115.11 117.60 1sj9 h GLN 2188Ca -0.00 0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.39 1sj9 h GLN 2188Cb 0.22 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.91 1sj9 h GLN 2188CO 0.00 -0.10 0.29 0.00 -1.93 0.00 0.00 178.83 177.10 1sj9 h ALA 2189N 1.00 1.13 0.00 3.38 0.00 -0.59 -2.17 119.26 122.01 1sj9 h ALA 2189Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1sj9 h ALA 2189Cb 0.35 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1sj9 h ALA 2189CO -0.33 0.62 0.00 -1.33 0.00 0.00 0.00 179.25 178.21 1sj9 n MET 2190N -4.29 0.87 0.00 0.00 2.81 0.11 -4.89 117.12 111.74 1sj9 n MET 2190Ca 0.07 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 1sj9 n MET 2190Cb 0.18 -1.06 0.00 0.00 -0.71 0.00 0.00 33.22 31.63 1sj9 n MET 2190CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1sj9 n GLY 2191N 0.42 3.05 3.51 3.03 0.00 -0.45 -5.00 105.19 109.76 1sj9 n GLY 2191Ca 0.02 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.50 1sj9 n GLY 2191CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1sj9 n VAL 2192N -1.68 0.53 0.96 1.61 0.31 -0.73 -4.84 118.33 114.49 1sj9 n VAL 2192Ca 0.00 -0.13 0.10 0.00 -0.01 0.00 0.00 64.34 64.30 1sj9 n VAL 2192Cb 0.00 -0.30 -0.05 0.00 -0.91 0.00 0.00 33.84 32.59 1sj9 n VAL 2192CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1sj9 n MET 2193N 1.62 0.91 -3.56 5.55 0.00 -0.34 -4.46 117.12 116.85 1sj9 n MET 2193Ca 0.18 -0.61 -0.08 0.00 0.00 0.00 0.00 57.70 57.20 1sj9 n MET 2193Cb 0.16 -1.45 -0.03 0.00 0.00 0.00 0.00 33.22 31.90 1sj9 n MET 2193CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1sj9 s ASN 2194N -2.59 -0.28 0.14 3.17 6.03 -1.26 -3.22 114.94 116.94 1sj9 s ASN 2194Ca 0.14 0.13 -0.00 0.00 -1.03 0.00 0.00 52.86 52.10 1sj9 s ASN 2194Cb 0.17 0.27 -0.04 0.00 -3.03 0.00 0.00 41.25 38.61 1sj9 s ASN 2194CO 0.66 -0.38 0.31 -0.31 -2.03 0.00 0.00 177.10 175.35 1sj9 s TYR 2195N -2.11 3.49 0.00 1.54 2.02 0.28 -0.27 117.35 122.30 1sj9 s TYR 2195Ca 0.04 0.28 0.00 0.00 -0.37 0.00 0.00 57.07 57.03 1sj9 s TYR 2195Cb -0.01 -1.80 0.00 0.00 -0.40 0.00 0.00 41.96 39.75 1sj9 s TYR 2195CO -0.04 0.48 0.00 -0.85 -1.57 0.00 0.00 175.55 173.56 1sj9 n GLU 2196N -0.30 0.00 0.00 -0.62 -0.00 -0.10 -2.64 120.64 116.98 1sj9 n GLU 2196Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.11 1sj9 n GLU 2196Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.97 1sj9 n GLU 2196CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1sj9 n MET 2197N -0.03 0.52 0.00 3.44 2.81 -1.26 0.75 117.12 123.35 1sj9 n MET 2197Ca 0.00 -0.81 0.00 0.00 -1.81 0.00 0.00 57.70 55.08 1sj9 n MET 2197Cb 0.00 -0.93 0.00 0.00 -0.71 0.00 0.00 33.22 31.58 1sj9 n MET 2197CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1sj9 n GLU 2198N -0.17 2.26 -0.34 0.03 4.71 -1.26 -3.62 120.64 122.24 1sj9 n GLU 2198Ca 0.00 0.00 0.22 0.00 -0.01 0.00 0.00 57.16 57.37 1sj9 n GLU 2198Cb 0.13 -0.93 0.47 0.00 -1.01 0.00 0.00 31.44 30.10 1sj9 n GLU 2198CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1sj9 h SER 2199N 0.00 0.53 0.05 1.62 4.64 -1.97 -2.37 113.55 116.05 1sj9 h SER 2199Ca 0.00 0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1sj9 h SER 2199Cb 0.86 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1sj9 h SER 2199CO 0.00 0.06 -0.02 0.00 -0.87 0.00 0.00 176.83 175.99 1sj9 h ALA 2200N 1.68 -0.07 -0.64 5.18 0.00 -1.90 0.67 119.26 124.19 1sj9 h ALA 2200Ca 0.64 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.52 1sj9 h ALA 2200Cb 1.48 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.25 1sj9 h ALA 2200CO -0.40 -0.48 0.37 1.15 0.00 0.00 0.00 179.25 179.90 1sj9 h THR 2201N -0.20 1.02 0.00 0.00 2.02 -1.77 -1.65 112.91 112.33 1sj9 h THR 2201Ca -0.01 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1sj9 h THR 2201Cb 0.17 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1sj9 h THR 2201CO 0.01 0.13 0.00 -0.11 0.37 0.00 0.00 175.52 175.92 1sj9 n LEU 2202N -4.76 0.11 -0.54 2.58 0.00 -0.99 -0.40 117.00 113.00 1sj9 n LEU 2202Ca 0.07 0.68 0.46 0.00 0.00 0.00 0.00 56.01 57.21 1sj9 n LEU 2202Cb 0.13 -0.21 0.80 0.00 0.00 0.00 0.00 43.42 44.14 1sj9 n LEU 2202CO 0.31 -0.21 1.42 -0.07 0.00 0.00 0.00 177.39 178.84 1sj9 h LEU 2203N 0.00 0.00 0.00 -1.96 3.38 0.30 -0.41 115.31 116.62 1sj9 h LEU 2203Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1sj9 h LEU 2203Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1sj9 h LEU 2203CO 0.00 0.00 -0.11 0.74 0.09 0.00 0.00 178.44 179.16 1sj9 h THR 2204N 0.00 1.01 -0.62 0.22 2.02 -1.24 -0.40 112.91 113.90 1sj9 h THR 2204Ca 0.78 -1.79 0.14 0.00 0.77 0.00 0.00 66.41 66.31 1sj9 h THR 2204Cb 3.14 1.94 -0.03 0.00 -1.74 0.00 0.00 68.15 71.45 1sj9 h THR 2204CO -0.01 0.34 0.43 -0.03 0.37 0.00 0.00 175.52 176.62 1sj9 h MET 2205N -1.00 0.23 0.00 6.66 1.85 0.47 0.13 114.93 123.27 1sj9 h MET 2205Ca -0.02 -0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 59.04 1sj9 h MET 2205Cb 0.64 -0.05 -0.00 0.00 0.43 0.00 0.00 31.60 32.62 1sj9 h MET 2205CO -0.01 0.15 -0.17 0.00 -0.40 0.00 0.00 176.91 176.48 1sj9 h ALA 2207N -0.87 -0.49 -1.06 0.00 0.00 -0.79 0.10 119.26 116.16 1sj9 h ALA 2207Ca -0.01 0.08 0.29 0.00 0.00 0.00 0.00 54.91 55.27 1sj9 h ALA 2207Cb 0.28 1.08 -0.12 0.00 0.00 0.00 0.00 17.79 19.03 1sj9 h ALA 2207CO -0.01 -0.91 0.66 0.66 0.00 0.00 0.00 179.25 179.65 1sj9 h SER 2208N -0.24 0.49 -0.56 0.00 4.64 -0.91 -3.42 113.55 113.54 1sj9 h SER 2208Ca 0.15 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1sj9 h SER 2208Cb 0.55 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1sj9 h SER 2208CO -0.71 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.27 1sj9 n GLN 2209N -4.78 3.81 -3.22 4.77 10.64 0.02 -5.04 117.38 123.58 1sj9 n GLN 2209Ca 0.28 0.00 -0.44 0.00 -1.83 0.00 0.00 57.00 55.02 1sj9 n GLN 2209Cb 0.94 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.32 1sj9 n GLN 2209CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1sj9 n GLY 2210N 5.00 4.62 3.08 2.61 0.00 -1.25 -4.91 105.19 114.33 1sj9 n GLY 2210Ca 0.00 -2.63 -0.13 0.00 0.00 0.00 0.00 46.02 43.27 1sj9 n GLY 2210CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sj9 s LEU 2211N -1.94 1.16 -0.92 0.99 1.43 -1.21 -4.98 118.68 113.21 1sj9 s LEU 2211Ca 0.31 0.41 -0.15 0.00 -1.03 0.00 0.00 54.13 53.67 1sj9 s LEU 2211Cb -0.03 0.69 0.19 0.00 0.03 0.00 0.00 46.19 47.06 1sj9 s LEU 2211CO -0.00 -0.08 0.99 -0.13 0.23 0.00 0.00 176.35 177.36 1sj9 s ARG 2212N 0.21 3.69 0.40 1.70 0.52 -0.05 -4.22 118.95 121.20 1sj9 s ARG 2212Ca -0.01 -2.26 -0.00 0.00 -0.52 0.00 0.00 55.73 52.94 1sj9 s ARG 2212Cb -0.02 -4.68 -0.02 0.00 0.52 0.00 0.00 34.95 30.74 1sj9 s ARG 2212CO -0.00 -1.51 0.62 0.00 0.02 0.00 0.00 175.30 174.42 1sj9 s ALA 2213N 1.13 3.69 0.16 2.13 0.00 -1.26 -0.48 121.76 127.14 1sj9 s ALA 2213Ca 0.27 -0.92 -0.16 0.00 0.00 0.00 0.00 51.96 51.15 1sj9 s ALA 2213Cb -0.07 -2.17 0.03 0.00 0.00 0.00 0.00 23.12 20.90 1sj9 s ALA 2213CO -0.08 -0.18 0.44 0.20 0.00 0.00 0.00 175.76 176.13 1sj9 s GLY 2214N -4.11 -0.11 -0.02 0.00 0.00 0.25 -2.07 107.32 101.26 1sj9 s GLY 2214Ca 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 44.72 44.93 1sj9 s GLY 2214CO 0.38 -0.35 0.04 -0.29 0.00 0.00 0.00 173.10 172.87 1sj9 s MET 2215N -3.85 0.01 -0.11 2.90 1.75 -1.26 -0.83 119.30 117.90 1sj9 s MET 2215Ca 0.07 0.12 -0.09 0.00 -1.25 0.00 0.00 55.69 54.54 1sj9 s MET 2215Cb 0.01 -0.10 0.03 0.00 2.84 0.00 0.00 34.83 37.61 1sj9 s MET 2215CO -0.07 -0.08 0.30 0.54 -0.65 0.00 0.00 175.02 175.06 1sj9 s VAL 2216N 0.50 -0.01 0.30 10.11 0.11 0.32 -2.31 120.40 129.42 1sj9 s VAL 2216Ca -0.04 0.03 -0.03 0.00 -2.93 0.00 0.00 61.98 59.01 1sj9 s VAL 2216Cb -0.06 -0.42 -0.01 0.00 -1.53 0.00 0.00 36.38 34.36 1sj9 s VAL 2216CO -0.02 0.01 0.39 0.00 -3.33 0.00 0.00 175.10 172.16 1sj9 s ALA 2217N 0.43 0.81 -0.03 1.54 0.00 0.58 -3.03 121.76 122.05 1sj9 s ALA 2217Ca -0.02 -1.51 0.01 0.00 0.00 0.00 0.00 51.96 50.43 1sj9 s ALA 2217Cb -0.04 1.23 0.03 0.00 0.00 0.00 0.00 23.12 24.33 1sj9 s ALA 2217CO -0.02 -0.75 -0.00 0.20 0.00 0.00 0.00 175.76 175.18 1sj9 s GLY 2218N -3.20 0.26 -0.20 0.00 0.00 -0.82 -0.22 107.32 103.13 1sj9 s GLY 2218Ca 0.32 0.15 -0.29 0.00 0.00 0.00 0.00 44.72 44.90 1sj9 s GLY 2218CO 0.18 0.57 2.20 -0.62 0.00 0.00 0.00 173.10 175.42 1sj9 n VAL 2219N 4.10 0.38 -0.02 1.40 0.31 -0.99 -2.67 118.33 120.84 1sj9 n VAL 2219Ca -0.27 -0.41 0.04 0.00 -0.01 0.00 0.00 64.34 63.69 1sj9 n VAL 2219Cb 0.50 -2.48 -0.14 0.00 -0.91 0.00 0.00 33.84 30.82 1sj9 n VAL 2219CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1sj9 n ILE 2220N 7.46 0.61 -3.76 2.52 -0.00 -0.91 -0.95 119.36 124.34 1sj9 n ILE 2220Ca 0.30 -0.63 -0.13 0.00 -0.00 0.00 0.00 62.75 62.28 1sj9 n ILE 2220Cb 0.43 -0.27 -0.09 0.00 -0.00 0.00 0.00 39.64 39.71 1sj9 n ILE 2220CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1sj9 s VAL 2221N -3.14 0.05 -0.25 7.28 0.11 -1.25 -4.92 120.40 118.28 1sj9 s VAL 2221Ca -0.07 -0.44 -0.00 0.00 -2.93 0.00 0.00 61.98 58.53 1sj9 s VAL 2221Cb 0.11 -0.61 0.03 0.00 -1.53 0.00 0.00 36.38 34.38 1sj9 s VAL 2221CO 0.86 -0.24 -0.08 0.21 -3.33 0.00 0.00 175.10 172.52 1sj9 s ASN 2222N -1.25 4.25 -1.49 3.54 3.04 -1.26 -1.92 114.94 119.85 1sj9 s ASN 2222Ca -0.13 -1.00 -0.11 0.00 0.04 0.00 0.00 52.86 51.66 1sj9 s ASN 2222Cb -0.05 -1.62 0.02 0.00 -1.54 0.00 0.00 41.25 38.05 1sj9 s ASN 2222CO 0.04 -0.14 2.46 0.54 -3.04 0.00 0.00 177.10 176.96 1sj9 n ARG 2223N 4.61 3.37 0.03 0.43 1.74 -0.29 -3.91 116.66 122.65 1sj9 n ARG 2223Ca -0.16 -2.63 0.00 0.00 -0.77 0.00 0.00 57.85 54.29 1sj9 n ARG 2223Cb 0.46 -3.03 0.00 0.00 -1.02 0.00 0.00 32.46 28.87 1sj9 n ARG 2223CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1sj9 n THR 2224N 4.11 0.00 -0.95 0.55 -2.24 -1.26 -4.78 114.28 109.71 1sj9 n THR 2224Ca 0.61 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 62.06 1sj9 n THR 2224Cb 0.32 -0.00 0.14 0.00 -2.10 0.00 0.00 70.33 68.69 1sj9 n THR 2224CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sj9 s GLN 2225N -1.14 1.38 -0.11 -0.78 1.03 -1.25 -4.99 119.66 113.80 1sj9 s GLN 2225Ca 0.00 1.69 0.14 0.00 0.04 0.00 0.00 55.36 57.23 1sj9 s GLN 2225Cb 0.00 -1.75 0.46 0.00 0.03 0.00 0.00 33.01 31.75 1sj9 s GLN 2225CO 0.00 -2.39 1.38 0.00 -2.54 0.00 0.00 175.29 171.74 1sj9 n GLN 2226N -3.67 2.99 0.00 9.60 10.64 -1.26 -4.98 117.38 130.70 1sj9 n GLN 2226Ca 0.13 -2.56 0.00 0.00 -1.83 0.00 0.00 57.00 52.74 1sj9 n GLN 2226Cb 0.51 -1.65 0.00 0.00 -0.86 0.00 0.00 30.24 28.24 1sj9 n GLN 2226CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1sj9 n GLU 2227N -0.03 2.75 -4.51 2.61 1.02 -1.26 -5.06 120.64 116.16 1sj9 n GLU 2227Ca 0.18 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.98 1sj9 n GLU 2227Cb 0.73 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 32.03 1sj9 n GLU 2227CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1sj9 s ILE 2228N 0.00 3.75 -0.02 -3.67 1.01 -1.26 -4.99 121.20 116.01 1sj9 s ILE 2228Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.23 1sj9 s ILE 2228Cb 0.00 -2.60 0.03 0.00 0.01 0.00 0.00 42.46 39.90 1sj9 s ILE 2228CO 0.00 0.53 1.18 -0.81 0.00 0.00 0.00 174.94 175.84 1sj9 n PRO 2229N 3.14 1.06 0.00 2.79 -0.04 -1.26 -4.98 135.00 135.71 1sj9 n PRO 2229Ca -0.18 -0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.14 1sj9 n PRO 2229Cb 0.53 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.93 1sj9 n PRO 2229CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1sj9 n ASN 2230N 0.55 -1.09 0.00 3.54 3.02 -1.26 -4.42 115.26 115.60 1sj9 n ASN 2230Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1sj9 n ASN 2230Cb 0.55 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.72 1sj9 n ASN 2230CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sj9 n ALA 2231N 2.34 0.00 -1.93 5.41 0.00 -1.26 -4.76 120.51 120.31 1sj9 n ALA 2231Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1sj9 n ALA 2231Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1sj9 n ALA 2231CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1sj9 n GLU 2232N 0.00 3.97 0.00 0.00 2.13 -1.26 -4.62 120.64 120.86 1sj9 n GLU 2232Ca 0.00 -3.15 0.06 0.00 0.66 0.00 0.00 57.16 54.73 1sj9 n GLU 2232Cb 0.00 -2.81 0.33 0.00 0.27 0.00 0.00 31.44 29.22 1sj9 n GLU 2232CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1sj9 n THR 2233N 2.88 0.00 -1.24 6.31 5.66 -1.26 -2.79 114.28 123.84 1sj9 n THR 2233Ca 0.58 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 61.45 1sj9 n THR 2233Cb 0.29 -0.33 0.22 0.00 -1.55 0.00 0.00 70.33 68.96 1sj9 n THR 2233CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 1sj9 n MET 2234N -0.72 2.50 0.04 1.09 2.00 -1.26 -4.56 117.12 116.21 1sj9 n MET 2234Ca 0.08 -3.07 0.00 0.00 0.00 0.00 0.00 57.70 54.71 1sj9 n MET 2234Cb 0.04 -2.07 0.00 0.00 0.00 0.00 0.00 33.22 31.19 1sj9 n MET 2234CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1sj9 n LYS 2235N -0.89 0.00 -0.20 0.03 4.76 -1.12 -4.47 118.16 116.28 1sj9 n LYS 2235Ca 0.46 0.00 0.28 0.00 -2.87 0.00 0.00 58.31 56.18 1sj9 n LYS 2235Cb 1.40 -0.26 0.70 0.00 -1.84 0.00 0.00 35.03 35.03 1sj9 n LYS 2235CO 0.00 0.00 0.00 0.37 -1.37 0.00 0.00 177.40 176.40 1sj9 h GLN 2236N 0.00 0.05 0.09 1.97 -0.00 -1.83 0.25 115.11 115.64 1sj9 h GLN 2236Ca 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1sj9 h GLN 2236Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 27.47 1sj9 h GLN 2236CO 0.00 0.03 -0.04 1.79 0.00 0.00 0.00 178.83 180.61 1sj9 h THR 2237N 0.05 1.11 -0.95 2.39 1.35 -1.86 -0.71 112.91 114.30 1sj9 h THR 2237Ca 0.44 -0.78 0.07 0.00 -0.55 0.00 0.00 66.41 65.59 1sj9 h THR 2237Cb 1.67 1.61 -0.06 0.00 -1.73 0.00 0.00 68.15 69.64 1sj9 h THR 2237CO -0.03 0.19 0.62 -0.33 -0.25 0.00 0.00 175.52 175.71 1sj9 h GLU 2238N -0.48 1.06 -0.15 4.72 5.08 -0.96 0.38 114.58 124.23 1sj9 h GLU 2238Ca -0.01 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1sj9 h GLU 2238Cb 0.40 -0.24 -0.07 0.00 0.50 0.00 0.00 28.75 29.35 1sj9 h GLU 2238CO 0.02 0.70 -0.36 0.66 -1.00 0.00 0.00 179.01 179.03 1sj9 h SER 2239N 1.09 -1.12 0.00 1.42 4.64 -0.23 0.32 113.55 119.68 1sj9 h SER 2239Ca 0.41 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1sj9 h SER 2239Cb 0.20 0.47 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1sj9 h SER 2239CO -0.16 -0.38 0.00 1.41 -0.87 0.00 0.00 176.83 176.83 1sj9 n HIS 2240N -5.42 0.00 -0.27 4.77 8.25 -0.00 -2.11 115.22 120.43 1sj9 n HIS 2240Ca -0.03 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.49 1sj9 n HIS 2240Cb 0.34 0.00 0.17 0.00 1.12 0.00 0.00 29.99 31.62 1sj9 n HIS 2240CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1sj9 h ALA 2241N -2.01 0.81 -0.55 -1.41 0.00 -1.20 0.25 119.26 115.15 1sj9 h ALA 2241Ca 0.00 0.26 0.11 0.00 0.00 0.00 0.00 54.91 55.29 1sj9 h ALA 2241Cb 0.00 0.47 -0.10 0.00 0.00 0.00 0.00 17.79 18.16 1sj9 h ALA 2241CO 0.00 -0.44 -0.06 0.28 0.00 0.00 0.00 179.25 179.03 1sj9 h VAL 2242N 0.08 0.50 0.38 0.00 2.07 -0.40 1.29 116.25 120.17 1sj9 h VAL 2242Ca 0.44 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.92 1sj9 h VAL 2242Cb 0.78 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1sj9 h VAL 2242CO -0.72 0.01 -0.28 0.11 0.02 0.00 0.00 177.57 176.71 1sj9 h LYS 2243N 0.06 -0.61 -1.02 1.57 1.57 -0.03 0.23 116.57 118.35 1sj9 h LYS 2243Ca 0.28 0.04 0.26 0.00 -1.87 0.00 0.00 60.65 59.36 1sj9 h LYS 2243Cb 0.43 0.14 -0.08 0.00 0.08 0.00 0.00 32.23 32.80 1sj9 h LYS 2243CO -0.52 -0.40 0.67 0.82 -0.57 0.00 0.00 179.45 179.45 1sj9 h ILE 2244N -0.63 0.55 0.00 1.86 1.08 0.16 1.49 117.51 122.01 1sj9 h ILE 2244Ca -0.05 -0.11 -0.10 0.00 -0.39 0.00 0.00 64.86 64.21 1sj9 h ILE 2244Cb 0.52 0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 34.46 1sj9 h ILE 2244CO 0.02 0.06 -0.50 1.62 -0.69 0.00 0.00 178.15 178.66 1sj9 h VAL 2245N 0.32 0.84 0.12 1.67 3.04 0.19 0.69 116.25 123.12 1sj9 h VAL 2245Ca 0.55 -2.19 -0.26 0.00 -1.01 0.00 0.00 66.70 63.80 1sj9 h VAL 2245Cb 1.54 2.41 0.00 0.00 -2.01 0.00 0.00 31.29 33.23 1sj9 h VAL 2245CO -0.21 0.48 -1.28 0.58 -1.01 0.00 0.00 177.57 176.13 1sj9 h VAL 2246N 0.00 1.13 0.45 1.51 2.07 0.32 -2.48 116.25 119.25 1sj9 h VAL 2246Ca -0.01 -2.43 -0.02 0.00 0.82 0.00 0.00 66.70 65.07 1sj9 h VAL 2246Cb 1.38 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 33.96 1sj9 h VAL 2246CO 0.06 0.70 -0.22 -0.33 0.02 0.00 0.00 177.57 177.80 1sj9 h GLU 2247N -0.33 -0.59 -0.12 1.57 4.39 0.18 0.70 114.58 120.37 1sj9 h GLU 2247Ca -0.27 0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.49 1sj9 h GLU 2247Cb 1.73 0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 30.47 1sj9 h GLU 2247CO 0.07 -0.31 -0.31 0.00 -1.16 0.00 0.00 179.01 177.30 1sj9 h ALA 2248N -0.32 -0.67 -0.60 3.43 0.00 -1.00 -1.80 119.26 118.30 1sj9 h ALA 2248Ca -0.06 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.93 1sj9 h ALA 2248Cb 0.55 0.86 -0.08 0.00 0.00 0.00 0.00 17.79 19.11 1sj9 h ALA 2248CO 0.10 -0.79 0.13 0.00 0.00 0.00 0.00 179.25 178.69 1sj9 h ALA 2249N -0.73 0.71 -1.08 0.00 0.00 -1.49 -0.02 119.26 116.64 1sj9 h ALA 2249Ca 0.02 0.13 0.35 0.00 0.00 0.00 0.00 54.91 55.41 1sj9 h ALA 2249Cb 0.38 0.17 -0.14 0.00 0.00 0.00 0.00 17.79 18.20 1sj9 h ALA 2249CO -0.27 -0.30 0.64 -0.09 0.00 0.00 0.00 179.25 179.23 1sj9 h ARG 2250N 0.26 0.24 0.15 0.00 2.43 -0.03 0.80 114.38 118.23 1sj9 h ARG 2250Ca 0.31 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.46 1sj9 h ARG 2250Cb 0.46 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1sj9 h ARG 2250CO -0.40 0.16 -0.07 0.00 -1.51 0.00 0.00 179.97 178.15 1sj9 h ARG 2251N 0.24 -0.19 0.45 0.20 3.08 -0.38 -3.37 114.38 114.42 1sj9 h ARG 2251Ca 0.75 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.80 1sj9 h ARG 2251Cb 1.93 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 32.01 1sj9 h ARG 2251CO -0.55 0.20 -0.32 -0.07 -1.07 0.00 0.00 179.97 178.16 1sj9 h LEU 2252N -0.94 -0.83 0.00 3.04 3.38 -0.37 -3.52 115.31 116.08 1sj9 h LEU 2252Ca -0.02 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1sj9 h LEU 2252Cb 0.48 0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1sj9 h LEU 2252CO 0.03 -0.49 0.00 0.18 0.09 0.00 0.00 178.44 178.26