#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hpa s GLU 2002N 0.00 0.36 0.18 -1.58 2.12 0.05 -4.90 118.70 114.93 2hpa s GLU 2002Ca 0.00 0.43 -0.33 0.00 0.36 0.00 0.00 54.97 55.42 2hpa s GLU 2002Cb 0.00 -0.43 -0.14 0.00 0.26 0.00 0.00 34.13 33.82 2hpa s GLU 2002CO 0.00 -0.74 1.53 -0.11 -0.54 0.00 0.00 175.26 175.40 2hpa n LEU 2003N 5.36 3.06 -0.04 2.70 7.94 -1.26 -0.77 117.00 134.00 2hpa n LEU 2003Ca -0.03 1.10 -0.05 0.00 -1.11 0.00 0.00 56.01 55.92 2hpa n LEU 2003Cb 0.50 -1.42 -0.04 0.00 0.53 0.00 0.00 43.42 42.99 2hpa n LEU 2003CO 0.04 -0.35 -0.74 0.29 -1.11 0.00 0.00 177.39 175.51 2hpa n LYS 2004N 3.06 0.77 -3.95 1.96 4.76 0.23 -4.87 118.16 120.13 2hpa n LYS 2004Ca 0.16 0.03 -0.09 0.00 -2.87 0.00 0.00 58.31 55.54 2hpa n LYS 2004Cb 0.29 -1.15 -0.10 0.00 -1.84 0.00 0.00 35.03 32.23 2hpa n LYS 2004CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 2hpa s PHE 2005N -2.15 0.23 -0.13 2.13 5.36 -1.08 -4.68 117.98 117.66 2hpa s PHE 2005Ca -0.09 -0.53 -0.12 0.00 -0.96 0.00 0.00 56.93 55.24 2hpa s PHE 2005Cb 0.02 -0.17 0.04 0.00 -0.34 0.00 0.00 43.02 42.57 2hpa s PHE 2005CO 0.19 -0.31 0.35 0.54 -1.46 0.00 0.00 175.22 174.52 2hpa s VAL 2006N -2.32 -0.00 -0.05 3.12 0.11 0.04 -0.86 120.40 120.43 2hpa s VAL 2006Ca -0.08 0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.00 2hpa s VAL 2006Cb -0.03 -0.49 0.02 0.00 -1.53 0.00 0.00 36.38 34.35 2hpa s VAL 2006CO -0.04 0.00 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.77 2hpa s THR 2007N 0.30 0.82 -0.17 5.04 2.01 -1.03 -1.82 115.64 120.79 2hpa s THR 2007Ca -0.01 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.70 2hpa s THR 2007Cb -0.03 -0.78 0.02 0.00 0.01 0.00 0.00 72.50 71.73 2hpa s THR 2007CO -0.01 0.28 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.28 2hpa s LEU 2008N 0.72 1.97 -0.29 4.42 1.43 -0.77 -1.37 118.68 124.79 2hpa s LEU 2008Ca -0.12 -0.60 -0.04 0.00 -1.03 0.00 0.00 54.13 52.34 2hpa s LEU 2008Cb -0.14 -1.34 0.03 0.00 0.03 0.00 0.00 46.19 44.77 2hpa s LEU 2008CO 0.02 -0.03 0.02 0.68 0.23 0.00 0.00 176.35 177.26 2hpa s VAL 2009N 1.38 3.32 0.31 -1.59 -7.23 -1.14 -0.87 120.40 114.58 2hpa s VAL 2009Ca 0.04 -1.05 0.10 0.00 -1.81 0.00 0.00 61.98 59.26 2hpa s VAL 2009Cb -0.13 -2.78 -0.05 0.00 0.56 0.00 0.00 36.38 33.98 2hpa s VAL 2009CO -0.12 0.03 -0.05 0.72 -0.31 0.00 0.00 175.10 175.37 2hpa s PHE 2010N 1.36 2.51 0.06 2.82 -0.12 -0.37 -1.88 117.98 122.37 2hpa s PHE 2010Ca -0.01 -0.36 -0.10 0.00 -0.05 0.00 0.00 56.93 56.41 2hpa s PHE 2010Cb -0.18 -1.29 -0.06 0.00 -0.63 0.00 0.00 43.02 40.86 2hpa s PHE 2010CO -0.01 0.58 0.37 0.50 -0.05 0.00 0.00 175.22 176.61 2hpa s ARG 2011N -3.65 3.74 1.10 1.99 3.52 -0.54 -0.35 118.95 124.75 2hpa s ARG 2011Ca 0.33 0.15 -0.12 0.00 -0.13 0.00 0.00 55.73 55.95 2hpa s ARG 2011Cb -0.03 -3.03 0.24 0.00 -1.56 0.00 0.00 34.95 30.57 2hpa s ARG 2011CO 0.18 0.59 1.02 -2.39 -0.81 0.00 0.00 175.30 173.89 2hpa n HIS 2012N 1.03 -0.65 -0.51 5.12 1.44 -0.52 -2.24 115.22 118.88 2hpa n HIS 2012Ca -0.09 0.02 -0.01 0.00 -2.01 0.00 0.00 57.72 55.63 2hpa n HIS 2012Cb 0.52 -1.79 0.01 0.00 0.12 0.00 0.00 29.99 28.86 2hpa n HIS 2012CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2hpa n GLY 2013N 0.84 -2.46 3.75 -1.39 0.00 -1.26 -1.53 105.19 103.13 2hpa n GLY 2013Ca 0.06 -1.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.25 2hpa n GLY 2013CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2hpa s ASP 2014N -1.62 5.29 0.10 1.61 2.15 -1.26 -4.72 116.67 118.22 2hpa s ASP 2014Ca 0.03 2.65 -0.13 0.00 0.43 0.00 0.00 52.55 55.53 2hpa s ASP 2014Cb -0.00 -2.63 0.02 0.00 -0.30 0.00 0.00 42.92 40.01 2hpa s ASP 2014CO 0.02 -1.55 0.30 0.00 -0.17 0.00 0.00 175.17 173.77 2hpa s ARG 2015N -2.99 0.95 0.81 4.34 1.70 -1.26 -1.94 118.95 120.56 2hpa s ARG 2015Ca 0.73 -0.81 -0.11 0.00 -0.47 0.00 0.00 55.73 55.07 2hpa s ARG 2015Cb -0.37 0.41 0.08 0.00 -0.57 0.00 0.00 34.95 34.49 2hpa s ARG 2015CO 0.43 -0.34 1.12 -1.54 -1.08 0.00 0.00 175.30 173.89 2hpa s SER 2016N -2.79 4.02 0.64 -2.89 1.04 -0.57 -4.88 113.70 108.28 2hpa s SER 2016Ca 0.03 1.99 -0.17 0.00 0.48 0.00 0.00 55.95 58.28 2hpa s SER 2016Cb 0.03 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.57 2hpa s SER 2016CO -0.11 -2.36 0.88 -2.65 0.98 0.00 0.00 173.24 169.98 2hpa n PRO 2017N -3.61 0.69 0.04 4.02 -0.02 -1.26 -3.23 135.00 131.62 2hpa n PRO 2017Ca 0.10 0.28 -0.06 0.00 -2.02 0.00 0.00 63.50 61.80 2hpa n PRO 2017Cb 0.52 -2.11 -0.11 0.00 -0.02 0.00 0.00 33.50 31.79 2hpa n PRO 2017CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 2hpa h ILE 2018N 0.17 1.19 -3.54 4.25 -0.00 -1.92 0.13 117.51 117.79 2hpa h ILE 2018Ca -0.48 -2.90 -0.13 0.00 -0.00 0.00 0.00 64.86 61.36 2hpa h ILE 2018Cb 1.36 2.57 -0.04 0.00 -0.00 0.00 0.00 36.82 40.70 2hpa h ILE 2018CO 0.48 0.68 0.04 -0.62 -0.00 0.00 0.00 178.15 178.73 2hpa s ASP 2019N -6.37 0.37 0.18 2.16 -1.08 -1.26 -4.55 116.67 106.13 2hpa s ASP 2019Ca -0.01 -1.24 -0.23 0.00 -0.52 0.00 0.00 52.55 50.55 2hpa s ASP 2019Cb 0.09 0.74 0.06 0.00 -1.46 0.00 0.00 42.92 42.35 2hpa s ASP 2019CO 0.81 -1.45 0.63 0.28 0.52 0.00 0.00 175.17 175.96 2hpa s THR 2020N -2.88 0.00 0.33 1.71 -1.32 -1.26 -4.45 115.64 107.77 2hpa s THR 2020Ca 0.22 -0.22 -0.26 0.00 -1.21 0.00 0.00 61.69 60.22 2hpa s THR 2020Cb -0.03 -1.22 -0.09 0.00 -1.51 0.00 0.00 72.50 69.65 2hpa s THR 2020CO 0.15 0.00 1.00 0.72 -2.21 0.00 0.00 174.62 174.27 2hpa s PHE 2021N -3.77 3.59 0.42 9.09 -0.71 0.86 -4.92 117.98 122.53 2hpa s PHE 2021Ca 0.03 1.75 0.22 0.00 -1.04 0.00 0.00 56.93 57.89 2hpa s PHE 2021Cb -0.02 -3.04 1.21 0.00 -1.21 0.00 0.00 43.02 39.95 2hpa s PHE 2021CO -0.09 -0.11 1.76 -1.00 -1.34 0.00 0.00 175.22 174.44 2hpa h PRO 2022N 3.18 0.29 0.00 1.99 0.13 -1.88 0.53 132.00 136.24 2hpa h PRO 2022Ca -0.47 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2hpa h PRO 2022Cb 1.20 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2hpa h PRO 2022CO 0.65 0.19 0.00 2.41 -0.23 0.00 0.00 178.00 181.02 2hpa n THR 2023N -4.57 0.19 -2.31 1.56 -1.04 -0.98 -4.80 114.28 102.33 2hpa n THR 2023Ca 0.27 0.05 -0.43 0.00 -2.04 0.00 0.00 64.05 61.89 2hpa n THR 2023Cb 0.99 -0.60 -0.02 0.00 -1.82 0.00 0.00 70.33 68.88 2hpa n THR 2023CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2hpa s ASP 2024N -2.85 6.52 0.56 8.00 2.15 0.18 -4.88 116.67 126.34 2hpa s ASP 2024Ca 0.17 1.27 0.33 0.00 0.43 0.00 0.00 52.55 54.75 2hpa s ASP 2024Cb 0.17 -2.54 1.65 0.00 -0.30 0.00 0.00 42.92 41.90 2hpa s ASP 2024CO 0.45 -1.20 2.12 1.55 -0.17 0.00 0.00 175.17 177.92 2hpa h PRO 2025N 10.00 0.00 -5.00 4.34 0.13 -1.88 -3.36 132.00 136.24 2hpa h PRO 2025Ca -0.29 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.19 2hpa h PRO 2025Cb 1.12 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.20 2hpa h PRO 2025CO 1.03 0.06 2.43 -0.89 -0.23 0.00 0.00 178.00 180.41 2hpa n ILE 2026N -3.37 3.32 -1.47 -3.56 5.41 -1.26 -4.96 119.36 113.47 2hpa n ILE 2026Ca -0.01 -3.21 -0.29 0.00 1.00 0.00 0.00 62.75 60.24 2hpa n ILE 2026Cb 0.22 -2.42 0.14 0.00 -0.71 0.00 0.00 39.64 36.87 2hpa n ILE 2026CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2hpa s LYS 2027N 4.19 1.05 0.31 0.38 1.02 -1.26 -4.84 119.74 120.59 2hpa s LYS 2027Ca 0.53 0.35 0.05 0.00 0.02 0.00 0.00 55.97 56.93 2hpa s LYS 2027Cb 0.08 -1.82 0.85 0.00 -0.52 0.00 0.00 37.83 36.42 2hpa s LYS 2027CO 0.03 -2.27 1.59 1.49 -0.92 0.00 0.00 175.35 175.27 2hpa h GLU 2028N -1.55 0.06 -0.94 1.68 4.81 -1.94 -0.47 114.58 116.23 2hpa h GLU 2028Ca -0.51 -0.00 0.26 0.00 -0.13 0.00 0.00 59.36 58.98 2hpa h GLU 2028Cb 1.33 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.65 2hpa h GLU 2028CO 0.61 0.04 0.67 0.66 -0.73 0.00 0.00 179.01 180.26 2hpa h SER 2029N 0.06 0.07 -0.16 1.04 4.64 -1.97 -1.92 113.55 115.32 2hpa h SER 2029Ca 0.63 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.95 2hpa h SER 2029Cb 1.39 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.47 2hpa h SER 2029CO -0.82 0.02 0.08 0.28 -0.87 0.00 0.00 176.83 175.53 2hpa h SER 2030N 0.07 0.24 -3.35 4.97 0.02 -1.40 -3.41 113.55 110.70 2hpa h SER 2030Ca 0.46 -0.02 -0.59 0.00 -0.84 0.00 0.00 61.79 60.81 2hpa h SER 2030Cb 1.71 -0.06 -0.10 0.00 0.14 0.00 0.00 62.40 64.09 2hpa h SER 2030CO -0.04 0.22 -0.24 0.26 -1.14 0.00 0.00 176.83 175.90 2hpa s TRP 2031N -5.17 3.46 0.37 3.45 0.52 -0.72 -5.00 118.94 115.85 2hpa s TRP 2031Ca -0.06 0.70 0.17 0.00 0.02 0.00 0.00 56.10 56.92 2hpa s TRP 2031Cb 0.17 -2.45 1.10 0.00 -1.15 0.00 0.00 33.47 31.14 2hpa s TRP 2031CO 0.71 0.16 1.71 -1.00 0.02 0.00 0.00 176.95 178.55 2hpa h PRO 2032N 6.85 0.36 0.00 4.98 0.13 -1.84 -0.67 132.00 141.81 2hpa h PRO 2032Ca -0.40 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2hpa h PRO 2032Cb 1.17 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2hpa h PRO 2032CO 0.75 0.24 -0.00 1.04 -0.23 0.00 0.00 178.00 179.79 2hpa n GLN 2033N -4.80 1.71 0.00 0.86 3.00 -1.26 -5.10 117.38 111.79 2hpa n GLN 2033Ca 0.29 -2.29 0.00 0.00 -0.01 0.00 0.00 57.00 54.99 2hpa n GLN 2033Cb 0.96 -1.36 0.00 0.00 0.00 0.00 0.00 30.24 29.84 2hpa n GLN 2033CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2hpa n GLY 2034N -1.19 -0.44 3.93 1.08 0.00 -0.26 -4.79 105.19 103.52 2hpa n GLY 2034Ca 0.12 -1.10 -0.25 0.00 0.00 0.00 0.00 46.02 44.78 2hpa n GLY 2034CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hpa s PHE 2035N 0.00 3.51 -1.52 1.61 0.08 -1.26 -4.33 117.98 116.07 2hpa s PHE 2035Ca 0.00 0.53 -0.13 0.00 0.12 0.00 0.00 56.93 57.45 2hpa s PHE 2035Cb 0.00 -2.08 0.08 0.00 -0.57 0.00 0.00 43.02 40.45 2hpa s PHE 2035CO 0.00 -0.06 0.94 0.41 -0.10 0.00 0.00 175.22 176.41 2hpa n GLY 2036N -1.99 -0.47 3.16 4.36 0.00 0.45 -4.95 105.19 105.76 2hpa n GLY 2036Ca -0.02 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2hpa n GLY 2036CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2hpa s GLN 2037N -6.58 2.60 0.21 1.61 2.00 -1.26 -4.48 119.66 113.76 2hpa s GLN 2037Ca 0.59 -0.74 -0.31 0.00 -2.00 0.00 0.00 55.36 52.91 2hpa s GLN 2037Cb -0.30 -2.01 -0.11 0.00 0.80 0.00 0.00 33.01 31.39 2hpa s GLN 2037CO 0.83 0.14 1.61 -1.17 -0.50 0.00 0.00 175.29 176.20 2hpa s LEU 2038N 0.41 4.37 0.00 3.68 2.96 -1.26 -1.51 118.68 127.33 2hpa s LEU 2038Ca -0.17 2.76 -0.03 0.00 -0.22 0.00 0.00 54.13 56.48 2hpa s LEU 2038Cb -0.17 -3.61 0.07 0.00 0.50 0.00 0.00 46.19 42.99 2hpa s LEU 2038CO 0.07 -0.87 0.47 0.35 -1.32 0.00 0.00 176.35 175.05 2hpa n THR 2039N 3.46 0.00 0.10 3.68 -2.24 -0.82 -4.92 114.28 113.54 2hpa n THR 2039Ca 0.13 -0.57 -0.05 0.00 -2.27 0.00 0.00 64.05 61.28 2hpa n THR 2039Cb 0.37 -1.40 0.07 0.00 -2.10 0.00 0.00 70.33 67.27 2hpa n THR 2039CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2hpa h GLN 2040N 0.00 0.14 -0.31 -0.78 1.08 -1.95 -2.49 115.11 110.81 2hpa h GLN 2040Ca -0.15 -0.13 -0.04 0.00 -1.45 0.00 0.00 58.65 56.88 2hpa h GLN 2040Cb 0.51 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 2hpa h GLN 2040CO 0.14 0.81 0.03 1.25 -0.95 0.00 0.00 178.83 180.12 2hpa h LEU 2041N 0.09 0.50 -1.98 1.46 5.85 -1.93 -1.70 115.31 117.61 2hpa h LEU 2041Ca -0.02 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.43 2hpa h LEU 2041Cb 1.30 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 2hpa h LEU 2041CO 0.11 0.65 0.02 1.23 -0.34 0.00 0.00 178.44 180.11 2hpa h GLY 2042N 0.33 0.04 1.00 3.75 0.00 -1.65 0.99 103.07 107.53 2hpa h GLY 2042Ca 0.09 -0.01 -0.16 0.00 0.00 0.00 0.00 47.33 47.25 2hpa h GLY 2042CO 0.01 0.01 -0.50 -0.33 0.00 0.00 0.00 176.54 175.73 2hpa h MET 2043N 0.03 0.68 -0.78 4.80 2.86 -1.11 -2.65 114.93 118.76 2hpa h MET 2043Ca 0.01 -0.47 -0.05 0.00 -2.06 0.00 0.00 59.70 57.13 2hpa h MET 2043Cb 0.01 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 2hpa h MET 2043CO -0.00 1.09 0.30 0.93 1.06 0.00 0.00 176.91 180.29 2hpa h GLU 2044N 0.38 1.18 -0.45 1.72 5.08 -0.14 0.61 114.58 122.96 2hpa h GLU 2044Ca -0.01 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2hpa h GLU 2044Cb 1.12 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 2hpa h GLU 2044CO 0.11 0.96 0.28 1.96 -1.00 0.00 0.00 179.01 181.32 2hpa h GLN 2045N 1.14 0.60 0.00 2.33 4.20 -0.79 -0.08 115.11 122.51 2hpa h GLN 2045Ca 0.26 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.80 2hpa h GLN 2045Cb 0.24 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 2hpa h GLN 2045CO -0.02 0.43 -0.58 0.45 -0.67 0.00 0.00 178.83 178.44 2hpa h HIS 2046N 0.60 0.00 -0.20 2.96 3.86 -1.24 -1.39 115.15 119.74 2hpa h HIS 2046Ca 0.16 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.27 2hpa h HIS 2046Cb -0.02 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 2hpa h HIS 2046CO -0.04 0.58 -0.31 -0.92 0.86 0.00 0.00 177.93 178.11 2hpa h TYR 2047N 0.00 0.44 -0.01 2.45 3.20 -0.53 -1.07 116.97 121.45 2hpa h TYR 2047Ca -0.01 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.75 2hpa h TYR 2047Cb 1.31 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.48 2hpa h TYR 2047CO 0.00 0.66 -0.03 1.49 -1.64 0.00 0.00 178.16 178.64 2hpa h GLU 2048N 0.34 0.04 -0.96 1.82 4.22 -0.89 -2.27 114.58 116.88 2hpa h GLU 2048Ca 0.04 -0.03 0.15 0.00 0.08 0.00 0.00 59.36 59.60 2hpa h GLU 2048Cb 0.71 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.89 2hpa h GLU 2048CO 0.05 0.63 0.61 1.25 -2.18 0.00 0.00 179.01 179.37 2hpa h LEU 2049N -0.54 0.78 -0.52 1.64 6.46 -1.10 0.03 115.31 122.07 2hpa h LEU 2049Ca -0.00 0.05 -0.16 0.00 -0.12 0.00 0.00 57.88 57.65 2hpa h LEU 2049Cb 0.63 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 2hpa h LEU 2049CO 0.01 0.38 -0.53 1.23 -0.62 0.00 0.00 178.44 178.90 2hpa h GLY 2050N 0.81 0.63 1.29 3.75 0.00 -1.16 -1.50 103.07 106.89 2hpa h GLY 2050Ca 0.49 -0.72 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2hpa h GLY 2050CO -0.26 0.65 0.28 0.83 0.00 0.00 0.00 176.54 178.04 2hpa h GLU 2051N 0.45 0.92 0.16 4.80 5.08 -0.43 -1.48 114.58 124.08 2hpa h GLU 2051Ca 0.01 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2hpa h GLU 2051Cb 1.08 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2hpa h GLU 2051CO 0.10 0.73 -0.08 -0.92 -1.00 0.00 0.00 179.01 177.85 2hpa h TYR 2052N 0.91 -0.20 -0.71 4.33 3.20 -0.92 -1.97 116.97 121.62 2hpa h TYR 2052Ca 0.22 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.19 2hpa h TYR 2052Cb 0.14 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 2hpa h TYR 2052CO 0.01 0.02 0.47 0.82 -1.64 0.00 0.00 178.16 177.84 2hpa h ILE 2053N -0.39 0.90 0.83 1.81 1.08 -1.05 0.12 117.51 120.81 2hpa h ILE 2053Ca -0.02 -0.19 -0.04 0.00 -0.39 0.00 0.00 64.86 64.22 2hpa h ILE 2053Cb 0.31 0.30 0.01 0.00 -3.07 0.00 0.00 36.82 34.37 2hpa h ILE 2053CO 0.04 0.10 -0.40 -0.09 -0.69 0.00 0.00 178.15 177.11 2hpa h ARG 2054N 0.55 -1.08 -0.02 2.37 2.43 -0.70 -1.37 114.38 116.56 2hpa h ARG 2054Ca 0.33 0.07 0.03 0.00 -0.81 0.00 0.00 59.98 59.61 2hpa h ARG 2054Cb 0.57 0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 30.31 2hpa h ARG 2054CO -0.11 -0.71 -0.33 0.87 -1.51 0.00 0.00 179.97 178.18 2hpa h LYS 2055N -1.19 -0.46 -0.83 0.20 1.57 -0.77 0.33 116.57 115.42 2hpa h LYS 2055Ca -0.11 0.03 0.24 0.00 -1.87 0.00 0.00 60.65 58.94 2hpa h LYS 2055Cb 0.87 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.25 2hpa h LYS 2055CO 0.19 -0.30 0.61 -0.09 -0.57 0.00 0.00 179.45 179.28 2hpa h ARG 2056N -0.47 0.00 -0.05 3.15 2.43 -0.69 0.65 114.38 119.39 2hpa h ARG 2056Ca 0.06 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2hpa h ARG 2056Cb 0.57 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 2hpa h ARG 2056CO -0.28 0.00 -0.31 0.66 -1.51 0.00 0.00 179.97 178.52 2hpa n TYR 2057N -4.23 0.16 -0.36 2.20 4.01 -0.20 -4.73 117.16 114.01 2hpa n TYR 2057Ca 0.17 -1.37 0.27 0.00 -0.16 0.00 0.00 57.90 56.82 2hpa n TYR 2057Cb 0.91 -0.26 0.56 0.00 -0.31 0.00 0.00 39.34 40.24 2hpa n TYR 2057CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 2hpa h ARG 2058N 0.78 0.28 0.08 -0.72 9.65 0.20 -1.12 114.38 123.52 2hpa h ARG 2058Ca 0.03 -0.02 -0.36 0.00 -1.10 0.00 0.00 59.98 58.53 2hpa h ARG 2058Cb 1.09 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 29.58 2hpa h ARG 2058CO 0.05 0.18 -2.07 1.63 2.80 0.00 0.00 179.97 182.57 2hpa n LYS 2059N -4.65 0.72 0.45 0.20 5.02 -1.26 -4.42 118.16 114.22 2hpa n LYS 2059Ca 0.29 0.23 -0.19 0.00 -2.02 0.00 0.00 58.31 56.62 2hpa n LYS 2059Cb 1.06 -1.68 -0.09 0.00 -0.02 0.00 0.00 35.03 34.30 2hpa n LYS 2059CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2hpa h PHE 2060N 0.05 -1.04 -3.31 2.13 3.57 -1.71 -3.33 116.94 113.29 2hpa h PHE 2060Ca -0.44 -0.02 -0.77 0.00 3.53 0.00 0.00 57.97 60.26 2hpa h PHE 2060Cb 2.02 0.35 -0.24 0.00 2.79 0.00 0.00 35.95 40.86 2hpa h PHE 2060CO 0.06 -0.65 0.48 -0.51 -2.23 0.00 0.00 178.31 175.46 2hpa s LEU 2061N -9.99 6.15 -0.69 0.59 1.43 -0.49 -4.90 118.68 110.78 2hpa s LEU 2061Ca -0.19 -2.91 -0.02 0.00 -1.03 0.00 0.00 54.13 49.98 2hpa s LEU 2061Cb 0.03 -2.26 0.37 0.00 0.03 0.00 0.00 46.19 44.36 2hpa s LEU 2061CO 0.60 -0.58 2.08 -0.46 0.23 0.00 0.00 176.35 178.21 2hpa n ASN 2062N 4.19 7.49 -3.56 2.29 0.23 -1.25 -4.78 115.26 119.87 2hpa n ASN 2062Ca 0.21 -3.71 -0.00 0.00 -0.53 0.00 0.00 54.58 50.55 2hpa n ASN 2062Cb 0.44 -1.03 -0.04 0.00 -2.08 0.00 0.00 39.78 37.08 2hpa n ASN 2062CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2hpa s GLU 2063N -3.63 0.54 -0.53 -3.83 8.01 -1.26 -5.07 118.70 112.93 2hpa s GLU 2063Ca 0.58 1.32 -0.25 0.00 0.01 0.00 0.00 54.97 56.62 2hpa s GLU 2063Cb 0.46 0.79 -0.26 0.00 -4.31 0.00 0.00 34.13 30.81 2hpa s GLU 2063CO -0.16 -0.24 1.74 -1.13 0.01 0.00 0.00 175.26 175.48 2hpa n SER 2064N 5.40 0.81 -0.83 -0.19 3.41 -1.26 -4.38 113.62 116.58 2hpa n SER 2064Ca -0.10 -2.30 0.00 0.00 -0.26 0.00 0.00 58.87 56.21 2hpa n SER 2064Cb 0.50 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2hpa n SER 2064CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hpa n TYR 2065N 13.77 -1.27 -3.64 7.33 9.36 -1.26 -4.91 117.16 136.54 2hpa n TYR 2065Ca 0.38 0.75 -0.22 0.00 3.32 0.00 0.00 57.90 62.12 2hpa n TYR 2065Cb 0.44 -2.37 -0.17 0.00 -0.63 0.00 0.00 39.34 36.61 2hpa n TYR 2065CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 2hpa s LYS 2066N -2.59 0.00 0.55 2.98 1.02 -1.26 -5.03 119.74 115.42 2hpa s LYS 2066Ca 0.00 0.18 0.33 0.00 0.02 0.00 0.00 55.97 56.50 2hpa s LYS 2066Cb 0.00 -1.11 1.48 0.00 -0.52 0.00 0.00 37.83 37.68 2hpa s LYS 2066CO 0.00 -0.49 1.84 1.12 -0.92 0.00 0.00 175.35 176.89 2hpa h HIS 2067N 8.42 0.00 0.00 3.18 2.07 -1.98 0.37 115.15 127.21 2hpa h HIS 2067Ca -0.14 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.38 2hpa h HIS 2067Cb 1.13 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.11 2hpa h HIS 2067CO 0.31 0.00 0.00 -0.85 -3.07 0.00 0.00 177.93 174.32 2hpa n GLU 2068N -4.08 0.54 -0.00 5.12 0.00 -1.26 -3.57 120.64 117.39 2hpa n GLU 2068Ca 0.19 0.03 0.01 0.00 0.00 0.00 0.00 57.16 57.39 2hpa n GLU 2068Cb 1.03 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.94 2hpa n GLU 2068CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2hpa n GLN 2069N -1.18 0.82 -4.55 3.44 6.02 0.13 -4.25 117.38 117.80 2hpa n GLN 2069Ca 0.15 -0.02 -0.24 0.00 -0.01 0.00 0.00 57.00 56.87 2hpa n GLN 2069Cb 0.16 -1.08 -0.14 0.00 1.02 0.00 0.00 30.24 30.20 2hpa n GLN 2069CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2hpa s VAL 2070N -2.20 1.57 -0.13 5.09 1.01 -1.02 -0.39 120.40 124.33 2hpa s VAL 2070Ca -0.01 -1.20 -0.05 0.00 0.00 0.00 0.00 61.98 60.72 2hpa s VAL 2070Cb 0.02 -1.38 0.06 0.00 0.00 0.00 0.00 36.38 35.08 2hpa s VAL 2070CO 0.14 0.14 0.27 -0.47 0.00 0.00 0.00 175.10 175.18 2hpa s TYR 2071N -0.85 -0.42 -0.12 5.22 5.04 -0.82 -4.73 117.35 120.68 2hpa s TYR 2071Ca 0.06 0.95 0.01 0.00 -2.44 0.00 0.00 57.07 55.66 2hpa s TYR 2071Cb -0.09 -0.00 -0.01 0.00 0.35 0.00 0.00 41.96 42.21 2hpa s TYR 2071CO 0.02 -0.33 -0.16 0.42 -1.34 0.00 0.00 175.55 174.16 2hpa s ILE 2072N 2.15 2.82 -0.02 3.14 1.09 -1.26 -0.06 121.20 129.06 2hpa s ILE 2072Ca -0.01 -0.75 0.04 0.00 -1.10 0.00 0.00 60.65 58.83 2hpa s ILE 2072Cb -0.12 -2.16 -0.01 0.00 -1.06 0.00 0.00 42.46 39.12 2hpa s ILE 2072CO -0.09 0.54 -0.15 -0.60 -0.10 0.00 0.00 174.94 174.54 2hpa s ARG 2073N 0.25 1.37 0.16 2.79 3.52 0.22 -1.15 118.95 126.10 2hpa s ARG 2073Ca -0.11 -0.53 0.04 0.00 -0.13 0.00 0.00 55.73 55.00 2hpa s ARG 2073Cb -0.16 -1.26 -0.05 0.00 -1.56 0.00 0.00 34.95 31.92 2hpa s ARG 2073CO 0.06 0.27 -0.07 0.45 -0.81 0.00 0.00 175.30 175.20 2hpa s SER 2074N -0.14 1.65 0.44 -2.12 0.15 0.64 -0.65 113.70 113.67 2hpa s SER 2074Ca 0.01 -1.06 -0.21 0.00 0.70 0.00 0.00 55.95 55.39 2hpa s SER 2074Cb -0.08 0.02 -0.10 0.00 -1.71 0.00 0.00 66.02 64.15 2hpa s SER 2074CO 0.00 -0.40 0.98 0.42 1.20 0.00 0.00 173.24 175.44 2hpa s THR 2075N -3.42 4.16 -1.06 6.45 -4.23 -1.11 -4.22 115.64 112.22 2hpa s THR 2075Ca 0.19 1.39 -0.16 0.00 -1.18 0.00 0.00 61.69 61.92 2hpa s THR 2075Cb 0.04 -3.58 -0.08 0.00 1.34 0.00 0.00 72.50 70.22 2hpa s THR 2075CO 0.01 -0.25 2.13 -0.67 -0.54 0.00 0.00 174.62 175.30 2hpa n ASP 2076N -0.65 3.82 -3.85 3.99 2.03 -1.24 -4.30 116.55 116.35 2hpa n ASP 2076Ca 0.07 -2.66 -0.12 0.00 0.52 0.00 0.00 54.79 52.61 2hpa n ASP 2076Cb 0.53 -1.30 -0.13 0.00 -0.72 0.00 0.00 41.12 39.50 2hpa n ASP 2076CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2hpa s VAL 2077N 3.99 0.00 0.16 5.18 1.01 -1.26 -4.71 120.40 124.77 2hpa s VAL 2077Ca 0.52 -0.01 -0.19 0.00 0.00 0.00 0.00 61.98 62.30 2hpa s VAL 2077Cb 0.14 -0.11 0.08 0.00 0.00 0.00 0.00 36.38 36.48 2hpa s VAL 2077CO 0.02 -0.01 1.64 0.44 0.00 0.00 0.00 175.10 177.20 2hpa h ASP 2078N 6.01 -0.60 -0.78 3.32 5.19 -1.89 0.59 116.42 128.26 2hpa h ASP 2078Ca -0.25 0.14 0.09 0.00 -0.62 0.00 0.00 57.03 56.40 2hpa h ASP 2078Cb 1.20 0.33 -0.05 0.00 0.18 0.00 0.00 39.33 40.99 2hpa h ASP 2078CO 0.46 -0.21 0.51 0.08 -3.12 0.00 0.00 179.24 176.96 2hpa h ARG 2079N -0.12 0.69 0.00 3.56 0.11 -1.96 0.62 114.38 117.29 2hpa h ARG 2079Ca 0.18 -0.04 -0.20 0.00 0.10 0.00 0.00 59.98 60.01 2hpa h ARG 2079Cb 0.39 -0.16 -0.03 0.00 1.11 0.00 0.00 29.97 31.28 2hpa h ARG 2079CO -0.43 0.46 -1.22 1.79 0.10 0.00 0.00 179.97 180.67 2hpa h THR 2080N 0.72 1.00 -0.06 0.08 1.35 -1.73 -2.41 112.91 111.87 2hpa h THR 2080Ca 0.36 -2.63 -0.08 0.00 -0.55 0.00 0.00 66.41 63.50 2hpa h THR 2080Cb 0.43 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 2hpa h THR 2080CO -0.13 0.57 -0.27 -0.07 -0.25 0.00 0.00 175.52 175.37 2hpa h LEU 2081N 0.00 0.33 -1.05 3.87 -0.00 -0.20 -2.86 115.31 115.39 2hpa h LEU 2081Ca -0.13 -0.65 -0.05 0.00 -0.00 0.00 0.00 57.88 57.05 2hpa h LEU 2081Cb 1.72 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 42.26 2hpa h LEU 2081CO 0.08 0.93 0.11 0.24 -0.00 0.00 0.00 178.44 179.80 2hpa h MET 2082N -0.25 0.79 -0.15 1.13 2.86 0.12 -1.63 114.93 117.80 2hpa h MET 2082Ca -0.02 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2hpa h MET 2082Cb 0.92 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.46 2hpa h MET 2082CO 0.06 0.73 0.09 0.77 1.06 0.00 0.00 176.91 179.61 2hpa h SER 2083N 0.76 0.18 -0.06 1.22 0.02 -1.47 0.46 113.55 114.66 2hpa h SER 2083Ca 0.17 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.10 2hpa h SER 2083Cb 0.30 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 2hpa h SER 2083CO 0.00 0.17 -0.11 0.00 -1.14 0.00 0.00 176.83 175.75 2hpa h ALA 2084N 1.01 -0.08 -0.80 3.77 0.00 -1.22 0.12 119.26 122.07 2hpa h ALA 2084Ca 0.05 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2hpa h ALA 2084Cb 0.03 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2hpa h ALA 2084CO -0.01 -0.59 0.42 0.52 0.00 0.00 0.00 179.25 179.59 2hpa h MET 2085N -0.16 1.14 -0.13 0.00 2.86 -1.16 -1.30 114.93 116.17 2hpa h MET 2085Ca 0.06 -0.15 -0.12 0.00 -2.06 0.00 0.00 59.70 57.43 2hpa h MET 2085Cb 0.25 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 2hpa h MET 2085CO -0.16 0.86 -0.44 1.15 1.06 0.00 0.00 176.91 179.38 2hpa h THR 2086N 1.13 1.32 0.40 2.22 2.02 -0.56 -2.54 112.91 116.89 2hpa h THR 2086Ca 0.28 -1.61 -0.02 0.00 0.77 0.00 0.00 66.41 65.83 2hpa h THR 2086Cb 0.07 1.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 2hpa h THR 2086CO -0.04 0.49 -0.19 -1.13 0.37 0.00 0.00 175.52 175.01 2hpa h ASN 2087N 0.26 -0.45 -0.71 4.18 -0.73 -0.27 -3.10 115.58 114.76 2hpa h ASN 2087Ca 0.02 -0.09 0.07 0.00 1.87 0.00 0.00 56.30 58.17 2hpa h ASN 2087Cb 0.89 0.12 -0.04 0.00 0.27 0.00 0.00 38.32 39.55 2hpa h ASN 2087CO 0.07 -0.17 0.47 -0.07 -0.37 0.00 0.00 177.43 177.36 2hpa h LEU 2088N -0.74 0.61 -2.02 0.34 3.38 -1.26 -1.82 115.31 113.81 2hpa h LEU 2088Ca -0.05 0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.06 2hpa h LEU 2088Cb 0.51 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2hpa h LEU 2088CO 0.09 0.39 0.40 0.00 0.09 0.00 0.00 178.44 179.40 2hpa h ALA 2089N 1.62 2.33 0.05 1.53 0.00 -1.37 0.62 119.26 124.04 2hpa h ALA 2089Ca 0.31 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.86 2hpa h ALA 2089Cb 0.33 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2hpa h ALA 2089CO -0.10 -0.64 -2.02 0.00 0.00 0.00 0.00 179.25 176.48 2hpa n ALA 2090N -2.52 1.25 -0.01 0.00 0.00 -0.72 -4.27 120.51 114.23 2hpa n ALA 2090Ca 0.09 -0.82 -0.13 0.00 0.00 0.00 0.00 53.44 52.57 2hpa n ALA 2090Cb 0.60 -0.59 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 2hpa n ALA 2090CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2hpa h LEU 2091N 0.03 0.00 -6.62 0.00 6.46 -0.59 -3.39 115.31 111.20 2hpa h LEU 2091Ca -0.42 -0.47 -0.65 0.00 -0.12 0.00 0.00 57.88 56.23 2hpa h LEU 2091Cb 2.04 -0.00 -0.39 0.00 -0.73 0.00 0.00 40.66 41.57 2hpa h LEU 2091CO 0.05 0.47 -0.34 0.49 -0.62 0.00 0.00 178.44 178.50 2hpa n PHE 2092N -4.86 3.49 -2.57 1.25 3.72 0.20 -4.87 117.46 113.81 2hpa n PHE 2092Ca -0.08 -3.99 -0.40 0.00 -0.05 0.00 0.00 57.45 52.93 2hpa n PHE 2092Cb 0.24 -0.74 -0.05 0.00 -0.94 0.00 0.00 39.48 37.99 2hpa n PHE 2092CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2hpa s PRO 2093N -2.17 4.64 -0.07 -1.08 0.02 -1.26 -4.67 135.00 130.40 2hpa s PRO 2093Ca 0.34 1.67 -0.31 0.00 0.02 0.00 0.00 61.00 62.72 2hpa s PRO 2093Cb 0.07 -3.12 -0.09 0.00 0.02 0.00 0.00 34.50 31.38 2hpa s PRO 2093CO -0.04 0.25 2.03 -2.30 -0.33 0.00 0.00 177.00 176.61 2hpa n PRO 2094N 1.09 2.41 -4.51 5.54 -0.02 -1.26 -4.88 135.00 133.37 2hpa n PRO 2094Ca -0.00 0.84 -0.33 0.00 -2.02 0.00 0.00 63.50 61.98 2hpa n PRO 2094Cb 0.46 -2.95 -0.13 0.00 -0.02 0.00 0.00 33.50 30.85 2hpa n PRO 2094CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2hpa s GLU 2095N 4.92 3.53 4.74 -0.52 0.41 -1.26 -4.60 118.70 125.92 2hpa s GLU 2095Ca 0.94 -0.60 0.00 0.00 -0.41 0.00 0.00 54.97 54.90 2hpa s GLU 2095Cb -0.49 -2.81 0.00 0.00 -1.78 0.00 0.00 34.13 29.05 2hpa s GLU 2095CO 0.43 0.19 0.00 0.41 -0.49 0.00 0.00 175.26 175.80 2hpa n GLY 2096N 3.64 3.38 0.34 -1.39 0.00 -1.26 -1.03 105.19 108.86 2hpa n GLY 2096Ca -0.18 0.14 0.18 0.00 0.00 0.00 0.00 46.02 46.16 2hpa n GLY 2096CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2hpa h VAL 2097N 0.00 0.21 0.00 1.61 3.04 -2.03 -0.03 116.25 119.05 2hpa h VAL 2097Ca 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.68 2hpa h VAL 2097Cb 0.00 0.86 -0.00 0.00 -2.01 0.00 0.00 31.29 30.14 2hpa h VAL 2097CO 0.00 0.00 -0.06 -1.28 -1.01 0.00 0.00 177.57 175.22 2hpa h SER 2098N 0.00 0.00 -1.92 3.17 0.87 -1.44 -3.40 113.55 110.84 2hpa h SER 2098Ca 0.03 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.05 2hpa h SER 2098Cb 0.35 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 62.23 2hpa h SER 2098CO -0.00 0.06 1.19 -0.63 -0.53 0.00 0.00 176.83 176.92 2hpa s ILE 2099N -4.42 3.73 -0.06 2.23 1.01 -0.03 -4.74 121.20 118.93 2hpa s ILE 2099Ca -0.04 0.04 0.12 0.00 0.00 0.00 0.00 60.65 60.77 2hpa s ILE 2099Cb 0.14 -4.84 -0.06 0.00 0.01 0.00 0.00 42.46 37.71 2hpa s ILE 2099CO 0.56 -1.77 1.29 4.11 0.00 0.00 0.00 174.94 179.14 2hpa h TRP 2100N 10.43 0.00 -3.37 3.97 5.08 -1.87 -3.42 115.95 126.78 2hpa h TRP 2100Ca -0.13 0.00 -0.55 0.00 1.08 0.00 0.00 58.89 59.29 2hpa h TRP 2100Cb 1.05 0.00 -0.38 0.00 -3.00 0.00 0.00 29.16 26.82 2hpa h TRP 2100CO 1.17 0.70 -0.78 1.21 -1.28 0.00 0.00 178.44 179.45 2hpa s ASN 2101N -6.46 2.98 0.52 0.11 3.84 -1.26 -5.02 114.94 109.65 2hpa s ASN 2101Ca 0.02 -0.76 0.31 0.00 0.21 0.00 0.00 52.86 52.64 2hpa s ASN 2101Cb 0.08 -0.88 1.11 0.00 -0.55 0.00 0.00 41.25 41.02 2hpa s ASN 2101CO 0.78 -0.22 1.89 1.55 -2.79 0.00 0.00 177.10 178.31 2hpa h PRO 2102N 8.12 0.00 -0.01 0.43 0.13 -1.99 -2.98 132.00 135.70 2hpa h PRO 2102Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2hpa h PRO 2102Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2hpa h PRO 2102CO 0.39 0.01 -0.48 -0.89 -0.23 0.00 0.00 178.00 176.79 2hpa n ILE 2103N -3.10 0.00 -3.58 -3.56 -0.00 -1.26 -4.72 119.36 103.13 2hpa n ILE 2103Ca 0.01 -0.15 -0.28 0.00 -0.00 0.00 0.00 62.75 62.33 2hpa n ILE 2103Cb 0.36 0.83 -0.15 0.00 -0.00 0.00 0.00 39.64 40.68 2hpa n ILE 2103CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 2hpa s LEU 2104N -2.61 0.71 -1.24 1.39 2.96 -1.13 -5.06 118.68 113.71 2hpa s LEU 2104Ca 0.18 -1.17 -0.16 0.00 -0.22 0.00 0.00 54.13 52.76 2hpa s LEU 2104Cb 0.18 -0.40 0.13 0.00 0.50 0.00 0.00 46.19 46.60 2hpa s LEU 2104CO 0.61 -0.41 1.55 -0.76 -1.32 0.00 0.00 176.35 176.02 2hpa s LEU 2105N 2.04 4.55 -0.27 -0.68 1.43 -1.26 -4.43 118.68 120.07 2hpa s LEU 2105Ca 0.07 -2.74 -0.24 0.00 -1.03 0.00 0.00 54.13 50.20 2hpa s LEU 2105Cb -0.16 -2.47 0.07 0.00 0.03 0.00 0.00 46.19 43.66 2hpa s LEU 2105CO -0.29 -0.93 0.74 0.86 0.23 0.00 0.00 176.35 176.96 2hpa s TRP 2106N 2.70 -0.80 -0.01 0.29 -0.00 -1.26 -4.65 118.94 115.20 2hpa s TRP 2106Ca 0.47 1.90 0.04 0.00 -0.00 0.00 0.00 56.10 58.51 2hpa s TRP 2106Cb -0.00 0.32 -0.01 0.00 -0.00 0.00 0.00 33.47 33.78 2hpa s TRP 2106CO 0.03 -0.39 -0.14 1.14 -0.00 0.00 0.00 176.95 177.59 2hpa s GLN 2107N 0.53 1.11 0.13 5.86 -2.07 -1.26 -4.81 119.66 119.15 2hpa s GLN 2107Ca -0.01 -0.51 -0.31 0.00 -1.82 0.00 0.00 55.36 52.70 2hpa s GLN 2107Cb -0.05 -1.08 -0.09 0.00 -1.09 0.00 0.00 33.01 30.70 2hpa s GLN 2107CO -0.02 0.29 1.46 -1.25 -1.32 0.00 0.00 175.29 174.45 2hpa s PRO 2108N -0.38 4.28 -0.09 9.60 0.04 -1.26 -4.99 135.00 142.20 2hpa s PRO 2108Ca 0.05 2.19 0.03 0.00 0.04 0.00 0.00 61.00 63.31 2hpa s PRO 2108Cb -0.05 -3.21 0.01 0.00 0.04 0.00 0.00 34.50 31.28 2hpa s PRO 2108CO -0.00 -0.50 -0.18 0.42 0.04 0.00 0.00 177.00 176.77 2hpa s ILE 2109N 1.12 1.60 -0.04 0.56 1.01 -1.26 -5.12 121.20 119.07 2hpa s ILE 2109Ca 0.67 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 60.27 2hpa s ILE 2109Cb -0.40 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 2hpa s ILE 2109CO 0.31 0.46 1.25 -2.16 0.00 0.00 0.00 174.94 174.80 2hpa s PRO 2110N 0.57 4.33 -0.29 2.79 0.04 -1.26 -5.00 135.00 136.19 2hpa s PRO 2110Ca -0.15 1.75 -0.08 0.00 0.04 0.00 0.00 61.00 62.56 2hpa s PRO 2110Cb -0.17 -3.56 -0.01 0.00 0.04 0.00 0.00 34.50 30.80 2hpa s PRO 2110CO 0.05 -0.48 0.11 0.08 0.04 0.00 0.00 177.00 176.80 2hpa s VAL 2111N 2.27 4.37 0.17 -0.36 1.01 -1.26 -4.32 120.40 122.27 2hpa s VAL 2111Ca 0.58 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 62.05 2hpa s VAL 2111Cb -0.26 -3.17 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 2hpa s VAL 2111CO 0.23 0.16 0.51 -1.00 0.00 0.00 0.00 175.10 175.00 2hpa s HIS 2112N 1.59 3.52 0.34 5.22 3.76 -0.30 -4.89 115.29 124.53 2hpa s HIS 2112Ca 0.05 0.91 0.01 0.00 -0.15 0.00 0.00 55.06 55.88 2hpa s HIS 2112Cb -0.16 -2.27 -0.00 0.00 1.11 0.00 0.00 32.58 31.25 2hpa s HIS 2112CO 0.05 0.38 0.42 -2.37 -0.85 0.00 0.00 174.74 172.37 2hpa n THR 2113N 0.41 0.00 -3.66 1.30 5.66 -1.26 -0.26 114.28 116.47 2hpa n THR 2113Ca -0.03 -1.95 -0.12 0.00 -3.05 0.00 0.00 64.05 58.90 2hpa n THR 2113Cb 0.52 1.12 -0.06 0.00 -1.55 0.00 0.00 70.33 70.36 2hpa n THR 2113CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2hpa s VAL 2114N -2.97 0.06 0.29 1.08 1.01 -1.26 -5.01 120.40 113.60 2hpa s VAL 2114Ca 0.32 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.49 2hpa s VAL 2114Cb -0.00 -1.03 -0.13 0.00 0.00 0.00 0.00 36.38 35.22 2hpa s VAL 2114CO 0.23 -0.28 1.30 -2.65 0.00 0.00 0.00 175.10 173.70 2hpa n PRO 2115N 0.27 1.98 -0.08 2.72 -0.02 -1.26 -3.71 135.00 134.90 2hpa n PRO 2115Ca -0.18 0.70 -0.07 0.00 -2.02 0.00 0.00 63.50 61.93 2hpa n PRO 2115Cb 0.61 -2.28 -0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2hpa n PRO 2115CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2hpa h LEU 2116N 3.21 -0.20 -1.30 2.45 3.38 -1.96 0.38 115.31 121.26 2hpa h LEU 2116Ca -0.45 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2hpa h LEU 2116Cb 1.29 0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.19 2hpa h LEU 2116CO 0.68 -0.06 0.20 0.77 0.09 0.00 0.00 178.44 180.11 2hpa h SER 2117N 0.04 0.00 0.00 -0.43 4.64 -1.98 -1.17 113.55 114.65 2hpa h SER 2117Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2hpa h SER 2117Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2hpa h SER 2117CO -0.27 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.07 2hpa n GLU 2118N -2.28 0.85 -2.14 4.77 1.02 0.82 -5.02 120.64 118.67 2hpa n GLU 2118Ca -0.01 -0.85 -0.43 0.00 -0.02 0.00 0.00 57.16 55.85 2hpa n GLU 2118Cb 0.23 -0.88 -0.02 0.00 -0.02 0.00 0.00 31.44 30.74 2hpa n GLU 2118CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2hpa s ASP 2119N -0.40 6.23 -0.58 1.62 -1.08 0.96 -4.87 116.67 118.54 2hpa s ASP 2119Ca 0.00 1.33 0.04 0.00 -0.52 0.00 0.00 52.55 53.40 2hpa s ASP 2119Cb 0.00 -2.53 0.37 0.00 -1.46 0.00 0.00 42.92 39.30 2hpa s ASP 2119CO 0.00 -1.43 1.18 1.67 0.52 0.00 0.00 175.17 177.11 2hpa n GLN 2120N 7.98 3.47 0.14 4.34 -0.06 -1.26 -4.54 117.38 127.46 2hpa n GLN 2120Ca 0.19 -4.59 0.00 0.00 -2.00 0.00 0.00 57.00 50.61 2hpa n GLN 2120Cb 0.46 -2.27 0.00 0.00 -4.06 0.00 0.00 30.24 24.38 2hpa n GLN 2120CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 2hpa n LEU 2121N -0.35 -2.57 -0.09 1.69 7.94 -1.26 -4.95 117.00 117.41 2hpa n LEU 2121Ca 0.38 0.61 -0.09 0.00 -1.11 0.00 0.00 56.01 55.79 2hpa n LEU 2121Cb 0.48 2.56 -0.13 0.00 0.53 0.00 0.00 43.42 46.85 2hpa n LEU 2121CO 0.37 0.07 -1.09 0.18 -1.11 0.00 0.00 177.39 175.81 2hpa n LEU 2122N -3.10 0.34 -3.90 -1.96 4.77 -1.26 -4.56 117.00 107.33 2hpa n LEU 2122Ca 0.00 -0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.55 2hpa n LEU 2122Cb 0.00 0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.37 2hpa n LEU 2122CO 0.00 0.48 2.39 0.00 -1.33 0.00 0.00 177.39 178.93 2hpa n TYR 2123N -2.70 3.35 -3.54 -1.77 9.36 -1.26 -4.60 117.16 115.99 2hpa n TYR 2123Ca -0.30 -2.63 -0.30 0.00 3.32 0.00 0.00 57.90 57.99 2hpa n TYR 2123Cb 1.05 -2.40 -0.04 0.00 -0.63 0.00 0.00 39.34 37.32 2hpa n TYR 2123CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 2hpa s LEU 2124N 2.82 4.19 0.16 2.98 1.02 -1.26 -4.21 118.68 124.38 2hpa s LEU 2124Ca 0.51 0.65 -0.30 0.00 0.02 0.00 0.00 54.13 55.01 2hpa s LEU 2124Cb 0.12 -3.41 -0.07 0.00 0.02 0.00 0.00 46.19 42.84 2hpa s LEU 2124CO -0.01 -0.05 0.98 -2.16 0.02 0.00 0.00 176.35 175.13 2hpa s PRO 2125N -3.04 4.72 0.01 1.29 0.04 -1.26 -4.24 135.00 132.52 2hpa s PRO 2125Ca 0.42 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.68 2hpa s PRO 2125Cb -0.11 -3.33 -0.07 0.00 0.04 0.00 0.00 34.50 31.03 2hpa s PRO 2125CO 0.26 0.27 1.70 -0.06 0.04 0.00 0.00 177.00 179.22 2hpa s PHE 2126N -0.39 2.03 -1.87 0.56 0.08 -1.26 -4.87 117.98 112.26 2hpa s PHE 2126Ca 0.46 0.13 0.22 0.00 0.12 0.00 0.00 56.93 57.86 2hpa s PHE 2126Cb -0.25 -3.99 -0.04 0.00 -0.57 0.00 0.00 43.02 38.17 2hpa s PHE 2126CO 0.32 -4.14 1.05 0.54 -0.10 0.00 0.00 175.22 172.89 2hpa n ARG 2127N 6.62 1.04 -0.69 0.44 5.12 -1.26 -4.25 116.66 123.68 2hpa n ARG 2127Ca 0.17 -0.84 -0.03 0.00 -1.93 0.00 0.00 57.85 55.21 2hpa n ARG 2127Cb 0.42 -1.48 0.22 0.00 -1.16 0.00 0.00 32.46 30.46 2hpa n ARG 2127CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2hpa n ASN 2128N -0.25 3.95 -4.20 0.55 6.94 -1.26 -4.76 115.26 116.23 2hpa n ASN 2128Ca 0.08 -2.80 -0.37 0.00 -0.02 0.00 0.00 54.58 51.47 2hpa n ASN 2128Cb 0.45 -0.67 -0.12 0.00 -2.36 0.00 0.00 39.78 37.08 2hpa n ASN 2128CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2hpa h PRO 2130N 8.13 -0.86 -0.95 0.00 0.11 -1.86 -1.69 132.00 134.88 2hpa h PRO 2130Ca -0.20 0.06 0.18 0.00 0.11 0.00 0.00 66.00 66.16 2hpa h PRO 2130Cb 1.07 0.20 -0.08 0.00 0.11 0.00 0.00 31.00 32.29 2hpa h PRO 2130CO 0.63 -0.57 0.61 -0.09 -0.21 0.00 0.00 178.00 178.36 2hpa h ARG 2131N -0.89 0.62 -0.48 1.05 9.65 -1.00 0.27 114.38 123.59 2hpa h ARG 2131Ca -0.04 -0.04 -0.13 0.00 -1.10 0.00 0.00 59.98 58.68 2hpa h ARG 2131Cb 0.81 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.24 2hpa h ARG 2131CO -0.13 0.41 -0.20 0.35 2.80 0.00 0.00 179.97 183.19 2hpa h PHE 2132N 0.63 1.13 0.00 2.20 3.57 -1.69 0.39 116.94 123.18 2hpa h PHE 2132Ca 0.52 -0.27 -0.04 0.00 3.53 0.00 0.00 57.97 61.70 2hpa h PHE 2132Cb 0.96 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 2hpa h PHE 2132CO -0.00 1.10 -0.19 1.96 -2.23 0.00 0.00 178.31 178.94 2hpa h GLN 2133N 0.84 0.00 0.28 1.11 1.08 -0.07 -1.20 115.11 117.16 2hpa h GLN 2133Ca 0.11 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.30 2hpa h GLN 2133Cb 0.78 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 2hpa h GLN 2133CO 0.06 0.19 -0.14 1.49 -0.95 0.00 0.00 178.83 179.49 2hpa h GLU 2134N 0.00 -0.37 -0.94 1.46 4.81 0.81 -2.11 114.58 118.25 2hpa h GLU 2134Ca -0.00 0.03 0.23 0.00 -0.13 0.00 0.00 59.36 59.49 2hpa h GLU 2134Cb 0.41 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.81 2hpa h GLU 2134CO 0.03 -0.02 0.63 -0.07 -0.73 0.00 0.00 179.01 178.84 2hpa h LEU 2135N -0.89 0.31 -0.03 1.64 3.38 0.22 0.11 115.31 120.04 2hpa h LEU 2135Ca -0.04 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2hpa h LEU 2135Cb 0.51 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2hpa h LEU 2135CO 0.06 0.11 -0.01 -0.33 0.09 0.00 0.00 178.44 178.36 2hpa h GLU 2136N 0.30 0.07 -0.51 1.13 5.08 -1.12 -1.21 114.58 118.32 2hpa h GLU 2136Ca 0.49 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.89 2hpa h GLU 2136Cb 1.39 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.58 2hpa h GLU 2136CO -0.16 0.44 0.16 0.77 -1.00 0.00 0.00 179.01 179.22 2hpa h SER 2137N -0.30 0.14 0.37 1.42 0.02 -0.12 -0.76 113.55 114.30 2hpa h SER 2137Ca 0.01 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2hpa h SER 2137Cb 0.41 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 2hpa h SER 2137CO 0.00 0.10 -0.26 -0.33 -1.14 0.00 0.00 176.83 175.21 2hpa h GLU 2138N 0.33 -0.59 -1.11 3.45 5.08 -1.12 -2.05 114.58 118.56 2hpa h GLU 2138Ca 0.25 0.04 0.31 0.00 -1.00 0.00 0.00 59.36 58.96 2hpa h GLU 2138Cb 0.29 0.13 -0.11 0.00 0.50 0.00 0.00 28.75 29.56 2hpa h GLU 2138CO -0.27 -0.39 0.71 1.15 -1.00 0.00 0.00 179.01 179.21 2hpa h THR 2139N -0.61 0.40 -0.57 1.13 2.02 -0.52 1.79 112.91 116.55 2hpa h THR 2139Ca -0.03 -0.11 -0.06 0.00 0.77 0.00 0.00 66.41 66.98 2hpa h THR 2139Cb 0.52 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 2hpa h THR 2139CO 0.01 0.06 0.14 -0.07 0.37 0.00 0.00 175.52 176.03 2hpa h LEU 2140N 0.31 0.88 -0.03 2.58 -0.00 -0.46 -2.50 115.31 116.07 2hpa h LEU 2140Ca 0.66 -0.24 0.00 0.00 -0.00 0.00 0.00 57.88 58.31 2hpa h LEU 2140Cb 1.80 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 42.23 2hpa h LEU 2140CO -0.35 0.88 0.00 0.29 -0.00 0.00 0.00 178.44 179.26 2hpa n LYS 2141N -4.38 0.08 -2.18 1.13 5.02 0.58 -4.56 118.16 113.86 2hpa n LYS 2141Ca 0.03 0.10 -0.38 0.00 -2.02 0.00 0.00 58.31 56.04 2hpa n LYS 2141Cb 0.24 -1.59 -0.01 0.00 -0.02 0.00 0.00 35.03 33.65 2hpa n LYS 2141CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2hpa s SER 2142N -3.44 6.29 0.19 4.39 1.04 0.40 -4.93 113.70 117.63 2hpa s SER 2142Ca 0.12 2.46 -0.07 0.00 0.48 0.00 0.00 55.95 58.94 2hpa s SER 2142Cb 0.16 -2.62 0.09 0.00 0.10 0.00 0.00 66.02 63.75 2hpa s SER 2142CO 0.51 -0.85 1.57 1.05 0.98 0.00 0.00 173.24 176.51 2hpa h GLU 2143N 2.43 0.85 -0.57 4.02 4.11 -1.89 -1.61 114.58 121.93 2hpa h GLU 2143Ca -0.49 -0.38 0.05 0.00 0.07 0.00 0.00 59.36 58.61 2hpa h GLU 2143Cb 1.25 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.43 2hpa h GLU 2143CO 0.62 1.02 0.30 1.49 0.07 0.00 0.00 179.01 182.50 2hpa h GLU 2144N 0.73 0.55 0.20 1.06 4.57 -1.91 0.37 114.58 120.14 2hpa h GLU 2144Ca 0.09 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 2hpa h GLU 2144Cb 0.82 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 2hpa h GLU 2144CO 0.07 0.36 -0.09 0.35 -1.18 0.00 0.00 179.01 178.52 2hpa h PHE 2145N 0.57 -0.25 -0.26 0.92 3.57 -1.77 -2.68 116.94 117.05 2hpa h PHE 2145Ca 0.25 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.82 2hpa h PHE 2145Cb 0.16 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2hpa h PHE 2145CO -0.10 0.05 0.19 1.96 -2.23 0.00 0.00 178.31 178.19 2hpa h GLN 2146N -0.54 0.00 0.01 1.11 1.08 -0.98 0.12 115.11 115.90 2hpa h GLN 2146Ca -0.03 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2hpa h GLN 2146Cb 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 2hpa h GLN 2146CO 0.04 0.00 -0.00 -0.22 -0.95 0.00 0.00 178.83 177.70 2hpa h LYS 2147N 0.00 -0.01 -0.67 1.46 3.11 -0.08 0.21 116.57 120.60 2hpa h LYS 2147Ca 0.12 0.00 -0.05 0.00 -2.81 0.00 0.00 60.65 57.91 2hpa h LYS 2147Cb 0.50 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.71 2hpa h LYS 2147CO -0.00 0.19 0.22 0.00 -2.81 0.00 0.00 179.45 177.04 2hpa h ARG 2148N -0.21 1.03 0.00 1.90 3.08 -0.79 -3.06 114.38 116.33 2hpa h ARG 2148Ca -0.00 -0.22 -0.11 0.00 0.07 0.00 0.00 59.98 59.72 2hpa h ARG 2148Cb 0.21 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2hpa h ARG 2148CO 0.00 0.89 -0.54 1.25 -1.07 0.00 0.00 179.97 180.50 2hpa h LEU 2149N 0.96 0.00 -0.22 3.04 5.85 -0.73 -3.37 115.31 120.85 2hpa h LEU 2149Ca 0.22 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.99 2hpa h LEU 2149Cb 0.28 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.24 2hpa h LEU 2149CO -0.01 0.54 -0.31 -0.74 -0.34 0.00 0.00 178.44 177.58 2hpa h HIS 2150N 0.00 -0.85 -0.26 1.25 2.76 -0.47 -2.39 115.15 115.19 2hpa h HIS 2150Ca -0.01 0.04 0.08 0.00 -2.20 0.00 0.00 60.37 58.28 2hpa h HIS 2150Cb 1.23 0.41 -0.01 0.00 1.55 0.00 0.00 27.41 30.59 2hpa h HIS 2150CO 0.00 -0.38 0.56 -1.35 -1.30 0.00 0.00 177.93 175.46 2hpa h PRO 2151N -0.33 0.00 0.00 5.26 0.11 -1.73 -1.77 132.00 133.54 2hpa h PRO 2151Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 2hpa h PRO 2151Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 2hpa h PRO 2151CO -0.41 0.00 -1.54 0.66 -0.21 0.00 0.00 178.00 176.50 2hpa n TYR 2152N -3.16 0.24 -0.20 0.65 4.01 -0.91 -4.60 117.16 113.20 2hpa n TYR 2152Ca 0.04 0.07 0.02 0.00 -0.16 0.00 0.00 57.90 57.87 2hpa n TYR 2152Cb 0.68 -0.54 0.06 0.00 -0.31 0.00 0.00 39.34 39.23 2hpa n TYR 2152CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2hpa n LYS 2153N -2.23 -0.08 0.10 -0.72 4.01 -0.67 -0.30 118.16 118.28 2hpa n LYS 2153Ca -0.01 0.85 -0.13 0.00 -0.51 0.00 0.00 58.31 58.50 2hpa n LYS 2153Cb 0.52 -1.27 -0.08 0.00 -0.51 0.00 0.00 35.03 33.69 2hpa n LYS 2153CO 0.00 0.00 0.00 0.22 -1.11 0.00 0.00 177.40 176.51 2hpa h ASP 2154N 0.00 -0.16 0.06 4.39 1.82 -1.81 -1.81 116.42 118.91 2hpa h ASP 2154Ca 0.24 -0.10 0.02 0.00 -0.39 0.00 0.00 57.03 56.79 2hpa h ASP 2154Cb 0.37 0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.40 2hpa h ASP 2154CO -0.56 -0.00 -0.18 0.15 -1.61 0.00 0.00 179.24 177.05 2hpa h PHE 2155N -0.32 -0.46 -0.66 0.28 3.04 -0.95 -2.29 116.94 115.58 2hpa h PHE 2155Ca -0.02 0.01 0.14 0.00 3.98 0.00 0.00 57.97 62.08 2hpa h PHE 2155Cb 0.25 0.20 -0.10 0.00 2.56 0.00 0.00 35.95 38.86 2hpa h PHE 2155CO -0.03 -0.26 0.09 0.82 -2.02 0.00 0.00 178.31 176.92 2hpa h ILE 2156N -0.32 0.53 -0.21 1.41 2.04 -0.86 0.24 117.51 120.34 2hpa h ILE 2156Ca 0.04 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 65.86 2hpa h ILE 2156Cb 0.36 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 2hpa h ILE 2156CO -0.12 0.04 0.03 0.00 0.00 0.00 0.00 178.15 178.10 2hpa h ALA 2157N 1.57 0.21 0.56 1.87 0.00 -0.93 -2.16 119.26 120.38 2hpa h ALA 2157Ca 0.36 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 2hpa h ALA 2157Cb 0.59 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.44 2hpa h ALA 2157CO -0.50 -0.40 -0.27 1.15 0.00 0.00 0.00 179.25 179.24 2hpa h THR 2158N 0.11 0.44 -0.89 0.00 2.02 -0.82 -2.84 112.91 110.93 2hpa h THR 2158Ca 0.10 -0.06 0.19 0.00 0.77 0.00 0.00 66.41 67.41 2hpa h THR 2158Cb 0.10 0.47 -0.17 0.00 -1.74 0.00 0.00 68.15 66.81 2hpa h THR 2158CO -0.14 0.01 -0.16 0.25 0.37 0.00 0.00 175.52 175.85 2hpa h LEU 2159N -0.79 -0.73 -0.89 2.58 7.12 -0.40 -0.32 115.31 121.88 2hpa h LEU 2159Ca -0.08 0.26 0.20 0.00 0.13 0.00 0.00 57.88 58.39 2hpa h LEU 2159Cb 0.59 0.52 -0.12 0.00 -0.53 0.00 0.00 40.66 41.13 2hpa h LEU 2159CO 0.13 -0.29 0.41 1.23 -0.13 0.00 0.00 178.44 179.79 2hpa h GLY 2160N 0.01 1.50 0.97 3.75 0.00 -1.14 0.46 103.07 108.62 2hpa h GLY 2160Ca 0.45 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.55 2hpa h GLY 2160CO -0.89 -0.20 0.16 0.50 0.00 0.00 0.00 176.54 176.11 2hpa h LYS 2161N 0.47 0.76 -0.00 4.80 1.79 -1.08 0.31 116.57 123.61 2hpa h LYS 2161Ca 0.53 -0.16 -0.01 0.00 -2.18 0.00 0.00 60.65 58.83 2hpa h LYS 2161Cb 0.95 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.49 2hpa h LYS 2161CO -0.48 0.71 -0.04 -0.07 -1.08 0.00 0.00 179.45 178.48 2hpa h LEU 2162N 0.66 0.05 -1.11 2.94 3.38 -1.00 -3.31 115.31 116.92 2hpa h LEU 2162Ca 0.16 -0.74 -0.07 0.00 0.09 0.00 0.00 57.88 57.32 2hpa h LEU 2162Cb 0.26 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2hpa h LEU 2162CO -0.01 0.78 -0.14 0.77 0.09 0.00 0.00 178.44 179.93 2hpa h SER 2163N -0.68 0.45 0.00 -0.43 4.64 -0.21 -3.43 113.55 113.89 2hpa h SER 2163Ca -0.00 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2hpa h SER 2163Cb 0.78 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2hpa h SER 2163CO 0.01 0.62 0.00 0.61 -0.87 0.00 0.00 176.83 177.20 2hpa n GLY 2164N -0.63 3.21 3.87 -0.77 0.00 0.09 -2.31 105.19 108.65 2hpa n GLY 2164Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2hpa n GLY 2164CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2hpa s LEU 2165N 0.00 4.40 -0.11 0.99 2.34 -1.18 -4.91 118.68 120.21 2hpa s LEU 2165Ca 0.00 0.52 -0.01 0.00 0.06 0.00 0.00 54.13 54.70 2hpa s LEU 2165Cb 0.00 -2.13 -0.03 0.00 -0.56 0.00 0.00 46.19 43.47 2hpa s LEU 2165CO 0.00 0.39 -0.05 -1.00 -1.06 0.00 0.00 176.35 174.64 2hpa s HIS 2166N -1.00 3.00 0.00 3.48 3.76 -1.26 -4.20 115.29 119.07 2hpa s HIS 2166Ca 0.16 -0.10 0.00 0.00 -0.15 0.00 0.00 55.06 54.97 2hpa s HIS 2166Cb -0.13 -1.82 0.00 0.00 1.11 0.00 0.00 32.58 31.74 2hpa s HIS 2166CO 0.05 0.19 0.00 0.41 -0.85 0.00 0.00 174.74 174.54 2hpa n GLY 2167N 2.75 0.87 0.00 -2.22 0.00 -1.26 -4.97 105.19 100.36 2hpa n GLY 2167Ca -0.18 0.46 0.02 0.00 0.00 0.00 0.00 46.02 46.31 2hpa n GLY 2167CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2hpa n GLN 2168N 0.00 0.12 -1.67 1.61 7.27 -1.26 -4.62 117.38 118.83 2hpa n GLN 2168Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 57.00 56.66 2hpa n GLN 2168Cb 0.00 -1.43 -0.03 0.00 2.41 0.00 0.00 30.24 31.19 2hpa n GLN 2168CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2hpa s ASP 2169N -1.98 5.18 0.54 1.69 2.15 -1.26 -4.83 116.67 118.16 2hpa s ASP 2169Ca 0.05 1.48 0.22 0.00 0.43 0.00 0.00 52.55 54.72 2hpa s ASP 2169Cb 0.02 -2.51 1.40 0.00 -0.30 0.00 0.00 42.92 41.54 2hpa s ASP 2169CO 0.04 -2.24 2.10 -0.07 -0.17 0.00 0.00 175.17 174.83 2hpa h LEU 2170N 16.39 0.00 -0.64 -1.34 3.38 -1.94 0.19 115.31 131.35 2hpa h LEU 2170Ca -0.34 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 2hpa h LEU 2170Cb 1.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 2hpa h LEU 2170CO 1.04 0.00 0.21 0.15 0.09 0.00 0.00 178.44 179.94 2hpa h PHE 2171N 0.00 1.02 0.05 1.13 3.04 -1.93 0.78 116.94 121.04 2hpa h PHE 2171Ca 0.09 -0.10 -0.00 0.00 3.98 0.00 0.00 57.97 61.94 2hpa h PHE 2171Cb 0.38 -0.30 0.00 0.00 2.56 0.00 0.00 35.95 38.59 2hpa h PHE 2171CO 0.00 0.83 -0.03 0.78 -2.02 0.00 0.00 178.31 177.87 2hpa h GLY 2172N 0.92 -0.08 0.21 2.40 0.00 -1.32 0.57 103.07 105.78 2hpa h GLY 2172Ca 0.21 0.03 0.15 0.00 0.00 0.00 0.00 47.33 47.72 2hpa h GLY 2172CO -0.01 -0.03 0.47 -2.22 0.00 0.00 0.00 176.54 174.75 2hpa h ILE 2173N -0.28 0.73 0.34 2.60 1.08 -1.06 0.55 117.51 121.48 2hpa h ILE 2173Ca -0.01 -0.22 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 2hpa h ILE 2173Cb 0.25 0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 2hpa h ILE 2173CO 0.01 0.12 -0.17 -0.25 -0.69 0.00 0.00 178.15 177.18 2hpa h TRP 2174N 0.65 -0.43 -0.38 1.37 7.01 -0.45 0.47 115.95 124.20 2hpa h TRP 2174Ca 0.48 -0.01 -0.15 0.00 2.11 0.00 0.00 58.89 61.32 2hpa h TRP 2174Cb 0.69 0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.88 2hpa h TRP 2174CO -0.08 -0.27 -0.35 0.66 -2.79 0.00 0.00 178.44 175.62 2hpa h SER 2175N -0.85 0.96 0.61 2.65 4.64 0.37 -1.16 113.55 120.77 2hpa h SER 2175Ca -0.05 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2hpa h SER 2175Cb 0.36 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2hpa h SER 2175CO 0.08 1.22 -0.39 0.29 -0.87 0.00 0.00 176.83 177.16 2hpa n LYS 2176N -4.10 0.00 0.07 4.77 5.02 0.19 -4.39 118.16 119.72 2hpa n LYS 2176Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2hpa n LYS 2176Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 2hpa n LYS 2176CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2hpa n VAL 2177N -1.50 0.05 0.18 -0.18 3.14 -1.06 -0.10 118.33 118.87 2hpa n VAL 2177Ca 0.06 0.02 -0.15 0.00 -2.96 0.00 0.00 64.34 61.31 2hpa n VAL 2177Cb 0.34 -0.59 -0.07 0.00 -1.06 0.00 0.00 33.84 32.46 2hpa n VAL 2177CO 0.00 0.00 0.00 0.22 -6.46 0.00 0.00 176.83 170.59 2hpa h TYR 2178N 0.00 -0.84 0.03 1.45 3.20 -0.84 -2.35 116.97 117.63 2hpa h TYR 2178Ca 0.00 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.91 2hpa h TYR 2178Cb 0.04 0.33 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 2hpa h TYR 2178CO 0.00 -0.44 -0.31 0.22 -1.64 0.00 0.00 178.16 175.98 2hpa h ASP 2179N -0.63 -0.93 -0.10 -2.11 3.58 -1.45 0.16 116.42 114.94 2hpa h ASP 2179Ca -0.01 0.12 0.03 0.00 0.42 0.00 0.00 57.03 57.59 2hpa h ASP 2179Cb 0.59 0.37 -0.06 0.00 1.72 0.00 0.00 39.33 41.95 2hpa h ASP 2179CO -0.09 -0.39 -0.54 -0.65 -2.88 0.00 0.00 179.24 174.70 2hpa h PRO 2180N -0.49 -0.58 -0.88 0.28 0.11 -1.75 0.32 132.00 129.02 2hpa h PRO 2180Ca 0.05 0.04 0.20 0.00 0.11 0.00 0.00 66.00 66.40 2hpa h PRO 2180Cb 0.56 0.13 -0.06 0.00 0.11 0.00 0.00 31.00 31.74 2hpa h PRO 2180CO -0.24 -0.39 0.58 -0.07 -0.21 0.00 0.00 178.00 177.68 2hpa h LEU 2181N -0.60 0.38 -0.33 2.35 3.38 -1.23 0.32 115.31 119.58 2hpa h LEU 2181Ca 0.03 0.04 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 2hpa h LEU 2181Cb 0.69 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2hpa h LEU 2181CO -0.42 0.16 -0.42 0.22 0.09 0.00 0.00 178.44 178.08 2hpa h TYR 2182N 0.38 1.05 -0.51 1.13 3.20 0.13 -0.74 116.97 121.62 2hpa h TYR 2182Ca 0.45 -0.34 -0.09 0.00 3.14 0.00 0.00 58.73 61.89 2hpa h TYR 2182Cb 1.15 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 2hpa h TYR 2182CO -0.00 1.15 -0.05 0.00 -1.64 0.00 0.00 178.16 177.62 2hpa h GLU 2184N 0.80 -0.28 -0.80 0.00 5.08 -1.01 -2.40 114.58 115.98 2hpa h GLU 2184Ca 0.14 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.58 2hpa h GLU 2184Cb 0.59 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.84 2hpa h GLU 2184CO 0.04 -0.09 0.48 0.66 -1.00 0.00 0.00 179.01 179.10 2hpa h SER 2185N -0.43 0.73 -0.77 1.42 4.64 -1.11 0.04 113.55 118.08 2hpa h SER 2185Ca -0.03 0.02 0.11 0.00 -0.47 0.00 0.00 61.79 61.43 2hpa h SER 2185Cb 0.32 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 62.24 2hpa h SER 2185CO 0.05 0.46 0.51 0.58 -0.87 0.00 0.00 176.83 177.56 2hpa h VAL 2186N 0.86 0.89 -0.44 0.95 2.07 -1.02 0.10 116.25 119.67 2hpa h VAL 2186Ca 0.35 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2hpa h VAL 2186Cb 0.20 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2hpa h VAL 2186CO -0.18 0.11 0.00 1.41 0.02 0.00 0.00 177.57 178.93 2hpa n HIS 2187N -4.50 1.54 -3.07 1.57 8.25 -0.40 -4.92 115.22 113.69 2hpa n HIS 2187Ca 0.14 -0.54 -0.20 0.00 -0.26 0.00 0.00 57.72 56.86 2hpa n HIS 2187Cb 0.40 -0.39 0.04 0.00 1.12 0.00 0.00 29.99 31.15 2hpa n HIS 2187CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2hpa n ASN 2188N 0.51 -5.61 -4.91 0.41 3.02 0.35 -5.01 115.26 104.02 2hpa n ASN 2188Ca 0.21 -0.31 -0.27 0.00 -0.03 0.00 0.00 54.58 54.18 2hpa n ASN 2188Cb 0.95 -4.38 -0.01 0.00 -0.61 0.00 0.00 39.78 35.72 2hpa n ASN 2188CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2hpa s PHE 2189N -3.15 3.53 -0.39 3.10 0.08 -0.14 -5.00 117.98 116.01 2hpa s PHE 2189Ca 0.34 0.73 -0.20 0.00 0.12 0.00 0.00 56.93 57.91 2hpa s PHE 2189Cb -0.15 -2.21 0.01 0.00 -0.57 0.00 0.00 43.02 40.10 2hpa s PHE 2189CO 0.42 -0.12 0.62 0.99 -0.10 0.00 0.00 175.22 177.03 2hpa s THR 2190N -2.53 4.88 0.65 0.64 2.01 -1.26 -4.44 115.64 115.58 2hpa s THR 2190Ca 0.46 0.38 -0.12 0.00 0.31 0.00 0.00 61.69 62.72 2hpa s THR 2190Cb -0.10 -4.11 -0.02 0.00 0.01 0.00 0.00 72.50 68.28 2hpa s THR 2190CO 0.40 -0.41 1.04 -0.76 -0.69 0.00 0.00 174.62 174.20 2hpa s LEU 2191N 2.72 3.24 0.50 4.42 1.02 -1.26 -5.02 118.68 124.30 2hpa s LEU 2191Ca 0.23 1.57 -0.22 0.00 0.02 0.00 0.00 54.13 55.73 2hpa s LEU 2191Cb -0.14 -4.49 -0.06 0.00 0.02 0.00 0.00 46.19 41.51 2hpa s LEU 2191CO 0.16 -1.17 1.23 -2.16 0.02 0.00 0.00 176.35 174.43 2hpa s PRO 2192N -4.91 3.48 0.31 1.29 0.04 -1.26 -4.88 135.00 129.07 2hpa s PRO 2192Ca 0.58 1.92 0.13 0.00 0.04 0.00 0.00 61.00 63.67 2hpa s PRO 2192Cb -0.13 -2.30 1.04 0.00 0.04 0.00 0.00 34.50 33.15 2hpa s PRO 2192CO 0.51 -0.82 1.40 -1.13 0.04 0.00 0.00 177.00 177.00 2hpa n SER 2193N -0.79 0.18 0.19 6.66 3.41 -1.26 0.75 113.62 122.76 2hpa n SER 2193Ca 0.09 1.48 0.05 0.00 -0.26 0.00 0.00 58.87 60.23 2hpa n SER 2193Cb 0.47 -0.67 0.36 0.00 -0.26 0.00 0.00 64.21 64.12 2hpa n SER 2193CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 2hpa h TRP 2194N 0.00 0.00 0.00 7.33 5.08 -2.02 -3.35 115.95 122.99 2hpa h TRP 2194Ca 0.69 0.00 -0.58 0.00 1.08 0.00 0.00 58.89 60.08 2hpa h TRP 2194Cb 1.72 0.00 0.04 0.00 -3.00 0.00 0.00 29.16 27.92 2hpa h TRP 2194CO -0.15 0.37 2.33 0.00 -1.28 0.00 0.00 178.44 179.72 2hpa n ALA 2195N -2.34 3.54 -2.31 0.11 0.00 0.23 -4.74 120.51 114.99 2hpa n ALA 2195Ca -0.01 -2.96 -0.26 0.00 0.00 0.00 0.00 53.44 50.21 2hpa n ALA 2195Cb 0.47 -3.48 0.00 0.00 0.00 0.00 0.00 19.45 16.44 2hpa n ALA 2195CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2hpa s THR 2196N 4.69 4.73 0.24 0.00 -4.23 -1.26 -4.79 115.64 115.02 2hpa s THR 2196Ca 0.53 0.02 -0.12 0.00 -1.18 0.00 0.00 61.69 60.94 2hpa s THR 2196Cb 0.13 -3.79 0.33 0.00 1.34 0.00 0.00 72.50 70.51 2hpa s THR 2196CO 0.09 -0.72 1.58 -0.08 -0.54 0.00 0.00 174.62 174.94 2hpa h GLU 2197N 0.27 -0.02 0.27 3.99 4.22 -1.96 0.63 114.58 121.99 2hpa h GLU 2197Ca -0.47 0.00 0.01 0.00 0.08 0.00 0.00 59.36 58.98 2hpa h GLU 2197Cb 1.22 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.43 2hpa h GLU 2197CO 0.61 -0.01 -0.44 0.22 -2.18 0.00 0.00 179.01 177.21 2hpa h ASP 2198N -0.02 -1.27 -0.71 1.04 1.82 -1.95 0.92 116.42 116.25 2hpa h ASP 2198Ca 0.38 0.12 0.15 0.00 -0.39 0.00 0.00 57.03 57.30 2hpa h ASP 2198Cb 0.62 0.45 -0.13 0.00 0.68 0.00 0.00 39.33 40.95 2hpa h ASP 2198CO -0.88 -0.55 -0.09 0.74 -1.61 0.00 0.00 179.24 176.86 2hpa h THR 2199N -0.78 0.34 -0.23 2.25 2.02 -0.32 0.10 112.91 116.29 2hpa h THR 2199Ca -0.01 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.19 2hpa h THR 2199Cb 0.74 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 2hpa h THR 2199CO -0.17 0.01 0.03 0.24 0.37 0.00 0.00 175.52 176.00 2hpa h MET 2200N 0.05 0.11 -0.86 6.66 2.86 0.10 0.24 114.93 124.09 2hpa h MET 2200Ca 0.36 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.99 2hpa h MET 2200Cb 0.60 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 2hpa h MET 2200CO -0.68 0.07 0.52 1.15 1.06 0.00 0.00 176.91 179.04 2hpa h THR 2201N 0.11 1.24 -0.15 2.22 2.02 0.13 0.24 112.91 118.72 2hpa h THR 2201Ca 0.11 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 2hpa h THR 2201Cb 0.12 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 2hpa h THR 2201CO -0.16 0.25 -0.00 0.11 0.37 0.00 0.00 175.52 176.09 2hpa h LYS 2202N 1.18 0.26 -0.49 6.66 1.79 -0.39 -1.88 116.57 123.70 2hpa h LYS 2202Ca 0.31 -0.08 0.04 0.00 -2.18 0.00 0.00 60.65 58.73 2hpa h LYS 2202Cb -0.06 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.53 2hpa h LYS 2202CO -0.06 0.49 0.26 -0.07 -1.08 0.00 0.00 179.45 178.99 2hpa h LEU 2203N 0.00 0.38 -0.49 2.94 3.38 0.16 -0.11 115.31 121.58 2hpa h LEU 2203Ca 0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2hpa h LEU 2203Cb 0.37 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2hpa h LEU 2203CO 0.01 0.27 0.31 -0.09 0.09 0.00 0.00 178.44 179.02 2hpa h ARG 2204N 0.51 0.65 -0.99 1.13 2.43 -0.51 0.12 114.38 117.72 2hpa h ARG 2204Ca 0.21 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 2hpa h ARG 2204Cb 0.10 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.46 2hpa h ARG 2204CO -0.14 0.46 0.65 0.93 -1.51 0.00 0.00 179.97 180.36 2hpa h GLU 2205N 0.65 1.27 -0.52 0.20 5.08 -0.82 0.44 114.58 120.88 2hpa h GLU 2205Ca 0.18 -0.08 -0.12 0.00 -1.00 0.00 0.00 59.36 58.34 2hpa h GLU 2205Cb -0.04 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 28.91 2hpa h GLU 2205CO -0.04 0.84 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.58 2hpa h LEU 2206N 1.31 1.04 -0.04 1.33 3.38 0.03 0.10 115.31 122.46 2hpa h LEU 2206Ca 0.37 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2hpa h LEU 2206Cb -0.11 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.35 2hpa h LEU 2206CO -0.09 1.18 0.01 0.28 0.09 0.00 0.00 178.44 179.91 2hpa h SER 2207N 0.90 0.02 -0.44 -0.43 0.02 0.47 0.35 113.55 114.44 2hpa h SER 2207Ca 0.13 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2hpa h SER 2207Cb 0.74 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 2hpa h SER 2207CO 0.06 0.02 0.25 -0.33 -1.14 0.00 0.00 176.83 175.68 2hpa h GLU 2208N 0.04 0.48 -0.87 3.45 5.08 -0.02 -0.96 114.58 121.78 2hpa h GLU 2208Ca 0.02 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2hpa h GLU 2208Cb 0.01 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 2hpa h GLU 2208CO -0.02 0.32 0.58 1.25 -1.00 0.00 0.00 179.01 180.14 2hpa h LEU 2209N 0.50 0.99 -0.16 1.33 5.85 -0.00 -1.55 115.31 122.27 2hpa h LEU 2209Ca 0.18 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.91 2hpa h LEU 2209Cb 0.04 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 2hpa h LEU 2209CO -0.10 0.71 -0.03 -1.28 -0.34 0.00 0.00 178.44 177.41 2hpa h SER 2210N 1.17 -0.12 0.01 1.25 0.87 0.65 0.15 113.55 117.53 2hpa h SER 2210Ca 0.32 0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.94 2hpa h SER 2210Cb -0.12 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2hpa h SER 2210CO -0.08 -0.04 -0.07 0.25 -0.53 0.00 0.00 176.83 176.36 2hpa h LEU 2211N 0.01 -0.20 0.16 2.23 5.85 -0.70 -0.89 115.31 121.78 2hpa h LEU 2211Ca 0.08 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.84 2hpa h LEU 2211Cb 0.11 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 2hpa h LEU 2211CO -0.15 -0.10 -0.34 -0.07 -0.34 0.00 0.00 178.44 177.43 2hpa h LEU 2212N -0.13 -0.97 -1.98 2.25 3.38 -0.91 -0.07 115.31 116.88 2hpa h LEU 2212Ca 0.02 0.11 0.14 0.00 0.09 0.00 0.00 57.88 58.24 2hpa h LEU 2212Cb 0.16 0.36 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2hpa h LEU 2212CO -0.06 -0.44 0.46 0.77 0.09 0.00 0.00 178.44 179.26 2hpa h SER 2213N -0.59 0.00 -0.11 -0.43 4.64 -0.44 0.83 113.55 117.44 2hpa h SER 2213Ca 0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.32 2hpa h SER 2213Cb 0.61 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2hpa h SER 2213CO -0.17 0.00 -0.02 0.25 -0.87 0.00 0.00 176.83 176.02 2hpa h LEU 2214N 0.00 0.21 -0.88 5.97 6.46 0.43 -3.33 115.31 124.17 2hpa h LEU 2214Ca 0.23 -0.36 0.00 0.00 -0.12 0.00 0.00 57.88 57.63 2hpa h LEU 2214Cb 1.14 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.02 2hpa h LEU 2214CO -0.00 0.52 -0.30 -1.22 -0.62 0.00 0.00 178.44 176.82 2hpa n TYR 2215N -4.76 0.00 -0.51 1.25 4.01 -0.45 -4.97 117.16 111.73 2hpa n TYR 2215Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 2hpa n TYR 2215Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 2hpa n TYR 2215CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2hpa n GLY 2216N 1.09 4.34 1.77 2.72 0.00 0.27 -4.60 105.19 110.78 2hpa n GLY 2216Ca 0.06 -0.53 -0.05 0.00 0.00 0.00 0.00 46.02 45.50 2hpa n GLY 2216CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2hpa n ILE 2217N 0.00 0.00 0.00 -0.61 -5.35 -1.26 -4.51 119.36 107.63 2hpa n ILE 2217Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2hpa n ILE 2217Cb 0.00 -0.58 0.00 0.00 -1.74 0.00 0.00 39.64 37.32 2hpa n ILE 2217CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 2hpa n HIS 2218N -1.25 0.00 -2.71 4.28 -0.00 -1.26 -4.61 115.22 109.67 2hpa n HIS 2218Ca -0.05 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 57.47 2hpa n HIS 2218Cb 0.22 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.21 2hpa n HIS 2218CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2hpa n LYS 2219N 0.00 -2.99 -0.26 1.57 5.02 -1.26 -4.88 118.16 115.36 2hpa n LYS 2219Ca 0.00 0.83 -0.10 0.00 -2.02 0.00 0.00 58.31 57.02 2hpa n LYS 2219Cb 0.00 -5.55 -0.06 0.00 -0.02 0.00 0.00 35.03 29.40 2hpa n LYS 2219CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 2hpa h GLN 2220N -0.54 -0.19 -0.70 1.97 4.15 -1.84 -2.00 115.11 115.96 2hpa h GLN 2220Ca -0.46 0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.12 2hpa h GLN 2220Cb 1.33 0.04 -0.13 0.00 0.21 0.00 0.00 27.48 28.93 2hpa h GLN 2220CO 0.52 -0.13 -0.15 0.87 -1.93 0.00 0.00 178.83 178.02 2hpa h LYS 2221N -0.20 0.01 0.14 1.69 1.79 -1.90 0.50 116.57 118.60 2hpa h LYS 2221Ca 0.16 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.62 2hpa h LYS 2221Cb 0.54 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.18 2hpa h LYS 2221CO -0.76 0.01 -0.07 1.49 -1.08 0.00 0.00 179.45 179.04 2hpa h GLU 2222N 0.01 -0.18 -0.78 3.15 4.81 -1.73 -0.05 114.58 119.81 2hpa h GLU 2222Ca 0.34 0.01 0.16 0.00 -0.13 0.00 0.00 59.36 59.75 2hpa h GLU 2222Cb 0.54 0.04 -0.11 0.00 0.63 0.00 0.00 28.75 29.85 2hpa h GLU 2222CO -0.71 -0.03 0.27 0.87 -0.73 0.00 0.00 179.01 178.68 2hpa h LYS 2223N -0.29 0.36 -0.80 1.92 1.57 -0.89 0.18 116.57 118.62 2hpa h LYS 2223Ca -0.02 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 2hpa h LYS 2223Cb 0.23 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 2hpa h LYS 2223CO 0.03 0.24 0.51 0.77 -0.57 0.00 0.00 179.45 180.43 2hpa h SER 2224N 0.37 0.84 0.38 0.86 0.02 0.10 0.22 113.55 116.35 2hpa h SER 2224Ca 0.44 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 2hpa h SER 2224Cb 0.74 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2hpa h SER 2224CO -0.47 0.58 0.00 0.03 -1.14 0.00 0.00 176.83 175.83 2hpa h ARG 2225N 0.99 0.00 0.00 3.45 3.08 0.12 0.11 114.38 122.13 2hpa h ARG 2225Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2hpa h ARG 2225Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2hpa h ARG 2225CO -0.12 0.00 -1.19 1.28 -1.07 0.00 0.00 179.97 178.87 2hpa n LEU 2226N -3.01 0.60 0.00 3.04 4.77 0.44 -3.77 117.00 119.08 2hpa n LEU 2226Ca -0.01 -0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.62 2hpa n LEU 2226Cb 0.15 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2hpa n LEU 2226CO 0.22 0.15 0.00 0.00 -1.33 0.00 0.00 177.39 176.43 2hpa n GLN 2227N -1.67 0.00 -0.32 3.23 1.13 0.49 -4.73 117.38 115.52 2hpa n GLN 2227Ca 0.01 0.00 0.19 0.00 -1.94 0.00 0.00 57.00 55.26 2hpa n GLN 2227Cb 0.36 0.00 0.39 0.00 0.11 0.00 0.00 30.24 31.09 2hpa n GLN 2227CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2hpa h GLY 2228N 0.00 1.69 -0.73 1.08 0.00 -1.61 -0.69 103.07 102.80 2hpa h GLY 2228Ca 0.00 -0.09 0.34 0.00 0.00 0.00 0.00 47.33 47.58 2hpa h GLY 2228CO 0.00 -0.48 0.46 -1.33 0.00 0.00 0.00 176.54 175.18 2hpa h GLY 2229N 0.19 1.97 0.35 4.60 0.00 -0.92 0.22 103.07 109.47 2hpa h GLY 2229Ca 0.65 -0.14 0.09 0.00 0.00 0.00 0.00 47.33 47.93 2hpa h GLY 2229CO -0.69 -0.59 0.12 -2.08 0.00 0.00 0.00 176.54 173.30 2hpa h VAL 2230N 0.16 0.72 -0.19 4.60 2.07 -1.31 0.18 116.25 122.49 2hpa h VAL 2230Ca 0.74 -0.09 -0.09 0.00 0.82 0.00 0.00 66.70 68.08 2hpa h VAL 2230Cb 1.76 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 2hpa h VAL 2230CO -0.70 0.05 -0.24 0.25 0.02 0.00 0.00 177.57 176.94 2hpa h LEU 2231N 0.26 0.54 -0.59 2.57 6.46 -0.81 -2.47 115.31 121.28 2hpa h LEU 2231Ca 0.26 -0.50 0.11 0.00 -0.12 0.00 0.00 57.88 57.63 2hpa h LEU 2231Cb 0.35 -0.15 -0.08 0.00 -0.73 0.00 0.00 40.66 40.04 2hpa h LEU 2231CO -0.33 0.94 0.14 0.58 -0.62 0.00 0.00 178.44 179.15 2hpa h VAL 2232N 0.16 0.67 0.02 1.05 2.07 -0.35 0.16 116.25 120.03 2hpa h VAL 2232Ca 0.02 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.46 2hpa h VAL 2232Cb 0.80 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2hpa h VAL 2232CO 0.06 0.05 -0.08 -1.13 0.02 0.00 0.00 177.57 176.49 2hpa h ASN 2233N 0.28 -0.23 -0.16 0.57 -0.00 -0.64 0.19 115.58 115.60 2hpa h ASN 2233Ca 0.31 0.03 0.03 0.00 -0.00 0.00 0.00 56.30 56.67 2hpa h ASN 2233Cb 0.44 0.09 -0.06 0.00 -0.00 0.00 0.00 38.32 38.79 2hpa h ASN 2233CO -0.38 -0.12 -0.54 -0.08 -0.00 0.00 0.00 177.43 176.32 2hpa h GLU 2234N -0.15 -0.54 -0.46 6.67 4.57 -0.41 0.78 114.58 125.05 2hpa h GLU 2234Ca 0.03 0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.27 2hpa h GLU 2234Cb 0.18 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 2hpa h GLU 2234CO -0.07 -0.36 0.25 0.82 -1.18 0.00 0.00 179.01 178.47 2hpa h ILE 2235N -0.56 1.01 -0.38 2.32 2.04 -0.55 -1.38 117.51 120.01 2hpa h ILE 2235Ca 0.03 -0.17 0.06 0.00 1.00 0.00 0.00 64.86 65.79 2hpa h ILE 2235Cb 0.66 0.46 -0.06 0.00 -0.74 0.00 0.00 36.82 37.14 2hpa h ILE 2235CO -0.44 0.09 0.03 0.25 0.00 0.00 0.00 178.15 178.08 2hpa h LEU 2236N 0.51 -0.09 -1.41 1.44 6.46 0.22 -1.48 115.31 120.95 2hpa h LEU 2236Ca 0.19 0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 58.03 2hpa h LEU 2236Cb 0.06 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.09 2hpa h LEU 2236CO -0.11 -0.01 0.31 0.78 -0.62 0.00 0.00 178.44 178.79 2hpa h ASN 2237N 0.14 0.62 -0.62 1.25 -0.26 0.18 0.28 115.58 117.16 2hpa h ASN 2237Ca 0.18 -0.03 -0.09 0.00 -0.56 0.00 0.00 56.30 55.80 2hpa h ASN 2237Cb 0.25 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.32 2hpa h ASN 2237CO -0.28 0.49 0.04 0.45 -1.06 0.00 0.00 177.43 177.06 2hpa h HIS 2238N 0.72 1.16 -0.33 1.19 3.86 -0.50 -2.00 115.15 119.26 2hpa h HIS 2238Ca 0.19 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.19 2hpa h HIS 2238Cb -0.02 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.13 2hpa h HIS 2238CO 0.00 1.01 0.10 0.52 0.86 0.00 0.00 177.93 180.42 2hpa h MET 2239N 0.99 0.51 -0.78 2.45 2.86 -0.25 0.11 114.93 120.82 2hpa h MET 2239Ca 0.18 -0.11 0.07 0.00 -2.06 0.00 0.00 59.70 57.78 2hpa h MET 2239Cb 0.52 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.04 2hpa h MET 2239CO 0.02 0.54 0.47 0.87 1.06 0.00 0.00 176.91 179.87 2hpa h LYS 2240N 0.37 0.82 -0.12 1.72 1.79 -0.85 -1.23 116.57 119.07 2hpa h LYS 2240Ca 0.11 -0.05 -0.15 0.00 -2.18 0.00 0.00 60.65 58.37 2hpa h LYS 2240Cb 0.25 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 2hpa h LYS 2240CO -0.00 0.54 -0.57 0.00 -1.08 0.00 0.00 179.45 178.33 2hpa h ARG 2241N 0.84 0.38 0.00 3.15 3.08 -1.13 -1.15 114.38 119.55 2hpa h ARG 2241Ca 0.35 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2hpa h ARG 2241Cb 0.20 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2hpa h ARG 2241CO -0.19 0.85 0.00 0.00 -1.07 0.00 0.00 179.97 179.56 2hpa h ALA 2242N 1.10 1.00 0.00 0.04 0.00 0.29 0.32 119.26 122.01 2hpa h ALA 2242Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2hpa h ALA 2242Cb 1.09 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2hpa h ALA 2242CO 0.10 0.00 -1.44 2.41 0.00 0.00 0.00 179.25 180.32 2hpa n THR 2243N -2.60 0.72 -0.04 0.00 -1.04 -0.48 -4.48 114.28 106.37 2hpa n THR 2243Ca -0.01 -0.61 -0.01 0.00 -2.04 0.00 0.00 64.05 61.38 2hpa n THR 2243Cb 0.12 -0.40 -0.10 0.00 -1.82 0.00 0.00 70.33 68.13 2hpa n THR 2243CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hpa n GLN 2244N -2.66 1.38 -4.14 -2.82 6.02 -0.54 -4.97 117.38 109.64 2hpa n GLN 2244Ca -0.06 -0.05 -0.34 0.00 -0.01 0.00 0.00 57.00 56.54 2hpa n GLN 2244Cb 0.69 -1.32 -0.15 0.00 1.02 0.00 0.00 30.24 30.48 2hpa n GLN 2244CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 2hpa s ILE 2245N -2.54 2.64 0.57 5.09 -5.25 0.10 -5.09 121.20 116.72 2hpa s ILE 2245Ca -0.06 -0.75 -0.15 0.00 -0.99 0.00 0.00 60.65 58.70 2hpa s ILE 2245Cb 0.06 -2.15 -0.06 0.00 2.95 0.00 0.00 42.46 43.26 2hpa s ILE 2245CO 0.53 0.49 1.01 -2.16 -1.79 0.00 0.00 174.94 173.03 2hpa s PRO 2246N 1.24 3.68 -0.78 0.37 0.04 -1.26 -3.53 135.00 134.76 2hpa s PRO 2246Ca 0.03 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.02 2hpa s PRO 2246Cb -0.14 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2hpa s PRO 2246CO -0.07 -0.50 0.00 0.43 0.04 0.00 0.00 177.00 176.90 2hpa n SER 2247N -2.05 -3.21 -4.93 6.66 7.64 -1.26 -5.02 113.62 111.44 2hpa n SER 2247Ca 0.07 0.02 -0.26 0.00 1.01 0.00 0.00 58.87 59.71 2hpa n SER 2247Cb 0.54 -2.39 0.06 0.00 -1.01 0.00 0.00 64.21 61.41 2hpa n SER 2247CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2hpa s TYR 2248N -2.43 2.98 0.31 1.43 5.04 -1.23 -4.98 117.35 118.47 2hpa s TYR 2248Ca 0.00 0.45 -0.30 0.00 -2.44 0.00 0.00 57.07 54.79 2hpa s TYR 2248Cb 0.00 -3.07 -0.11 0.00 0.35 0.00 0.00 41.96 39.12 2hpa s TYR 2248CO 0.00 -1.25 1.58 1.63 -1.34 0.00 0.00 175.55 176.16 2hpa n LYS 2249N -2.81 2.70 0.05 4.97 4.76 -1.26 -4.82 118.16 121.75 2hpa n LYS 2249Ca 0.07 0.96 -0.17 0.00 -2.87 0.00 0.00 58.31 56.30 2hpa n LYS 2249Cb 0.60 -2.73 -0.14 0.00 -1.84 0.00 0.00 35.03 30.91 2hpa n LYS 2249CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2hpa h LYS 2250N 4.41 0.24 -4.11 1.97 1.57 -1.00 -3.46 116.57 116.20 2hpa h LYS 2250Ca -0.48 -0.41 -0.28 0.00 -1.87 0.00 0.00 60.65 57.61 2hpa h LYS 2250Cb 1.23 0.15 -0.27 0.00 0.08 0.00 0.00 32.23 33.42 2hpa h LYS 2250CO 0.76 1.09 -0.74 -1.17 -0.57 0.00 0.00 179.45 178.83 2hpa s LEU 2251N -6.94 2.04 -0.08 2.94 2.96 -0.70 -0.78 118.68 118.12 2hpa s LEU 2251Ca -0.10 -0.12 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 2hpa s LEU 2251Cb 0.07 -0.15 0.03 0.00 0.50 0.00 0.00 46.19 46.64 2hpa s LEU 2251CO 0.84 0.00 -0.02 -0.63 -1.32 0.00 0.00 176.35 175.22 2hpa s ILE 2252N -0.24 0.58 -0.14 6.68 1.01 -0.76 -1.95 121.20 126.38 2hpa s ILE 2252Ca -0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.58 2hpa s ILE 2252Cb -0.02 -0.69 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 2hpa s ILE 2252CO -0.00 0.29 0.03 -0.04 0.00 0.00 0.00 174.94 175.22 2hpa s MET 2253N 1.82 3.59 -0.41 2.79 -1.94 0.92 -1.84 119.30 124.22 2hpa s MET 2253Ca 0.04 -0.38 0.03 0.00 -1.71 0.00 0.00 55.69 53.67 2hpa s MET 2253Cb -0.12 -3.03 0.11 0.00 2.01 0.00 0.00 34.83 33.80 2hpa s MET 2253CO -0.06 0.43 0.14 0.71 -0.01 0.00 0.00 175.02 176.24 2hpa s TYR 2254N -0.11 3.54 -0.22 -0.03 2.02 -0.05 0.71 117.35 123.22 2hpa s TYR 2254Ca 0.05 -3.03 -0.29 0.00 -0.37 0.00 0.00 57.07 53.43 2hpa s TYR 2254Cb -0.12 -2.91 0.00 0.00 -0.40 0.00 0.00 41.96 38.53 2hpa s TYR 2254CO 0.02 -0.87 1.12 0.45 -1.57 0.00 0.00 175.55 174.69 2hpa s SER 2255N 0.52 7.03 0.00 2.29 0.15 0.18 -1.23 113.70 122.64 2hpa s SER 2255Ca 0.13 1.45 0.00 0.00 0.70 0.00 0.00 55.95 58.23 2hpa s SER 2255Cb -0.22 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 2hpa s SER 2255CO -0.05 -0.73 0.00 0.00 1.20 0.00 0.00 173.24 173.67 2hpa n ALA 2256N 6.49 0.00 -2.50 5.45 0.00 0.52 -2.74 120.51 127.73 2hpa n ALA 2256Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.31 2hpa n ALA 2256Cb 0.46 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.82 2hpa n ALA 2256CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2hpa s HIS 2257N 0.37 2.58 0.28 0.00 3.76 -1.26 -1.44 115.29 119.59 2hpa s HIS 2257Ca 0.00 -0.58 0.28 0.00 -0.15 0.00 0.00 55.06 54.62 2hpa s HIS 2257Cb 0.00 -1.82 1.32 0.00 1.11 0.00 0.00 32.58 33.19 2hpa s HIS 2257CO 0.00 0.31 1.99 0.38 -0.85 0.00 0.00 174.74 176.57 2hpa h ASP 2258N 1.58 0.00 1.92 1.40 2.03 -1.91 -0.47 116.42 120.98 2hpa h ASP 2258Ca -0.43 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.87 2hpa h ASP 2258Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 2hpa h ASP 2258CO 0.72 0.13 0.00 0.71 -1.03 0.00 0.00 179.24 179.77 2hpa h THR 2259N 0.00 0.00 0.07 1.15 1.35 -1.96 -1.78 112.91 111.74 2hpa h THR 2259Ca -0.00 -0.94 -0.15 0.00 -0.55 0.00 0.00 66.41 64.76 2hpa h THR 2259Cb 0.49 1.94 0.02 0.00 -1.73 0.00 0.00 68.15 68.86 2hpa h THR 2259CO 0.02 0.00 -0.64 0.74 -0.25 0.00 0.00 175.52 175.39 2hpa h THR 2260N 0.00 1.50 0.70 6.82 2.02 -1.29 -1.01 112.91 121.65 2hpa h THR 2260Ca 0.00 -2.31 -0.03 0.00 0.77 0.00 0.00 66.41 64.84 2hpa h THR 2260Cb 0.96 2.96 0.01 0.00 -1.74 0.00 0.00 68.15 70.33 2hpa h THR 2260CO 0.00 0.65 -0.33 0.58 0.37 0.00 0.00 175.52 176.79 2hpa h VAL 2261N -0.33 0.20 -0.59 3.16 2.07 -1.39 -0.98 116.25 118.40 2hpa h VAL 2261Ca -0.10 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.27 2hpa h VAL 2261Cb 1.43 0.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.39 2hpa h VAL 2261CO 0.12 0.02 0.29 0.77 0.02 0.00 0.00 177.57 178.79 2hpa h SER 2262N -1.10 0.41 -0.36 0.57 4.64 -1.46 0.28 113.55 116.52 2hpa h SER 2262Ca -0.10 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 2hpa h SER 2262Cb 0.75 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.78 2hpa h SER 2262CO 0.16 0.27 0.21 1.23 -0.87 0.00 0.00 176.83 177.83 2hpa h GLY 2263N 0.55 0.56 0.50 -0.77 0.00 -1.17 0.09 103.07 102.83 2hpa h GLY 2263Ca 0.27 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 2hpa h GLY 2263CO -0.20 0.22 -0.01 -2.00 0.00 0.00 0.00 176.54 174.56 2hpa h LEU 2264N 0.53 -0.02 -1.28 3.11 5.85 0.29 -3.06 115.31 120.73 2hpa h LEU 2264Ca 0.14 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 2hpa h LEU 2264Cb 0.01 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2hpa h LEU 2264CO -0.02 0.48 0.01 1.56 -0.34 0.00 0.00 178.44 180.12 2hpa h GLN 2265N -0.53 0.49 -0.09 1.25 4.20 -0.75 -1.96 115.11 117.72 2hpa h GLN 2265Ca -0.00 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.53 2hpa h GLN 2265Cb 0.50 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 2hpa h GLN 2265CO 0.00 0.51 -0.29 0.52 -0.67 0.00 0.00 178.83 178.90 2hpa h MET 2266N 0.47 0.17 -0.00 1.46 2.86 -1.04 0.36 114.93 119.21 2hpa h MET 2266Ca 0.10 -0.06 -0.20 0.00 -2.06 0.00 0.00 59.70 57.49 2hpa h MET 2266Cb 0.30 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2hpa h MET 2266CO 0.01 0.45 -0.87 0.00 1.06 0.00 0.00 176.91 177.56 2hpa h ALA 2267N 1.55 0.51 0.00 6.32 0.00 -1.32 -2.77 119.26 123.55 2hpa h ALA 2267Ca 0.02 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2hpa h ALA 2267Cb 0.60 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2hpa h ALA 2267CO 0.04 0.88 -0.22 1.28 0.00 0.00 0.00 179.25 181.23 2hpa n LEU 2268N -3.70 0.39 -2.91 0.00 4.77 -0.78 -4.92 117.00 109.86 2hpa n LEU 2268Ca -0.04 0.35 -0.18 0.00 -0.03 0.00 0.00 56.01 56.11 2hpa n LEU 2268Cb 0.80 -0.35 0.06 0.00 -2.33 0.00 0.00 43.42 41.60 2hpa n LEU 2268CO 0.48 -0.01 0.18 -0.67 -1.33 0.00 0.00 177.39 176.04 2hpa n ASP 2269N -1.75 -5.01 -0.00 -1.43 -0.08 0.99 -4.49 116.55 104.78 2hpa n ASP 2269Ca 0.06 -0.43 0.00 0.00 -1.51 0.00 0.00 54.79 52.91 2hpa n ASP 2269Cb 0.37 -4.03 0.00 0.00 2.34 0.00 0.00 41.12 39.80 2hpa n ASP 2269CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 2hpa n VAL 2270N -4.33 0.63 -2.13 5.18 0.24 0.43 -4.45 118.33 113.89 2hpa n VAL 2270Ca -0.02 -0.63 -0.42 0.00 -2.04 0.00 0.00 64.34 61.23 2hpa n VAL 2270Cb 0.56 0.68 -0.03 0.00 -1.47 0.00 0.00 33.84 33.58 2hpa n VAL 2270CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2hpa s TYR 2271N -0.64 3.19 -2.02 6.34 5.04 -1.10 -4.91 117.35 123.25 2hpa s TYR 2271Ca 0.00 1.01 0.29 0.00 -2.44 0.00 0.00 57.07 55.93 2hpa s TYR 2271Cb 0.00 -3.71 1.22 0.00 0.35 0.00 0.00 41.96 39.82 2hpa s TYR 2271CO 0.00 -2.39 1.84 0.27 -1.34 0.00 0.00 175.55 173.93 2hpa n ASN 2272N 3.28 0.82 0.00 4.32 0.23 -1.26 -4.93 115.26 117.73 2hpa n ASN 2272Ca 0.09 -1.02 0.00 0.00 -0.53 0.00 0.00 54.58 53.12 2hpa n ASN 2272Cb 0.42 -0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 2hpa n ASN 2272CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2hpa n GLY 2273N 1.20 2.98 3.86 4.83 0.00 -1.26 -5.01 105.19 111.79 2hpa n GLY 2273Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2hpa n GLY 2273CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hpa s LEU 2274N 0.00 3.29 -0.06 0.99 1.43 -1.26 -4.84 118.68 118.23 2hpa s LEU 2274Ca 0.00 1.49 -0.30 0.00 -1.03 0.00 0.00 54.13 54.29 2hpa s LEU 2274Cb 0.00 -4.48 -0.04 0.00 0.03 0.00 0.00 46.19 41.70 2hpa s LEU 2274CO 0.00 -0.92 1.26 -0.76 0.23 0.00 0.00 176.35 176.16 2hpa s LEU 2275N -5.02 4.28 -0.32 1.79 1.43 -1.26 -4.94 118.68 114.63 2hpa s LEU 2275Ca 0.56 1.87 -0.33 0.00 -1.03 0.00 0.00 54.13 55.20 2hpa s LEU 2275Cb -0.11 -3.56 -0.10 0.00 0.03 0.00 0.00 46.19 42.45 2hpa s LEU 2275CO 0.50 -0.64 2.20 -2.65 0.23 0.00 0.00 176.35 175.99 2hpa n PRO 2276N 5.42 1.29 -1.23 1.29 -0.02 -1.26 -4.90 135.00 135.59 2hpa n PRO 2276Ca 0.12 0.35 -0.33 0.00 -2.02 0.00 0.00 63.50 61.61 2hpa n PRO 2276Cb 0.45 -2.65 0.11 0.00 -0.02 0.00 0.00 33.50 31.39 2hpa n PRO 2276CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2hpa s PRO 2277N 6.26 1.86 0.26 0.52 0.04 -1.26 -4.83 135.00 137.85 2hpa s PRO 2277Ca 1.07 1.66 -0.28 0.00 0.04 0.00 0.00 61.00 63.50 2hpa s PRO 2277Cb -0.73 -1.81 -0.15 0.00 0.04 0.00 0.00 34.50 31.85 2hpa s PRO 2277CO 0.46 -2.03 0.88 0.66 0.04 0.00 0.00 177.00 177.01 2hpa n TYR 2278N -3.16 0.79 -1.15 0.56 4.01 -1.26 -0.70 117.16 116.25 2hpa n TYR 2278Ca 0.13 0.78 -0.05 0.00 -0.16 0.00 0.00 57.90 58.59 2hpa n TYR 2278Cb 0.51 -2.17 -0.02 0.00 -0.31 0.00 0.00 39.34 37.35 2hpa n TYR 2278CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2hpa n ALA 2279N 0.19 -0.08 -1.76 -0.72 0.00 -0.58 -4.94 120.51 112.62 2hpa n ALA 2279Ca 0.12 0.08 -0.39 0.00 0.00 0.00 0.00 53.44 53.25 2hpa n ALA 2279Cb 0.30 -1.54 0.01 0.00 0.00 0.00 0.00 19.45 18.21 2hpa n ALA 2279CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2hpa s SER 2280N -2.20 5.98 -0.07 0.00 1.04 0.12 -4.69 113.70 113.88 2hpa s SER 2280Ca 0.00 2.71 0.00 0.00 0.48 0.00 0.00 55.95 59.14 2hpa s SER 2280Cb 0.00 -2.64 0.02 0.00 0.10 0.00 0.00 66.02 63.50 2hpa s SER 2280CO 0.00 -1.09 -0.05 0.00 0.98 0.00 0.00 173.24 173.08 2hpa s HIS 2282N 1.31 3.25 0.09 0.00 5.04 -0.79 -0.67 115.29 123.52 2hpa s HIS 2282Ca -0.04 -1.37 -0.30 0.00 -1.54 0.00 0.00 55.06 51.80 2hpa s HIS 2282Cb -0.14 -4.02 -0.06 0.00 0.04 0.00 0.00 32.58 28.40 2hpa s HIS 2282CO -0.02 -1.25 1.08 -0.51 -2.34 0.00 0.00 174.74 171.69 2hpa s LEU 2283N 1.94 4.43 -0.36 8.88 2.01 -0.29 -2.87 118.68 132.43 2hpa s LEU 2283Ca 0.19 1.92 -0.00 0.00 0.01 0.00 0.00 54.13 56.25 2hpa s LEU 2283Cb -0.15 -3.59 0.13 0.00 0.01 0.00 0.00 46.19 42.59 2hpa s LEU 2283CO -0.02 -0.27 0.19 0.28 1.01 0.00 0.00 176.35 177.54 2hpa s THR 2284N 0.44 0.45 -0.22 5.49 -1.32 -0.47 -0.33 115.64 119.67 2hpa s THR 2284Ca 0.52 -1.72 -0.15 0.00 -1.21 0.00 0.00 61.69 59.13 2hpa s THR 2284Cb -0.26 -1.34 -0.04 0.00 -1.51 0.00 0.00 72.50 69.35 2hpa s THR 2284CO 0.31 -0.90 0.36 -1.61 -2.21 0.00 0.00 174.62 170.57 2hpa s GLU 2285N 1.13 4.12 -0.28 7.08 2.02 0.12 -2.46 118.70 130.42 2hpa s GLU 2285Ca 0.16 0.11 -0.17 0.00 0.02 0.00 0.00 54.97 55.08 2hpa s GLU 2285Cb -0.22 -3.56 -0.02 0.00 0.10 0.00 0.00 34.13 30.42 2hpa s GLU 2285CO -0.07 -0.08 0.48 -1.17 0.02 0.00 0.00 175.26 174.44 2hpa s LEU 2286N 1.46 4.11 0.12 1.80 2.96 -0.04 -0.78 118.68 128.31 2hpa s LEU 2286Ca 0.17 0.35 0.06 0.00 -0.22 0.00 0.00 54.13 54.48 2hpa s LEU 2286Cb -0.15 -2.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.91 2hpa s LEU 2286CO 0.08 -0.31 0.00 -0.31 -1.32 0.00 0.00 176.35 174.49 2hpa s TYR 2287N 2.28 2.94 -0.10 5.38 2.02 0.12 0.77 117.35 130.75 2hpa s TYR 2287Ca 0.19 -0.07 0.01 0.00 -0.37 0.00 0.00 57.07 56.83 2hpa s TYR 2287Cb -0.16 -1.48 -0.02 0.00 -0.40 0.00 0.00 41.96 39.90 2hpa s TYR 2287CO 0.10 0.49 -0.12 0.12 -1.57 0.00 0.00 175.55 174.57 2hpa s PHE 2288N -1.45 2.82 -0.24 2.71 5.36 0.05 -0.09 117.98 127.14 2hpa s PHE 2288Ca 0.26 -0.39 -0.06 0.00 -0.96 0.00 0.00 56.93 55.79 2hpa s PHE 2288Cb -0.11 -1.78 0.12 0.00 -0.34 0.00 0.00 43.02 40.91 2hpa s PHE 2288CO 0.18 -0.01 0.47 -2.00 -1.46 0.00 0.00 175.22 172.40 2hpa s GLU 2289N -0.09 0.40 -1.39 10.12 2.56 0.20 -0.77 118.70 129.73 2hpa s GLU 2289Ca -0.01 0.98 -0.04 0.00 0.00 0.00 0.00 54.97 55.90 2hpa s GLU 2289Cb -0.14 0.25 0.00 0.00 2.00 0.00 0.00 34.13 36.25 2hpa s GLU 2289CO 0.03 -0.38 0.41 1.63 -0.56 0.00 0.00 175.26 176.40 2hpa n LYS 2290N 5.40 -2.57 -0.79 4.30 5.02 -1.26 0.04 118.16 128.30 2hpa n LYS 2290Ca -0.07 0.35 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2hpa n LYS 2290Cb 0.50 -4.24 0.00 0.00 -0.02 0.00 0.00 35.03 31.26 2hpa n LYS 2290CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hpa n GLY 2291N -2.04 0.98 3.52 0.72 0.00 -1.26 -4.99 105.19 102.11 2hpa n GLY 2291Ca -0.28 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 2hpa n GLY 2291CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hpa s GLU 2292N -0.18 1.91 -0.05 1.61 2.02 0.11 -5.13 118.70 118.98 2hpa s GLU 2292Ca 0.00 -1.12 0.01 0.00 0.02 0.00 0.00 54.97 53.88 2hpa s GLU 2292Cb 0.00 -2.18 -0.03 0.00 0.10 0.00 0.00 34.13 32.02 2hpa s GLU 2292CO 0.00 0.49 -0.04 0.71 0.02 0.00 0.00 175.26 176.44 2hpa s TYR 2293N -1.15 3.00 -0.02 1.61 2.02 -1.26 0.63 117.35 122.18 2hpa s TYR 2293Ca 0.19 0.06 0.02 0.00 -0.37 0.00 0.00 57.07 56.97 2hpa s TYR 2293Cb -0.11 -1.71 0.01 0.00 -0.40 0.00 0.00 41.96 39.75 2hpa s TYR 2293CO 0.11 0.39 -0.07 -0.06 -1.57 0.00 0.00 175.55 174.35 2hpa s PHE 2294N -0.89 0.77 -0.21 2.71 0.40 0.87 0.16 117.98 121.80 2hpa s PHE 2294Ca 0.14 -0.18 -0.13 0.00 -0.60 0.00 0.00 56.93 56.15 2hpa s PHE 2294Cb -0.11 -0.57 -0.04 0.00 0.51 0.00 0.00 43.02 42.80 2hpa s PHE 2294CO 0.04 -0.09 0.29 0.08 0.70 0.00 0.00 175.22 176.24 2hpa s VAL 2295N 0.25 5.28 -0.06 -0.44 1.01 0.22 0.10 120.40 126.76 2hpa s VAL 2295Ca -0.03 0.48 0.03 0.00 0.00 0.00 0.00 61.98 62.46 2hpa s VAL 2295Cb -0.08 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.68 2hpa s VAL 2295CO 0.00 0.30 -0.16 -1.61 0.00 0.00 0.00 175.10 173.64 2hpa s GLU 2296N 1.11 1.94 0.02 2.72 2.02 0.04 -1.70 118.70 124.86 2hpa s GLU 2296Ca 0.14 -0.56 0.07 0.00 0.02 0.00 0.00 54.97 54.64 2hpa s GLU 2296Cb -0.14 -1.60 -0.02 0.00 0.10 0.00 0.00 34.13 32.47 2hpa s GLU 2296CO 0.06 0.14 -0.21 -1.64 0.02 0.00 0.00 175.26 173.63 2hpa s MET 2297N 0.36 1.55 0.31 1.61 -1.94 -1.26 0.11 119.30 120.04 2hpa s MET 2297Ca -0.11 -0.87 0.03 0.00 -1.71 0.00 0.00 55.69 53.03 2hpa s MET 2297Cb -0.14 -1.60 -0.04 0.00 2.01 0.00 0.00 34.83 35.06 2hpa s MET 2297CO 0.04 0.42 0.12 0.71 -0.01 0.00 0.00 175.02 176.31 2hpa s TYR 2298N -0.67 1.66 -0.27 -0.03 2.02 0.55 -0.81 117.35 119.80 2hpa s TYR 2298Ca 0.08 -1.25 -0.03 0.00 -0.37 0.00 0.00 57.07 55.50 2hpa s TYR 2298Cb -0.09 -0.98 0.11 0.00 -0.40 0.00 0.00 41.96 40.61 2hpa s TYR 2298CO 0.01 -0.37 0.19 -0.47 -1.57 0.00 0.00 175.55 173.34 2hpa s TYR 2299N -3.54 -0.00 -1.09 2.71 5.04 0.21 -1.14 117.35 119.54 2hpa s TYR 2299Ca 0.34 -0.50 -0.19 0.00 -2.44 0.00 0.00 57.07 54.28 2hpa s TYR 2299Cb 0.06 -0.69 0.09 0.00 0.35 0.00 0.00 41.96 41.77 2hpa s TYR 2299CO 0.16 -0.81 1.43 0.50 -1.34 0.00 0.00 175.55 175.49 2hpa s ARG 2300N 2.21 3.76 -0.04 4.97 3.52 0.15 -1.44 118.95 132.07 2hpa s ARG 2300Ca 0.08 -1.70 0.17 0.00 -0.13 0.00 0.00 55.73 54.16 2hpa s ARG 2300Cb -0.15 -5.24 0.55 0.00 -1.56 0.00 0.00 34.95 28.54 2hpa s ARG 2300CO -0.31 -2.05 1.46 0.27 -0.81 0.00 0.00 175.30 173.87 2hpa n ASN 2301N 7.71 3.83 -3.52 -2.12 6.94 -1.26 -2.02 115.26 124.82 2hpa n ASN 2301Ca 0.35 -2.20 -0.06 0.00 -0.02 0.00 0.00 54.58 52.65 2hpa n ASN 2301Cb 0.48 -0.43 -0.07 0.00 -2.36 0.00 0.00 39.78 37.40 2hpa n ASN 2301CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2hpa s GLU 2302N -1.37 0.41 0.24 -3.83 2.02 -1.26 -4.85 118.70 110.05 2hpa s GLU 2302Ca 0.41 0.99 -0.05 0.00 0.02 0.00 0.00 54.97 56.34 2hpa s GLU 2302Cb 0.24 0.28 0.44 0.00 0.10 0.00 0.00 34.13 35.19 2hpa s GLU 2302CO 0.23 -0.38 1.71 1.15 0.02 0.00 0.00 175.26 177.99 2hpa h THR 2303N 6.12 0.59 -0.24 3.63 2.02 -1.98 -1.34 112.91 121.71 2hpa h THR 2303Ca -0.18 -0.12 -0.12 0.00 0.77 0.00 0.00 66.41 66.76 2hpa h THR 2303Cb 1.12 0.22 -0.07 0.00 -1.74 0.00 0.00 68.15 67.68 2hpa h THR 2303CO 0.17 0.06 0.16 0.00 0.37 0.00 0.00 175.52 176.28 2hpa n GLN 2304N -5.09 1.30 -3.72 6.66 0.00 -1.26 -4.85 117.38 110.42 2hpa n GLN 2304Ca 0.14 -0.72 -0.13 0.00 0.00 0.00 0.00 57.00 56.29 2hpa n GLN 2304Cb 0.43 -1.28 -0.08 0.00 0.00 0.00 0.00 30.24 29.31 2hpa n GLN 2304CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 2hpa s HIS 2305N -0.79 -0.23 0.57 2.61 3.76 -0.51 -5.14 115.29 115.56 2hpa s HIS 2305Ca 0.14 0.30 -0.20 0.00 -0.15 0.00 0.00 55.06 55.15 2hpa s HIS 2305Cb 0.11 0.15 -0.04 0.00 1.11 0.00 0.00 32.58 33.91 2hpa s HIS 2305CO 0.03 -0.47 1.23 -1.83 -0.85 0.00 0.00 174.74 172.85 2hpa s GLU 2306N -1.73 3.10 0.37 1.40 -1.05 -1.26 -4.78 118.70 114.76 2hpa s GLU 2306Ca -0.10 1.89 -0.28 0.00 -0.15 0.00 0.00 54.97 56.33 2hpa s GLU 2306Cb -0.03 -2.05 -0.11 0.00 -0.44 0.00 0.00 34.13 31.50 2hpa s GLU 2306CO 0.02 -1.12 1.47 -1.25 0.95 0.00 0.00 175.26 175.33 2hpa s PRO 2307N -3.17 4.12 0.01 -4.83 0.04 -1.26 -4.92 135.00 124.99 2hpa s PRO 2307Ca 0.75 2.53 -0.30 0.00 0.04 0.00 0.00 61.00 64.02 2hpa s PRO 2307Cb -0.32 -2.97 -0.06 0.00 0.04 0.00 0.00 34.50 31.19 2hpa s PRO 2307CO 0.36 -0.51 1.51 0.71 0.04 0.00 0.00 177.00 179.11 2hpa s TYR 2308N -1.13 2.59 0.22 0.56 1.51 -0.52 -4.65 117.35 115.93 2hpa s TYR 2308Ca 0.53 0.58 -0.30 0.00 -1.01 0.00 0.00 57.07 56.86 2hpa s TYR 2308Cb -0.46 -3.79 -0.09 0.00 -0.11 0.00 0.00 41.96 37.52 2hpa s TYR 2308CO 0.62 -3.07 1.23 -1.25 -1.11 0.00 0.00 175.55 171.97 2hpa s PRO 2309N 2.77 4.47 0.24 -1.71 0.04 -1.26 -0.62 135.00 138.93 2hpa s PRO 2309Ca 0.68 1.96 0.07 0.00 0.04 0.00 0.00 61.00 63.75 2hpa s PRO 2309Cb -0.34 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 30.97 2hpa s PRO 2309CO 0.28 -0.10 0.14 -0.51 0.04 0.00 0.00 177.00 176.86 2hpa s LEU 2310N -0.60 3.67 -0.09 -3.56 1.43 0.01 -4.90 118.68 114.64 2hpa s LEU 2310Ca 0.52 -0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 53.26 2hpa s LEU 2310Cb -0.34 -2.21 0.05 0.00 0.03 0.00 0.00 46.19 43.71 2hpa s LEU 2310CO 0.40 -0.01 0.17 -0.32 0.23 0.00 0.00 176.35 176.81 2hpa s MET 2311N -3.69 0.05 0.06 1.70 -2.45 -1.26 -4.45 119.30 109.25 2hpa s MET 2311Ca 0.32 0.56 -0.31 0.00 -1.25 0.00 0.00 55.69 55.01 2hpa s MET 2311Cb -0.08 -0.25 -0.10 0.00 1.25 0.00 0.00 34.83 35.65 2hpa s MET 2311CO 0.23 -0.29 1.89 -0.11 1.05 0.00 0.00 175.02 177.79 2hpa n LEU 2312N 5.22 3.96 -4.67 4.11 7.94 -1.26 -4.86 117.00 127.44 2hpa n LEU 2312Ca -0.07 0.96 -0.43 0.00 -1.11 0.00 0.00 56.01 55.36 2hpa n LEU 2312Cb 0.50 -1.51 -0.03 0.00 0.53 0.00 0.00 43.42 42.91 2hpa n LEU 2312CO 0.05 0.13 1.55 -0.81 -1.11 0.00 0.00 177.39 177.20 2hpa n PRO 2313N 6.44 2.77 0.00 1.96 -0.04 -1.26 -0.77 135.00 144.10 2hpa n PRO 2313Ca 0.19 1.01 0.00 0.00 -0.04 0.00 0.00 63.50 64.67 2hpa n PRO 2313Cb 0.37 -2.94 0.00 0.00 -0.04 0.00 0.00 33.50 30.89 2hpa n PRO 2313CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hpa n GLY 2314N 4.41 0.68 3.35 0.55 0.00 -1.26 -5.08 105.19 107.85 2hpa n GLY 2314Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 2hpa n GLY 2314CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hpa s SER 2316N -3.38 3.90 0.18 0.00 0.01 -1.26 -4.55 113.70 108.61 2hpa s SER 2316Ca 0.36 -0.15 -0.10 0.00 1.31 0.00 0.00 55.95 57.37 2hpa s SER 2316Cb 0.06 -0.10 0.06 0.00 0.21 0.00 0.00 66.02 66.25 2hpa s SER 2316CO 0.15 -2.18 1.63 -0.65 0.41 0.00 0.00 173.24 172.61 2hpa h PRO 2317N -0.93 1.06 -2.99 12.44 0.11 -1.92 -3.22 132.00 136.56 2hpa h PRO 2317Ca -0.39 -0.34 -0.78 0.00 0.11 0.00 0.00 66.00 64.60 2hpa h PRO 2317Cb 1.26 -0.09 -0.30 0.00 0.11 0.00 0.00 31.00 31.97 2hpa h PRO 2317CO 0.39 1.04 0.52 0.45 -0.21 0.00 0.00 178.00 180.19 2hpa n SER 2318N -4.19 5.82 -4.72 -2.05 2.88 -1.26 -4.33 113.62 105.76 2hpa n SER 2318Ca 0.03 -3.33 -0.42 0.00 -1.33 0.00 0.00 58.87 53.82 2hpa n SER 2318Cb 0.35 -1.21 -0.03 0.00 -0.75 0.00 0.00 64.21 62.57 2hpa n SER 2318CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hpa s PRO 2320N 0.76 4.24 0.33 0.00 0.02 -1.26 0.69 135.00 139.77 2hpa s PRO 2320Ca 0.66 2.27 0.11 0.00 0.02 0.00 0.00 61.00 64.05 2hpa s PRO 2320Cb -0.41 -3.28 1.00 0.00 0.02 0.00 0.00 34.50 31.82 2hpa s PRO 2320CO 0.34 -0.59 1.62 1.25 -0.33 0.00 0.00 177.00 179.29 2hpa h LEU 2321N 7.22 0.16 -1.01 -5.54 5.85 -0.62 0.14 115.31 121.51 2hpa h LEU 2321Ca -0.42 0.23 0.05 0.00 0.84 0.00 0.00 57.88 58.57 2hpa h LEU 2321Cb 1.20 0.26 -0.06 0.00 0.37 0.00 0.00 40.66 42.43 2hpa h LEU 2321CO 0.90 -0.26 0.65 -0.33 -0.34 0.00 0.00 178.44 179.07 2hpa h GLU 2322N 0.16 1.19 0.00 1.25 3.07 -1.89 0.10 114.58 118.47 2hpa h GLU 2322Ca 0.69 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.36 59.40 2hpa h GLU 2322Cb 1.60 -0.27 -0.01 0.00 -0.84 0.00 0.00 28.75 29.23 2hpa h GLU 2322CO -0.71 0.79 -0.68 -0.09 -1.40 0.00 0.00 179.01 176.92 2hpa h ARG 2323N 1.23 0.00 -0.28 2.33 2.43 -1.12 -3.03 114.38 115.93 2hpa h ARG 2323Ca 0.42 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.41 2hpa h ARG 2323Cb 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2hpa h ARG 2323CO -0.15 0.26 -0.51 0.35 -1.51 0.00 0.00 179.97 178.41 2hpa h PHE 2324N 0.00 1.06 -0.40 2.20 3.04 -0.47 -1.00 116.94 121.37 2hpa h PHE 2324Ca -0.04 -0.37 -0.01 0.00 3.98 0.00 0.00 57.97 61.52 2hpa h PHE 2324Cb 1.28 -0.20 -0.02 0.00 2.56 0.00 0.00 35.95 39.57 2hpa h PHE 2324CO 0.00 1.20 0.19 0.00 -2.02 0.00 0.00 178.31 177.68 2hpa h ALA 2325N 0.67 0.51 -0.08 2.41 0.00 -0.81 -2.28 119.26 119.69 2hpa h ALA 2325Ca 0.02 -0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.59 2hpa h ALA 2325Cb 1.12 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.76 2hpa h ALA 2325CO 0.12 0.07 -0.86 1.05 0.00 0.00 0.00 179.25 179.62 2hpa h GLU 2326N 0.50 0.66 -0.44 0.00 4.11 -1.53 -1.91 114.58 115.97 2hpa h GLU 2326Ca 0.14 -0.60 -0.02 0.00 0.07 0.00 0.00 59.36 58.94 2hpa h GLU 2326Cb 0.11 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2hpa h GLU 2326CO -0.02 1.21 0.19 -0.07 0.07 0.00 0.00 179.01 180.40 2hpa h LEU 2327N 0.43 0.60 -0.04 3.06 3.38 -1.19 -2.92 115.31 118.63 2hpa h LEU 2327Ca -0.07 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2hpa h LEU 2327Cb 1.49 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.09 2hpa h LEU 2327CO 0.17 0.58 -0.04 0.55 0.09 0.00 0.00 178.44 179.79 2hpa n VAL 2328N -4.63 0.00 -0.09 1.22 3.14 -0.86 -4.20 118.33 112.91 2hpa n VAL 2328Ca 0.01 -0.01 -0.09 0.00 -2.96 0.00 0.00 64.34 61.29 2hpa n VAL 2328Cb 0.13 -0.40 -0.01 0.00 -1.06 0.00 0.00 33.84 32.50 2hpa n VAL 2328CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2hpa h GLY 2329N 4.99 0.44 0.42 7.55 0.00 -1.13 -2.74 103.07 112.60 2hpa h GLY 2329Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2hpa h GLY 2329CO 0.00 0.14 0.00 -1.55 0.00 0.00 0.00 176.54 175.13 2hpa n PRO 2330N -4.89 0.28 0.00 4.80 -0.04 -1.26 -2.19 135.00 131.70 2hpa n PRO 2330Ca -0.01 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.49 2hpa n PRO 2330Cb 0.04 -1.21 -0.02 0.00 -0.04 0.00 0.00 33.50 32.27 2hpa n PRO 2330CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2hpa n VAL 2331N -0.71 0.00 -3.43 0.52 3.14 -1.03 -4.84 118.33 111.98 2hpa n VAL 2331Ca 0.03 -0.38 -0.40 0.00 -2.96 0.00 0.00 64.34 60.63 2hpa n VAL 2331Cb 0.01 1.04 -0.10 0.00 -1.06 0.00 0.00 33.84 33.74 2hpa n VAL 2331CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2hpa s ILE 2332N -1.39 5.19 0.87 1.55 1.01 -0.93 -3.12 121.20 124.39 2hpa s ILE 2332Ca 0.04 0.23 -0.10 0.00 0.00 0.00 0.00 60.65 60.82 2hpa s ILE 2332Cb 0.05 -3.73 0.12 0.00 0.01 0.00 0.00 42.46 38.91 2hpa s ILE 2332CO 0.23 0.04 1.13 -2.16 0.00 0.00 0.00 174.94 174.19 2hpa s PRO 2333N 1.99 1.37 -0.15 2.79 0.04 -1.25 -4.95 135.00 134.84 2hpa s PRO 2333Ca 0.12 1.46 0.10 0.00 0.04 0.00 0.00 61.00 62.72 2hpa s PRO 2333Cb -0.16 -1.78 -0.23 0.00 0.04 0.00 0.00 34.50 32.37 2hpa s PRO 2333CO 0.11 -2.35 0.24 1.04 0.04 0.00 0.00 177.00 176.08 2hpa n GLN 2334N -4.00 0.68 -2.89 4.56 1.13 -1.26 -4.80 117.38 110.78 2hpa n GLN 2334Ca 0.11 0.15 -0.02 0.00 -1.94 0.00 0.00 57.00 55.30 2hpa n GLN 2334Cb 0.52 -1.63 0.01 0.00 0.11 0.00 0.00 30.24 29.25 2hpa n GLN 2334CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2hpa s ASP 2335N -6.06 -1.37 0.42 1.08 -1.08 -1.26 -5.03 116.67 103.37 2hpa s ASP 2335Ca -0.14 -1.31 0.22 0.00 -0.52 0.00 0.00 52.55 50.80 2hpa s ASP 2335Cb 0.07 1.78 1.21 0.00 -1.46 0.00 0.00 42.92 44.52 2hpa s ASP 2335CO 0.78 -0.08 1.74 -0.25 0.52 0.00 0.00 175.17 177.87 2hpa h TRP 2336N 5.57 0.58 0.38 -5.34 7.01 -1.90 0.22 115.95 122.47 2hpa h TRP 2336Ca 0.05 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.05 2hpa h TRP 2336Cb 1.14 -0.16 0.00 0.00 -2.10 0.00 0.00 29.16 28.04 2hpa h TRP 2336CO 0.10 -0.01 -0.18 1.03 -2.79 0.00 0.00 178.44 176.59 2hpa h SER 2337N 0.29 -0.43 -0.84 2.65 0.87 -1.99 -0.77 113.55 113.33 2hpa h SER 2337Ca 0.65 0.01 0.09 0.00 -1.23 0.00 0.00 61.79 61.31 2hpa h SER 2337Cb 1.81 0.11 -0.07 0.00 -0.44 0.00 0.00 62.40 63.81 2hpa h SER 2337CO -0.31 -0.28 0.50 0.71 -0.53 0.00 0.00 176.83 176.92 2hpa h THR 2338N -0.57 0.95 0.00 2.23 1.35 -1.83 -0.56 112.91 114.48 2hpa h THR 2338Ca -0.05 -0.29 -0.00 0.00 -0.55 0.00 0.00 66.41 65.51 2hpa h THR 2338Cb 0.39 0.02 -0.00 0.00 -1.73 0.00 0.00 68.15 66.83 2hpa h THR 2338CO 0.09 0.16 -0.01 -0.33 -0.25 0.00 0.00 175.52 175.17 2hpa h GLU 2339N 0.85 0.00 0.00 4.72 5.08 -0.50 0.01 114.58 124.75 2hpa h GLU 2339Ca 0.39 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.68 2hpa h GLU 2339Cb 0.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2hpa h GLU 2339CO -0.22 0.01 -0.51 0.00 -1.00 0.00 0.00 179.01 177.28 2hpa s MET 2341N -3.07 4.13 0.00 0.00 -1.94 -0.01 -0.39 119.30 118.01 2hpa s MET 2341Ca 0.04 2.57 0.00 0.00 -1.71 0.00 0.00 55.69 56.59 2hpa s MET 2341Cb 0.07 -3.03 0.00 0.00 2.01 0.00 0.00 34.83 33.89 2hpa s MET 2341CO 0.74 -0.63 0.00 -2.37 -0.01 0.00 0.00 175.02 172.75