#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lrn s PHE 2004N 0.00 2.94 -0.05 5.58 2.19 -1.26 -4.74 117.98 122.64 1lrn s PHE 2004Ca 0.00 0.93 -0.06 0.00 0.33 0.00 0.00 56.93 58.12 1lrn s PHE 2004Cb 0.00 -3.90 -0.04 0.00 -1.31 0.00 0.00 43.02 37.76 1lrn s PHE 2004CO 0.00 -3.00 0.20 -1.17 1.83 0.00 0.00 175.22 173.08 1lrn s LEU 2005N -0.34 4.39 -0.28 6.12 2.96 -0.75 -0.98 118.68 129.80 1lrn s LEU 2005Ca 0.61 0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 54.99 1lrn s LEU 2005Cb -0.44 -2.41 0.09 0.00 0.50 0.00 0.00 46.19 43.93 1lrn s LEU 2005CO 0.44 0.32 0.09 -0.69 -1.32 0.00 0.00 176.35 175.20 1lrn s VAL 2006N -1.18 0.49 -0.30 1.68 1.01 -0.54 -1.34 120.40 120.21 1lrn s VAL 2006Ca 0.22 -1.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.06 1lrn s VAL 2006Cb -0.13 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 1lrn s VAL 2006CO 0.12 -0.59 0.29 -0.63 0.00 0.00 0.00 175.10 174.28 1lrn s ILE 2007N 1.82 5.24 0.13 2.22 1.01 -0.46 -1.39 121.20 129.77 1lrn s ILE 2007Ca 0.07 0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.79 1lrn s ILE 2007Cb -0.17 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.63 1lrn s ILE 2007CO -0.25 0.10 0.27 0.00 0.00 0.00 0.00 174.94 175.06 1lrn s ALA 2008N 1.89 -0.27 0.00 9.38 0.00 -0.53 -0.77 121.76 131.46 1lrn s ALA 2008Ca 0.10 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.44 1lrn s ALA 2008Cb -0.16 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.62 1lrn s ALA 2008CO 0.11 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 175.69 1lrn n GLY 2009N -0.15 1.24 3.77 0.00 0.00 -1.10 -0.23 105.19 108.71 1lrn n GLY 2009Ca -0.12 -1.35 -0.38 0.00 0.00 0.00 0.00 46.02 44.17 1lrn n GLY 2009CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lrn s PRO 2010N -1.90 4.02 0.13 1.61 0.04 -0.85 -0.34 135.00 137.71 1lrn s PRO 2010Ca 0.00 1.77 -0.31 0.00 0.04 0.00 0.00 61.00 62.50 1lrn s PRO 2010Cb 0.00 -2.60 -0.08 0.00 0.04 0.00 0.00 34.50 31.86 1lrn s PRO 2010CO 0.00 -0.33 1.57 0.00 0.04 0.00 0.00 177.00 178.28 1lrn s ALA 2012N -5.84 2.67 -1.17 0.00 0.00 -1.26 -1.60 121.76 114.56 1lrn s ALA 2012Ca -0.16 -1.31 -0.21 0.00 0.00 0.00 0.00 51.96 50.29 1lrn s ALA 2012Cb 0.09 -0.68 0.03 0.00 0.00 0.00 0.00 23.12 22.56 1lrn s ALA 2012CO 0.63 0.59 1.70 0.42 0.00 0.00 0.00 175.76 179.10 1lrn s ILE 2013N -1.09 3.94 -0.29 0.00 1.01 -0.12 -4.73 121.20 119.93 1lrn s ILE 2013Ca 0.17 -1.33 0.27 0.00 0.00 0.00 0.00 60.65 59.75 1lrn s ILE 2013Cb -0.11 -4.99 0.29 0.00 0.01 0.00 0.00 42.46 37.67 1lrn s ILE 2013CO 0.09 -1.79 1.80 -0.33 0.00 0.00 0.00 174.94 174.71 1lrn h GLU 2014N 8.78 0.00 0.00 2.79 5.08 -1.96 -3.41 114.58 125.86 1lrn h GLU 2014Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1lrn h GLU 2014Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1lrn h GLU 2014CO 1.40 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 178.28 1lrn n SER 2015N -2.49 0.00 0.12 1.42 3.41 -1.26 -4.97 113.62 109.85 1lrn n SER 2015Ca 0.01 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.73 1lrn n SER 2015Cb 0.24 0.00 0.47 0.00 -0.26 0.00 0.00 64.21 64.66 1lrn n SER 2015CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1lrn n GLU 2016N -0.52 0.15 0.13 4.33 0.28 -1.26 -1.97 120.64 121.79 1lrn n GLU 2016Ca 0.00 0.46 -0.14 0.00 -0.16 0.00 0.00 57.16 57.32 1lrn n GLU 2016Cb 0.00 -1.84 -0.08 0.00 1.43 0.00 0.00 31.44 30.95 1lrn n GLU 2016CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1lrn h GLU 2017N 0.00 -0.32 -0.48 3.44 4.81 -1.98 -1.04 114.58 119.02 1lrn h GLU 2017Ca 0.00 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1lrn h GLU 2017Cb 0.26 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 1lrn h GLU 2017CO 0.00 -0.04 0.30 1.25 -0.73 0.00 0.00 179.01 179.79 1lrn h LEU 2018N -0.59 0.51 -0.89 1.64 5.85 -1.77 -2.18 115.31 117.88 1lrn h LEU 2018Ca -0.03 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.75 1lrn h LEU 2018Cb 0.43 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.27 1lrn h LEU 2018CO 0.06 0.37 0.55 -0.07 -0.34 0.00 0.00 178.44 179.00 1lrn h LEU 2019N 0.62 0.84 -0.69 2.25 3.38 -1.37 -1.24 115.31 119.10 1lrn h LEU 2019Ca 0.18 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 1lrn h LEU 2019Cb -0.04 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1lrn h LEU 2019CO -0.06 0.52 -0.08 -0.07 0.09 0.00 0.00 178.44 178.84 1lrn h LEU 2020N 0.97 0.92 0.19 1.67 3.38 -0.73 0.38 115.31 122.10 1lrn h LEU 2020Ca 0.40 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1lrn h LEU 2020Cb 0.25 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1lrn h LEU 2020CO -0.20 1.03 -0.09 0.50 0.09 0.00 0.00 178.44 179.77 1lrn h LYS 2021N 0.84 -0.24 -0.82 1.13 3.64 -0.78 -1.02 116.57 119.31 1lrn h LYS 2021Ca 0.14 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1lrn h LYS 2021Cb 0.61 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.45 1lrn h LYS 2021CO 0.04 0.00 0.40 0.28 -2.27 0.00 0.00 179.45 177.90 1lrn h VAL 2022N -0.47 1.25 -0.05 2.00 2.07 -1.18 -1.99 116.25 117.87 1lrn h VAL 2022Ca -0.03 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 1lrn h VAL 2022Cb 0.36 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1lrn h VAL 2022CO 0.04 0.31 -0.02 1.23 0.02 0.00 0.00 177.57 179.15 1lrn h GLY 2023N 1.19 0.08 0.91 2.17 0.00 -0.04 -1.17 103.07 106.21 1lrn h GLY 2023Ca 0.28 -0.03 -0.06 0.00 0.00 0.00 0.00 47.33 47.52 1lrn h GLY 2023CO -0.04 0.03 -0.03 -2.09 0.00 0.00 0.00 176.54 174.42 1lrn h GLU 2024N 0.08 0.60 -0.52 4.80 4.81 -0.41 -0.40 114.58 123.53 1lrn h GLU 2024Ca 0.02 -0.21 -0.12 0.00 -0.13 0.00 0.00 59.36 58.92 1lrn h GLU 2024Cb 0.09 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1lrn h GLU 2024CO 0.00 0.75 -0.16 1.49 -0.73 0.00 0.00 179.01 180.36 1lrn h GLU 2025N 0.39 1.03 -0.11 1.92 4.57 -1.25 -1.43 114.58 119.69 1lrn h GLU 2025Ca 0.09 -0.41 -0.09 0.00 -1.18 0.00 0.00 59.36 57.77 1lrn h GLU 2025Cb 0.50 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 1lrn h GLU 2025CO 0.02 1.09 -0.35 0.82 -1.18 0.00 0.00 179.01 179.41 1lrn h ILE 2026N 0.90 1.28 -0.23 2.32 2.04 -1.14 -1.10 117.51 121.59 1lrn h ILE 2026Ca 0.13 -1.37 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 1lrn h ILE 2026Cb 0.73 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1lrn h ILE 2026CO 0.06 0.41 0.03 0.50 0.00 0.00 0.00 178.15 179.15 1lrn h LYS 2027N 0.20 0.39 -0.13 2.37 1.63 -0.77 0.78 116.57 121.04 1lrn h LYS 2027Ca 0.02 -0.11 0.04 0.00 -0.85 0.00 0.00 60.65 59.75 1lrn h LYS 2027Cb 0.72 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.27 1lrn h LYS 2027CO 0.05 0.54 -0.12 -0.09 -3.45 0.00 0.00 179.45 176.38 1lrn h ARG 2028N 0.18 -0.14 -0.86 1.90 2.43 -0.79 -0.24 114.38 116.87 1lrn h ARG 2028Ca 0.07 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1lrn h ARG 2028Cb 0.35 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 1lrn h ARG 2028CO 0.01 -0.09 0.57 -0.07 -1.51 0.00 0.00 179.97 178.87 1lrn h LEU 2029N -0.14 0.98 -1.01 3.80 -0.00 -1.09 -0.67 115.31 117.17 1lrn h LEU 2029Ca 0.09 -0.03 0.10 0.00 -0.00 0.00 0.00 57.88 58.04 1lrn h LEU 2029Cb 0.27 -0.25 -0.08 0.00 -0.00 0.00 0.00 40.66 40.61 1lrn h LEU 2029CO -0.21 0.71 0.64 -1.28 -0.00 0.00 0.00 178.44 178.30 1lrn h SER 2030N 1.16 0.98 1.04 -0.43 0.87 0.59 0.40 113.55 118.17 1lrn h SER 2030Ca 0.31 0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 60.74 1lrn h SER 2030Cb -0.13 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.63 1lrn h SER 2030CO -0.07 0.57 -0.76 -0.33 -0.53 0.00 0.00 176.83 175.71 1lrn h GLU 2031N 1.07 0.00 0.02 2.24 4.39 -0.00 -3.29 114.58 119.01 1lrn h GLU 2031Ca 0.47 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.94 1lrn h GLU 2031Cb 0.35 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 1lrn h GLU 2031CO -0.22 0.76 -1.09 -0.22 -1.16 0.00 0.00 179.01 177.08 1lrn h LYS 2032N 0.00 0.04 -2.41 2.33 3.64 0.27 -3.38 116.57 117.06 1lrn h LYS 2032Ca -0.01 -0.07 -0.63 0.00 -1.27 0.00 0.00 60.65 58.67 1lrn h LYS 2032Cb 1.49 0.02 -0.40 0.00 -0.41 0.00 0.00 32.23 32.93 1lrn h LYS 2032CO 0.10 1.00 -0.39 1.19 -2.27 0.00 0.00 179.45 179.07 1lrn n PHE 2033N -3.35 3.47 0.32 1.91 3.01 0.13 -4.92 117.46 118.02 1lrn n PHE 2033Ca -0.03 -3.97 0.19 0.00 1.01 0.00 0.00 57.45 54.66 1lrn n PHE 2033Cb 0.96 -0.68 1.02 0.00 -0.01 0.00 0.00 39.48 40.77 1lrn n PHE 2033CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1lrn h LYS 2034N 4.51 0.00 0.00 -1.08 1.79 -1.75 -1.11 116.57 118.94 1lrn h LYS 2034Ca 0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 1lrn h LYS 2034Cb 0.67 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 1lrn h LYS 2034CO 0.89 0.00 -0.39 -0.85 -1.08 0.00 0.00 179.45 178.02 1lrn n GLU 2035N -3.12 0.25 -3.63 3.15 0.00 -1.26 -4.83 120.64 111.20 1lrn n GLU 2035Ca -0.02 0.11 -0.37 0.00 0.00 0.00 0.00 57.16 56.88 1lrn n GLU 2035Cb 0.22 -1.70 -0.06 0.00 0.00 0.00 0.00 31.44 29.90 1lrn n GLU 2035CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1lrn s VAL 2036N -3.13 5.24 -0.44 3.84 1.01 -0.42 -4.11 120.40 122.39 1lrn s VAL 2036Ca 0.08 0.58 -0.19 0.00 0.00 0.00 0.00 61.98 62.45 1lrn s VAL 2036Cb 0.14 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.95 1lrn s VAL 2036CO 0.67 0.55 0.55 -0.70 0.00 0.00 0.00 175.10 176.17 1lrn s GLU 2037N -0.73 3.17 0.17 2.72 2.12 -0.16 -4.97 118.70 121.02 1lrn s GLU 2037Ca 0.19 -0.62 -0.15 0.00 0.36 0.00 0.00 54.97 54.75 1lrn s GLU 2037Cb -0.14 -3.98 -0.07 0.00 0.26 0.00 0.00 34.13 30.19 1lrn s GLU 2037CO 0.08 -0.98 0.58 -0.06 -0.54 0.00 0.00 175.26 174.35 1lrn s PHE 2038N 2.49 3.60 -0.07 5.30 0.40 -1.26 -1.46 117.98 126.98 1lrn s PHE 2038Ca 0.17 1.12 -0.01 0.00 -0.60 0.00 0.00 56.93 57.60 1lrn s PHE 2038Cb -0.16 -2.41 0.03 0.00 0.51 0.00 0.00 43.02 40.98 1lrn s PHE 2038CO 0.16 0.40 0.00 0.08 0.70 0.00 0.00 175.22 176.56 1lrn s VAL 2039N -1.50 0.33 0.02 -0.44 1.01 -0.48 -4.18 120.40 115.16 1lrn s VAL 2039Ca 0.39 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.21 1lrn s VAL 2039Cb -0.15 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 1lrn s VAL 2039CO 0.19 0.25 1.10 0.12 0.00 0.00 0.00 175.10 176.77 1lrn s PHE 2040N 1.90 3.51 0.08 5.22 5.36 -0.23 -1.46 117.98 132.35 1lrn s PHE 2040Ca 0.04 1.46 0.08 0.00 -0.96 0.00 0.00 56.93 57.55 1lrn s PHE 2040Cb -0.12 -3.29 -0.03 0.00 -0.34 0.00 0.00 43.02 39.23 1lrn s PHE 2040CO -0.05 -0.74 -0.22 0.21 -1.46 0.00 0.00 175.22 172.97 1lrn s LYS 2041N 1.18 1.30 -0.29 10.12 2.36 0.67 -1.21 119.74 133.87 1lrn s LYS 2041Ca 0.55 -1.08 -0.27 0.00 -2.55 0.00 0.00 55.97 52.62 1lrn s LYS 2041Cb -0.25 -1.51 0.19 0.00 -1.05 0.00 0.00 37.83 35.21 1lrn s LYS 2041CO 0.28 0.37 1.42 0.45 1.55 0.00 0.00 175.35 179.41 1lrn s SER 2042N -1.57 -0.04 -0.08 1.43 0.15 -1.14 -3.42 113.70 109.03 1lrn s SER 2042Ca 0.08 0.06 -0.10 0.00 0.70 0.00 0.00 55.95 56.69 1lrn s SER 2042Cb -0.09 0.06 -0.05 0.00 -1.71 0.00 0.00 66.02 64.22 1lrn s SER 2042CO 0.03 -0.02 0.23 -0.44 1.20 0.00 0.00 173.24 174.24 1lrn s SER 2043N -0.44 6.53 0.00 5.45 0.01 -0.63 -4.46 113.70 120.16 1lrn s SER 2043Ca 0.08 0.64 0.27 0.00 1.31 0.00 0.00 55.95 58.24 1lrn s SER 2043Cb -0.03 -2.13 0.80 0.00 0.21 0.00 0.00 66.02 64.87 1lrn s SER 2043CO -0.12 0.37 1.60 2.22 0.41 0.00 0.00 173.24 177.72 1lrn n PHE 2044N 1.96 0.00 -3.59 2.43 1.16 -1.26 -0.94 117.46 117.22 1lrn n PHE 2044Ca -0.18 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.38 1lrn n PHE 2044Cb 0.54 -0.14 -0.06 0.00 -1.61 0.00 0.00 39.48 38.22 1lrn n PHE 2044CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1lrn s ASP 2045N -2.52 -0.70 -1.04 5.98 2.15 -1.25 -3.38 116.67 115.91 1lrn s ASP 2045Ca 0.24 1.06 -0.16 0.00 0.43 0.00 0.00 52.55 54.12 1lrn s ASP 2045Cb 0.19 1.49 0.16 0.00 -0.30 0.00 0.00 42.92 44.47 1lrn s ASP 2045CO 0.52 -0.16 1.22 -0.54 -0.17 0.00 0.00 175.17 176.04 1lrn s LYS 2046N 1.86 3.83 0.00 4.34 -0.14 0.13 -4.84 119.74 124.91 1lrn s LYS 2046Ca -0.07 -2.24 0.28 0.00 -1.36 0.00 0.00 55.97 52.58 1lrn s LYS 2046Cb -0.06 -4.91 1.50 0.00 -1.68 0.00 0.00 37.83 32.69 1lrn s LYS 2046CO -0.17 -1.70 1.97 0.00 -0.76 0.00 0.00 175.35 174.69 1lrn n ALA 2047N 5.74 2.44 -1.71 5.17 0.00 -1.26 -3.79 120.51 127.10 1lrn n ALA 2047Ca 0.28 -0.15 0.06 0.00 0.00 0.00 0.00 53.44 53.63 1lrn n ALA 2047Cb 0.46 -1.45 0.14 0.00 0.00 0.00 0.00 19.45 18.60 1lrn n ALA 2047CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1lrn n ASN 2048N -1.16 1.57 -4.76 0.00 2.04 -1.26 -5.08 115.26 106.61 1lrn n ASN 2048Ca 0.16 -3.25 -0.39 0.00 -0.44 0.00 0.00 54.58 50.67 1lrn n ASN 2048Cb 0.16 -0.44 0.03 0.00 -2.53 0.00 0.00 39.78 37.00 1lrn n ASN 2048CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1lrn s ARG 2049N -2.31 3.44 0.16 -3.83 1.81 -1.25 -4.91 118.95 112.06 1lrn s ARG 2049Ca 0.33 2.34 -0.12 0.00 -1.72 0.00 0.00 55.73 56.56 1lrn s ARG 2049Cb 0.33 -2.48 0.05 0.00 -0.45 0.00 0.00 34.95 32.41 1lrn s ARG 2049CO -0.07 -0.99 1.69 0.77 -0.68 0.00 0.00 175.30 176.02 1lrn h SER 2050N 1.93 0.81 -2.80 0.23 0.02 -1.97 -3.43 113.55 108.34 1lrn h SER 2050Ca -0.51 -0.21 -0.65 0.00 -0.84 0.00 0.00 61.79 59.58 1lrn h SER 2050Cb 1.28 -0.21 -0.08 0.00 0.14 0.00 0.00 62.40 63.53 1lrn h SER 2050CO 0.59 0.81 -0.44 -0.55 -1.14 0.00 0.00 176.83 176.10 1lrn s SER 2051N -6.16 6.42 0.44 3.07 0.15 -1.26 -4.97 113.70 111.39 1lrn s SER 2051Ca -0.13 0.50 0.30 0.00 0.70 0.00 0.00 55.95 57.32 1lrn s SER 2051Cb 0.12 -2.10 1.36 0.00 -1.71 0.00 0.00 66.02 63.69 1lrn s SER 2051CO 0.80 0.36 1.90 -0.29 1.20 0.00 0.00 173.24 177.21 1lrn h ILE 2052N 4.07 0.00 -0.52 6.45 6.09 -2.03 -2.82 117.51 128.76 1lrn h ILE 2052Ca -0.52 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 62.69 1lrn h ILE 2052Cb 1.22 1.12 0.00 0.00 0.47 0.00 0.00 36.82 39.63 1lrn h ILE 2052CO 0.62 0.00 0.00 1.41 -3.07 0.00 0.00 178.15 177.11 1lrn n HIS 2053N -2.68 1.63 -3.39 2.19 8.25 -1.26 -4.96 115.22 114.99 1lrn n HIS 2053Ca 0.00 -0.59 -0.19 0.00 -0.26 0.00 0.00 57.72 56.69 1lrn n HIS 2053Cb 0.21 -0.38 -0.00 0.00 1.12 0.00 0.00 29.99 30.94 1lrn n HIS 2053CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1lrn s SER 2054N -0.72 5.93 0.05 0.41 0.01 -1.07 -5.06 113.70 113.24 1lrn s SER 2054Ca 0.46 -0.21 -0.31 0.00 1.31 0.00 0.00 55.95 57.20 1lrn s SER 2054Cb 0.33 -1.15 -0.07 0.00 0.21 0.00 0.00 66.02 65.35 1lrn s SER 2054CO 0.16 -0.48 1.42 0.12 0.41 0.00 0.00 173.24 174.86 1lrn s PHE 2055N -2.20 2.95 -0.22 2.43 5.36 -1.26 -4.92 117.98 120.11 1lrn s PHE 2055Ca 0.46 0.83 -0.02 0.00 -0.96 0.00 0.00 56.93 57.24 1lrn s PHE 2055Cb -0.10 -3.69 -0.13 0.00 -0.34 0.00 0.00 43.02 38.77 1lrn s PHE 2055CO 0.31 -2.53 -0.22 0.54 -1.46 0.00 0.00 175.22 171.86 1lrn n ARG 2056N 4.90 0.51 -1.35 10.12 1.74 -1.26 -4.66 116.66 126.66 1lrn n ARG 2056Ca 0.13 0.15 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 1lrn n ARG 2056Cb 0.43 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.48 1lrn n ARG 2056CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1lrn n GLY 2057N 2.22 0.32 0.59 -0.13 0.00 -1.26 0.17 105.19 107.09 1lrn n GLY 2057Ca -0.40 -1.66 0.06 0.00 0.00 0.00 0.00 46.02 44.03 1lrn n GLY 2057CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1lrn n HIS 2058N 9.00 0.26 0.00 1.61 8.25 -1.25 -5.03 115.22 128.05 1lrn n HIS 2058Ca 0.00 -0.25 0.00 0.00 -0.26 0.00 0.00 57.72 57.21 1lrn n HIS 2058Cb 0.00 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.10 1lrn n HIS 2058CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lrn n GLY 2059N 0.64 2.36 0.30 -1.41 0.00 -1.22 -4.46 105.19 101.40 1lrn n GLY 2059Ca 0.10 -1.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.10 1lrn n GLY 2059CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lrn h LEU 2060N 0.00 0.99 0.13 0.99 5.85 -1.99 -1.18 115.31 120.11 1lrn h LEU 2060Ca 0.00 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 1lrn h LEU 2060Cb 0.00 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.77 1lrn h LEU 2060CO 0.00 1.00 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.71 1lrn h GLU 2061N 0.95 -0.17 -0.40 1.25 5.08 -1.97 0.55 114.58 119.87 1lrn h GLU 2061Ca 0.19 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 1lrn h GLU 2061Cb 0.43 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1lrn h GLU 2061CO 0.01 0.12 0.21 -0.92 -1.00 0.00 0.00 179.01 177.42 1lrn h TYR 2062N -0.47 0.53 0.17 4.33 3.20 -1.78 -1.76 116.97 121.20 1lrn h TYR 2062Ca -0.02 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 1lrn h TYR 2062Cb 0.37 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1lrn h TYR 2062CO 0.02 0.38 -0.08 0.78 -1.64 0.00 0.00 178.16 177.62 1lrn h GLY 2063N 0.64 -0.24 1.42 1.82 0.00 -1.01 -1.84 103.07 103.87 1lrn h GLY 2063Ca 0.14 0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.59 1lrn h GLY 2063CO -0.02 -0.09 0.32 -2.08 0.00 0.00 0.00 176.54 174.66 1lrn h VAL 2064N -0.68 1.04 -0.02 4.60 2.07 -0.77 -0.71 116.25 121.78 1lrn h VAL 2064Ca -0.02 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1lrn h VAL 2064Cb 0.49 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1lrn h VAL 2064CO 0.04 0.10 0.00 0.50 0.02 0.00 0.00 177.57 178.23 1lrn h LYS 2065N 0.52 0.03 -0.68 1.57 3.64 -1.29 0.02 116.57 120.39 1lrn h LYS 2065Ca 0.19 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 1lrn h LYS 2065Cb 0.12 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 1lrn h LYS 2065CO -0.05 0.30 0.43 0.00 -2.27 0.00 0.00 179.45 177.87 1lrn h ALA 2066N 0.73 0.87 -0.29 5.00 0.00 -0.61 -1.48 119.26 123.48 1lrn h ALA 2066Ca 0.01 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1lrn h ALA 2066Cb 0.29 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1lrn h ALA 2066CO 0.00 0.23 -0.22 -0.07 0.00 0.00 0.00 179.25 179.19 1lrn h LEU 2067N 0.87 0.56 -0.66 0.00 3.38 -1.09 -2.53 115.31 115.85 1lrn h LEU 2067Ca 0.26 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1lrn h LEU 2067Cb -0.04 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1lrn h LEU 2067CO -0.08 0.78 0.38 -0.09 0.09 0.00 0.00 178.44 179.52 1lrn h ARG 2068N 0.49 0.90 -0.21 1.13 2.43 -0.33 -1.75 114.38 117.05 1lrn h ARG 2068Ca 0.07 -0.09 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1lrn h ARG 2068Cb 0.66 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1lrn h ARG 2068CO 0.05 0.66 -0.04 -0.22 -1.51 0.00 0.00 179.97 178.91 1lrn h LYS 2069N 0.89 0.31 -0.15 0.20 1.63 -0.92 -0.93 116.57 117.60 1lrn h LYS 2069Ca 0.23 -0.06 -0.12 0.00 -0.85 0.00 0.00 60.65 59.86 1lrn h LYS 2069Cb 0.00 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 1lrn h LYS 2069CO -0.04 0.37 -0.37 0.28 -3.45 0.00 0.00 179.45 176.24 1lrn h VAL 2070N 0.30 1.36 -0.29 2.00 2.07 -0.98 -0.25 116.25 120.46 1lrn h VAL 2070Ca 0.07 -1.65 -0.07 0.00 0.82 0.00 0.00 66.70 65.87 1lrn h VAL 2070Cb 0.27 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1lrn h VAL 2070CO 0.01 0.50 -0.12 0.50 0.02 0.00 0.00 177.57 178.47 1lrn h LYS 2071N 0.13 0.48 0.06 1.57 3.64 -1.05 -1.31 116.57 120.09 1lrn h LYS 2071Ca -0.00 -0.14 -0.25 0.00 -1.27 0.00 0.00 60.65 58.99 1lrn h LYS 2071Cb 0.98 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 1lrn h LYS 2071CO 0.08 0.61 -1.17 0.93 -2.27 0.00 0.00 179.45 177.62 1lrn h GLU 2072N 0.45 0.13 0.00 1.90 5.08 -1.16 -0.21 114.58 120.77 1lrn h GLU 2072Ca 0.08 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1lrn h GLU 2072Cb 0.49 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1lrn h GLU 2072CO 0.03 1.08 -0.51 -1.91 -1.00 0.00 0.00 179.01 176.70 1lrn n GLU 2073N -3.42 0.18 0.00 2.33 2.13 -0.11 -4.41 120.64 117.34 1lrn n GLU 2073Ca -0.05 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1lrn n GLU 2073Cb 0.99 -1.62 0.00 0.00 0.27 0.00 0.00 31.44 31.07 1lrn n GLU 2073CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1lrn n PHE 2074N -1.89 0.00 -1.98 4.31 3.72 -0.50 -5.02 117.46 116.09 1lrn n PHE 2074Ca 0.04 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.31 1lrn n PHE 2074Cb 0.40 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.92 1lrn n PHE 2074CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1lrn n GLY 2075N 0.25 0.32 3.83 1.37 0.00 -0.09 -5.00 105.19 105.87 1lrn n GLY 2075Ca 0.00 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.28 1lrn n GLY 2075CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lrn s LEU 2076N -3.55 4.48 0.81 0.99 1.43 -1.25 -5.05 118.68 116.55 1lrn s LEU 2076Ca 0.00 1.00 -0.11 0.00 -1.03 0.00 0.00 54.13 53.99 1lrn s LEU 2076Cb 0.00 -2.64 0.09 0.00 0.03 0.00 0.00 46.19 43.66 1lrn s LEU 2076CO 0.00 0.31 1.13 -0.54 0.23 0.00 0.00 176.35 177.48 1lrn s LYS 2077N -1.12 1.79 0.13 1.70 1.02 -1.26 -4.38 119.74 117.62 1lrn s LYS 2077Ca 0.25 1.42 0.08 0.00 0.02 0.00 0.00 55.97 57.73 1lrn s LYS 2077Cb -0.17 -1.83 -0.04 0.00 -0.52 0.00 0.00 37.83 35.28 1lrn s LYS 2077CO 0.14 -2.03 -0.19 0.42 -0.92 0.00 0.00 175.35 172.77 1lrn s ILE 2078N -2.64 1.67 -0.16 2.17 -1.09 -1.26 -1.07 121.20 118.82 1lrn s ILE 2078Ca 0.66 -1.70 -0.14 0.00 -2.23 0.00 0.00 60.65 57.23 1lrn s ILE 2078Cb -0.21 -1.64 0.04 0.00 -1.58 0.00 0.00 42.46 39.07 1lrn s ILE 2078CO 0.54 -0.22 0.43 0.28 -1.23 0.00 0.00 174.94 174.74 1lrn s THR 2079N -1.65 -0.00 0.17 2.92 -1.32 -0.35 0.21 115.64 115.62 1lrn s THR 2079Ca 0.10 0.02 -0.12 0.00 -1.21 0.00 0.00 61.69 60.47 1lrn s THR 2079Cb -0.08 -0.60 0.01 0.00 -1.51 0.00 0.00 72.50 70.32 1lrn s THR 2079CO 0.05 0.01 0.36 0.28 -2.21 0.00 0.00 174.62 173.11 1lrn s THR 2080N 0.43 0.06 0.02 5.08 -1.32 -1.20 -2.89 115.64 115.82 1lrn s THR 2080Ca -0.02 -1.12 -0.01 0.00 -1.21 0.00 0.00 61.69 59.34 1lrn s THR 2080Cb -0.04 -1.67 -0.04 0.00 -1.51 0.00 0.00 72.50 69.24 1lrn s THR 2080CO -0.02 -0.27 0.15 1.51 -2.21 0.00 0.00 174.62 173.78 1lrn s ASP 2081N -2.92 6.10 0.19 8.08 -4.77 -1.26 -0.67 116.67 121.43 1lrn s ASP 2081Ca 0.13 0.24 0.07 0.00 -3.30 0.00 0.00 52.55 49.68 1lrn s ASP 2081Cb 0.02 -1.84 -0.04 0.00 -1.09 0.00 0.00 42.92 39.97 1lrn s ASP 2081CO -0.03 0.23 0.08 0.27 0.70 0.00 0.00 175.17 176.43 1lrn s ILE 2082N -1.34 4.11 0.00 2.11 -4.36 -0.71 -4.80 121.20 116.20 1lrn s ILE 2082Ca 0.28 -1.34 0.00 0.00 -0.26 0.00 0.00 60.65 59.33 1lrn s ILE 2082Cb -0.12 -3.12 0.00 0.00 1.25 0.00 0.00 42.46 40.47 1lrn s ILE 2082CO 0.20 -0.18 0.00 1.41 0.24 0.00 0.00 174.94 176.61 1lrn n HIS 2083N -0.46 0.00 -3.91 1.37 8.25 -1.26 -4.33 115.22 114.88 1lrn n HIS 2083Ca -0.09 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.27 1lrn n HIS 2083Cb 0.56 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.57 1lrn n HIS 2083CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1lrn s GLU 2084N -1.81 0.52 0.28 -0.41 2.02 -1.26 -5.08 118.70 112.95 1lrn s GLU 2084Ca 0.00 -0.60 0.00 0.00 0.02 0.00 0.00 54.97 54.40 1lrn s GLU 2084Cb 0.00 0.21 0.64 0.00 0.10 0.00 0.00 34.13 35.08 1lrn s GLU 2084CO 0.00 -0.13 1.67 0.77 0.02 0.00 0.00 175.26 177.60 1lrn h SER 2085N 3.99 0.10 0.14 -0.19 0.02 -1.91 -1.81 113.55 113.90 1lrn h SER 2085Ca -0.32 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1lrn h SER 2085Cb 1.19 0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.94 1lrn h SER 2085CO 0.45 -0.07 0.00 4.11 -1.14 0.00 0.00 176.83 180.18 1lrn h TRP 2086N 0.29 0.00 0.00 3.45 5.08 -1.98 -2.49 115.95 120.30 1lrn h TRP 2086Ca 0.51 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.48 1lrn h TRP 2086Cb 0.97 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.13 1lrn h TRP 2086CO -0.23 0.00 -0.04 1.96 -1.28 0.00 0.00 178.44 178.85 1lrn h GLN 2087N 0.00 0.00 -0.11 0.12 4.20 -1.76 -3.37 115.11 114.18 1lrn h GLN 2087Ca 0.00 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.75 1lrn h GLN 2087Cb 0.07 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.80 1lrn h GLN 2087CO 0.00 0.00 -0.23 0.00 -0.67 0.00 0.00 178.83 177.93 1lrn h ALA 2088N 2.16 -0.22 0.61 3.87 0.00 -1.60 -2.14 119.26 121.95 1lrn h ALA 2088Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1lrn h ALA 2088Cb 0.92 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1lrn h ALA 2088CO 0.00 -0.70 -0.30 1.49 0.00 0.00 0.00 179.25 179.74 1lrn h GLU 2089N -0.30 -0.80 -0.45 0.00 4.81 -1.80 -0.39 114.58 115.64 1lrn h GLU 2089Ca 0.10 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1lrn h GLU 2089Cb 0.44 0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 1lrn h GLU 2089CO -0.29 -0.53 0.25 -1.00 -0.73 0.00 0.00 179.01 176.70 1lrn h PRO 2090N -0.83 0.61 -0.46 0.92 0.13 -1.77 -2.36 132.00 128.24 1lrn h PRO 2090Ca -0.08 -0.06 -0.14 0.00 -0.87 0.00 0.00 66.00 64.86 1lrn h PRO 2090Cb 0.64 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.63 1lrn h PRO 2090CO 0.13 0.45 -0.24 0.28 -0.23 0.00 0.00 178.00 178.39 1lrn h VAL 2091N 0.62 1.27 0.00 1.56 2.07 -1.26 -2.89 116.25 117.62 1lrn h VAL 2091Ca 0.16 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.27 1lrn h VAL 2091Cb 0.02 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1lrn h VAL 2091CO -0.03 0.48 0.11 0.00 0.02 0.00 0.00 177.57 178.16 1lrn h ALA 2092N 0.88 1.08 -0.65 1.67 0.00 -0.50 -0.71 119.26 121.02 1lrn h ALA 2092Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1lrn h ALA 2092Cb 0.82 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1lrn h ALA 2092CO 0.07 -0.08 0.39 0.93 0.00 0.00 0.00 179.25 180.56 1lrn h GLU 2093N 0.00 0.89 0.00 0.00 4.39 -1.51 -3.35 114.58 115.00 1lrn h GLU 2093Ca 0.00 -0.09 -0.27 0.00 0.34 0.00 0.00 59.36 59.34 1lrn h GLU 2093Cb 0.22 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 28.64 1lrn h GLU 2093CO 0.00 0.65 -2.01 0.28 -1.16 0.00 0.00 179.01 176.76 1lrn n VAL 2094N -4.57 1.02 -2.01 3.13 0.31 -0.70 -5.00 118.33 110.50 1lrn n VAL 2094Ca 0.05 -0.37 -0.42 0.00 -0.01 0.00 0.00 64.34 63.59 1lrn n VAL 2094Cb 0.06 -1.23 -0.03 0.00 -0.91 0.00 0.00 33.84 31.74 1lrn n VAL 2094CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1lrn s ALA 2095N -2.35 3.64 0.07 3.52 0.00 -0.36 -4.50 121.76 121.79 1lrn s ALA 2095Ca -0.24 1.06 0.05 0.00 0.00 0.00 0.00 51.96 52.83 1lrn s ALA 2095Cb 0.07 -3.69 -0.23 0.00 0.00 0.00 0.00 23.12 19.26 1lrn s ALA 2095CO 0.39 -1.16 1.10 -0.44 0.00 0.00 0.00 175.76 175.65 1lrn h ASP 2096N 8.63 0.10 -3.22 0.00 3.32 -0.56 -3.43 116.42 121.27 1lrn h ASP 2096Ca -0.41 -0.13 -0.53 0.00 0.02 0.00 0.00 57.03 55.98 1lrn h ASP 2096Cb 1.19 -0.03 -0.36 0.00 0.22 0.00 0.00 39.33 40.34 1lrn h ASP 2096CO 0.93 1.10 -0.81 -0.63 -1.72 0.00 0.00 179.24 178.12 1lrn s ILE 2097N -2.67 1.11 -0.17 0.35 1.01 -0.81 -2.13 121.20 117.88 1lrn s ILE 2097Ca -0.02 -0.36 -0.18 0.00 0.00 0.00 0.00 60.65 60.09 1lrn s ILE 2097Cb 0.09 -1.09 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1lrn s ILE 2097CO 0.83 0.38 0.48 -0.63 0.00 0.00 0.00 174.94 176.00 1lrn s ILE 2098N 1.48 5.15 -0.13 2.92 1.01 0.44 -3.23 121.20 128.85 1lrn s ILE 2098Ca 0.01 0.90 -0.11 0.00 0.00 0.00 0.00 60.65 61.45 1lrn s ILE 2098Cb -0.13 -3.81 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 1lrn s ILE 2098CO -0.06 0.24 0.22 -1.58 0.00 0.00 0.00 174.94 173.76 1lrn s GLN 2099N 1.25 3.91 -0.28 2.79 0.74 0.16 -1.04 119.66 127.18 1lrn s GLN 2099Ca 0.23 -0.00 -0.08 0.00 0.05 0.00 0.00 55.36 55.56 1lrn s GLN 2099Cb -0.15 -3.31 -0.02 0.00 1.10 0.00 0.00 33.01 30.63 1lrn s GLN 2099CO 0.09 0.51 0.11 0.42 -0.55 0.00 0.00 175.29 175.88 1lrn s ILE 2100N -0.31 4.46 0.59 -2.34 -1.09 -0.27 -1.74 121.20 120.48 1lrn s ILE 2100Ca 0.15 -0.31 -0.18 0.00 -2.23 0.00 0.00 60.65 58.08 1lrn s ILE 2100Cb -0.13 -3.19 -0.06 0.00 -1.58 0.00 0.00 42.46 37.50 1lrn s ILE 2100CO 0.04 0.19 0.77 -2.65 -1.23 0.00 0.00 174.94 172.06 1lrn n PRO 2101N 4.95 0.71 -0.06 2.79 -0.02 -1.26 -1.62 135.00 140.49 1lrn n PRO 2101Ca -0.15 0.28 -0.08 0.00 -2.02 0.00 0.00 63.50 61.53 1lrn n PRO 2101Cb 0.50 -1.95 -0.01 0.00 -0.02 0.00 0.00 33.50 32.01 1lrn n PRO 2101CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lrn h ALA 2102N 0.37 0.25 0.00 3.55 0.00 -1.90 -1.81 119.26 119.71 1lrn h ALA 2102Ca -0.47 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1lrn h ALA 2102Cb 1.38 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 1lrn h ALA 2102CO 0.49 -0.37 -0.03 0.74 0.00 0.00 0.00 179.25 180.08 1lrn h PHE 2103N 0.14 0.00 -0.69 0.00 0.04 -1.91 -2.53 116.94 111.98 1lrn h PHE 2103Ca 0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.88 1lrn h PHE 2103Cb 0.12 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.27 1lrn h PHE 2103CO -0.16 0.03 0.00 1.28 -0.60 0.00 0.00 178.31 178.86 1lrn n LEU 2104N -3.76 3.89 0.00 1.54 4.77 -0.72 -4.56 117.00 118.16 1lrn n LEU 2104Ca -0.03 -1.95 0.00 0.00 -0.03 0.00 0.00 56.01 54.01 1lrn n LEU 2104Cb 0.12 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1lrn n LEU 2104CO 0.28 0.96 0.49 0.00 -1.33 0.00 0.00 177.39 177.79 1lrn n ARG 2106N -1.48 0.86 -2.57 0.00 5.12 -1.26 -4.91 116.66 112.41 1lrn n ARG 2106Ca 0.00 -1.27 -0.41 0.00 -1.93 0.00 0.00 57.85 54.24 1lrn n ARG 2106Cb 0.00 -1.20 -0.03 0.00 -1.16 0.00 0.00 32.46 30.07 1lrn n ARG 2106CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1lrn s GLN 2107N -0.86 3.23 0.20 5.56 -1.52 -0.48 -4.90 119.66 120.89 1lrn s GLN 2107Ca 0.13 -0.39 -0.18 0.00 -1.95 0.00 0.00 55.36 52.98 1lrn s GLN 2107Cb 0.09 -4.32 0.18 0.00 -0.22 0.00 0.00 33.01 28.73 1lrn s GLN 2107CO 0.13 -2.13 1.60 1.15 -0.25 0.00 0.00 175.29 175.79 1lrn h THR 2108N 6.11 0.23 -0.54 -0.19 2.02 -1.91 -1.60 112.91 117.05 1lrn h THR 2108Ca -0.22 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.96 1lrn h THR 2108Cb 1.05 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1lrn h THR 2108CO 1.29 0.00 0.36 0.44 0.37 0.00 0.00 175.52 177.98 1lrn h ASP 2109N -0.10 0.62 -0.45 4.18 3.32 -1.99 0.67 116.42 122.66 1lrn h ASP 2109Ca 0.27 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.19 1lrn h ASP 2109Cb 0.53 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1lrn h ASP 2109CO -0.68 0.45 -0.16 0.25 -1.72 0.00 0.00 179.24 177.38 1lrn h LEU 2110N 0.73 0.93 -0.40 1.55 5.85 -1.69 -0.67 115.31 121.60 1lrn h LEU 2110Ca 0.20 -0.38 -0.08 0.00 0.84 0.00 0.00 57.88 58.45 1lrn h LEU 2110Cb -0.08 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.68 1lrn h LEU 2110CO -0.04 1.10 -0.07 -0.07 -0.34 0.00 0.00 178.44 179.02 1lrn h LEU 2111N 0.75 0.76 -0.66 2.25 3.38 -0.83 -2.34 115.31 118.61 1lrn h LEU 2111Ca 0.11 -0.35 -0.11 0.00 0.09 0.00 0.00 57.88 57.63 1lrn h LEU 2111Cb 0.72 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1lrn h LEU 2111CO 0.06 0.93 -0.11 -0.07 0.09 0.00 0.00 178.44 179.34 1lrn h LEU 2112N 0.58 0.93 -0.95 1.67 3.38 -0.79 -1.61 115.31 118.51 1lrn h LEU 2112Ca 0.11 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.72 1lrn h LEU 2112Cb 0.58 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1lrn h LEU 2112CO 0.03 1.05 0.08 0.00 0.09 0.00 0.00 178.44 179.69 1lrn h ALA 2113N 1.04 1.14 -0.24 1.53 0.00 -1.05 0.19 119.26 121.87 1lrn h ALA 2113Ca 0.13 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 1lrn h ALA 2113Cb 0.64 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1lrn h ALA 2113CO 0.04 0.57 -0.40 0.00 0.00 0.00 0.00 179.25 179.46 1lrn h ALA 2114N 1.28 0.37 -0.55 0.00 0.00 -1.23 -3.16 119.26 115.97 1lrn h ALA 2114Ca 0.17 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 1lrn h ALA 2114Cb 0.36 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1lrn h ALA 2114CO 0.01 0.48 0.05 0.00 0.00 0.00 0.00 179.25 179.78 1lrn h ALA 2115N 0.64 1.05 -0.12 0.00 0.00 -1.04 -2.90 119.26 116.88 1lrn h ALA 2115Ca 0.02 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.70 1lrn h ALA 2115Cb 1.00 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1lrn h ALA 2115CO 0.09 0.60 0.09 -0.22 0.00 0.00 0.00 179.25 179.82 1lrn h LYS 2116N 0.85 0.00 0.00 0.00 3.64 -0.93 -1.90 116.57 118.24 1lrn h LYS 2116Ca 0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1lrn h LYS 2116Cb 0.43 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1lrn h LYS 2116CO 0.02 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.45 1lrn n THR 2117N -4.40 0.94 -0.32 1.00 -2.24 -1.10 -4.87 114.28 103.30 1lrn n THR 2117Ca -0.00 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 1lrn n THR 2117Cb 0.21 -1.08 0.00 0.00 -2.10 0.00 0.00 70.33 67.36 1lrn n THR 2117CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lrn n GLY 2118N -0.03 2.03 3.85 3.38 0.00 -0.71 -5.02 105.19 108.69 1lrn n GLY 2118Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1lrn n GLY 2118CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lrn s ARG 2119N -0.11 0.81 0.44 1.61 1.81 -1.26 -4.93 118.95 117.32 1lrn s ARG 2119Ca 0.00 -0.10 -0.21 0.00 -1.72 0.00 0.00 55.73 53.70 1lrn s ARG 2119Cb 0.00 -1.84 -0.11 0.00 -0.45 0.00 0.00 34.95 32.56 1lrn s ARG 2119CO 0.00 -2.35 0.97 0.00 -0.68 0.00 0.00 175.30 173.24 1lrn s ALA 2120N -3.58 3.02 -0.10 2.13 0.00 -0.91 -4.74 121.76 117.59 1lrn s ALA 2120Ca 0.69 0.44 0.02 0.00 0.00 0.00 0.00 51.96 53.11 1lrn s ALA 2120Cb -0.09 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.88 1lrn s ALA 2120CO 0.52 0.06 -0.17 0.08 0.00 0.00 0.00 175.76 176.25 1lrn s VAL 2121N -2.13 1.60 -0.27 0.00 1.01 -0.24 -0.42 120.40 119.95 1lrn s VAL 2121Ca 0.63 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 1lrn s VAL 2121Cb -0.10 -1.43 0.04 0.00 0.00 0.00 0.00 36.38 34.88 1lrn s VAL 2121CO 0.14 0.46 -0.04 0.21 0.00 0.00 0.00 175.10 175.88 1lrn s ASN 2122N 0.78 4.60 -0.26 3.32 3.04 -0.21 -0.56 114.94 125.65 1lrn s ASN 2122Ca -0.11 -1.10 -0.13 0.00 0.04 0.00 0.00 52.86 51.56 1lrn s ASN 2122Cb -0.16 -1.68 -0.04 0.00 -1.54 0.00 0.00 41.25 37.83 1lrn s ASN 2122CO 0.02 -0.20 0.29 -0.69 -3.04 0.00 0.00 177.10 173.48 1lrn s VAL 2123N 1.27 5.24 -0.01 -5.21 1.01 0.66 -1.12 120.40 122.25 1lrn s VAL 2123Ca -0.03 0.40 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 1lrn s VAL 2123Cb -0.18 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1lrn s VAL 2123CO -0.03 0.22 1.24 -0.54 0.00 0.00 0.00 175.10 175.99 1lrn s LYS 2124N 1.79 4.36 -0.10 2.72 -0.14 -0.64 -0.96 119.74 126.76 1lrn s LYS 2124Ca 0.12 1.76 -0.29 0.00 -1.36 0.00 0.00 55.97 56.19 1lrn s LYS 2124Cb -0.16 -3.51 -0.04 0.00 -1.68 0.00 0.00 37.83 32.45 1lrn s LYS 2124CO 0.10 -0.43 1.52 0.21 -0.76 0.00 0.00 175.35 175.99 1lrn s LYS 2125N 1.96 4.17 0.36 1.68 2.20 0.07 -4.04 119.74 126.14 1lrn s LYS 2125Ca 0.58 1.98 -0.26 0.00 -0.36 0.00 0.00 55.97 57.91 1lrn s LYS 2125Cb -0.27 -3.92 -0.12 0.00 -1.51 0.00 0.00 37.83 32.01 1lrn s LYS 2125CO 0.25 -0.83 1.03 0.41 -0.36 0.00 0.00 175.35 175.85 1lrn n GLY 2126N 3.99 -0.17 0.03 5.54 0.00 -1.24 -4.55 105.19 108.79 1lrn n GLY 2126Ca 0.16 0.23 0.05 0.00 0.00 0.00 0.00 46.02 46.47 1lrn n GLY 2126CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1lrn n GLN 2127N 0.45 0.03 0.00 1.61 3.00 -1.26 -1.75 117.38 119.46 1lrn n GLN 2127Ca 0.09 0.40 0.09 0.00 -0.01 0.00 0.00 57.00 57.57 1lrn n GLN 2127Cb 0.36 -1.58 -0.03 0.00 0.00 0.00 0.00 30.24 28.99 1lrn n GLN 2127CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 1lrn n PHE 2128N -1.65 0.00 -3.43 1.08 1.16 -1.26 -1.32 117.46 112.04 1lrn n PHE 2128Ca 0.02 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.21 1lrn n PHE 2128Cb 0.10 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.91 1lrn n PHE 2128CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 1lrn s LEU 2129N -2.41 4.47 0.45 5.98 2.96 -0.71 -5.06 118.68 124.35 1lrn s LEU 2129Ca 0.13 1.01 -0.14 0.00 -0.22 0.00 0.00 54.13 54.92 1lrn s LEU 2129Cb 0.15 -2.67 -0.08 0.00 0.50 0.00 0.00 46.19 44.10 1lrn s LEU 2129CO 0.55 0.28 0.87 0.00 -1.32 0.00 0.00 176.35 176.73 1lrn s ALA 2130N -0.89 3.20 0.16 5.97 0.00 -1.26 -4.89 121.76 124.05 1lrn s ALA 2130Ca 0.25 0.03 -0.17 0.00 0.00 0.00 0.00 51.96 52.07 1lrn s ALA 2130Cb -0.17 -2.92 0.08 0.00 0.00 0.00 0.00 23.12 20.11 1lrn s ALA 2130CO 0.14 -0.07 1.69 -1.35 0.00 0.00 0.00 175.76 176.18 1lrn h PRO 2131N 1.25 0.07 0.00 0.00 0.11 -1.98 -2.04 132.00 129.41 1lrn h PRO 2131Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1lrn h PRO 2131Cb 1.18 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1lrn h PRO 2131CO 0.63 0.04 0.00 0.11 -0.21 0.00 0.00 178.00 178.57 1lrn h TRP 2132N 0.07 0.00 -0.06 0.65 0.09 -1.94 -2.28 115.95 112.48 1lrn h TRP 2132Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.16 1lrn h TRP 2132Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.50 1lrn h TRP 2132CO -0.28 0.00 0.00 -0.25 0.09 0.00 0.00 178.44 178.00 1lrn n ASP 2133N -2.81 0.64 0.05 0.11 8.00 -0.77 -2.98 116.55 118.79 1lrn n ASP 2133Ca -0.00 -1.54 0.13 0.00 0.71 0.00 0.00 54.79 54.08 1lrn n ASP 2133Cb 0.18 -0.04 0.36 0.00 -0.02 0.00 0.00 41.12 41.60 1lrn n ASP 2133CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1lrn n THR 2134N -0.35 0.26 -0.21 -3.53 -2.24 -0.86 -3.65 114.28 103.70 1lrn n THR 2134Ca 0.14 -0.16 -0.04 0.00 -2.27 0.00 0.00 64.05 61.73 1lrn n THR 2134Cb 0.16 -0.26 0.06 0.00 -2.10 0.00 0.00 70.33 68.19 1lrn n THR 2134CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1lrn h LYS 2135N 0.00 0.72 0.00 -0.78 3.64 -1.74 -1.51 116.57 116.90 1lrn h LYS 2135Ca 0.00 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 1lrn h LYS 2135Cb 0.64 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1lrn h LYS 2135CO 0.00 0.48 -0.33 -0.91 -2.27 0.00 0.00 179.45 176.41 1lrn h ASN 2136N 0.74 0.00 -0.37 4.20 -0.26 -1.82 -1.90 115.58 116.18 1lrn h ASN 2136Ca 0.25 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.96 1lrn h ASN 2136Cb 0.03 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.28 1lrn h ASN 2136CO -0.11 0.33 0.10 0.58 -1.06 0.00 0.00 177.43 177.27 1lrn h VAL 2137N 0.00 1.22 -0.32 2.81 2.07 -1.45 -1.97 116.25 118.61 1lrn h VAL 2137Ca -0.00 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 1lrn h VAL 2137Cb 0.61 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1lrn h VAL 2137CO 0.04 0.26 0.15 0.58 0.02 0.00 0.00 177.57 178.62 1lrn h VAL 2138N 0.45 1.16 -0.91 2.57 2.07 -1.09 -2.64 116.25 117.85 1lrn h VAL 2138Ca 0.12 -0.46 0.12 0.00 0.82 0.00 0.00 66.70 67.29 1lrn h VAL 2138Cb 0.29 0.87 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 1lrn h VAL 2138CO -0.00 0.17 0.54 -0.08 0.02 0.00 0.00 177.57 178.21 1lrn h GLU 2139N 0.38 0.82 -0.40 1.57 4.81 -1.17 0.12 114.58 120.71 1lrn h GLU 2139Ca 0.11 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1lrn h GLU 2139Cb 0.12 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1lrn h GLU 2139CO -0.01 0.54 0.26 0.87 -0.73 0.00 0.00 179.01 179.94 1lrn h LYS 2140N 0.85 0.54 -0.54 1.92 1.57 -1.02 0.55 116.57 120.43 1lrn h LYS 2140Ca 0.45 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 59.15 1lrn h LYS 2140Cb 0.48 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 1lrn h LYS 2140CO -0.28 0.37 0.15 -0.07 -0.57 0.00 0.00 179.45 179.05 1lrn h LEU 2141N 0.54 0.80 -0.48 2.94 3.38 -0.86 -0.66 115.31 120.98 1lrn h LEU 2141Ca 0.15 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1lrn h LEU 2141Cb -0.05 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1lrn h LEU 2141CO -0.03 0.81 0.28 0.11 0.09 0.00 0.00 178.44 179.71 1lrn h LYS 2142N 0.75 0.65 -0.49 1.13 1.57 -0.51 -0.56 116.57 119.11 1lrn h LYS 2142Ca 0.17 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.94 1lrn h LYS 2142Cb 0.31 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1lrn h LYS 2142CO -0.00 0.49 0.33 0.35 -0.57 0.00 0.00 179.45 180.05 1lrn h PHE 2143N 0.64 0.46 -0.02 -1.35 3.57 -0.59 -1.19 116.94 118.45 1lrn h PHE 2143Ca 0.17 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.68 1lrn h PHE 2143Cb 0.01 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.60 1lrn h PHE 2143CO -0.03 0.25 0.00 0.41 -2.23 0.00 0.00 178.31 176.72 1lrn n GLY 2144N -1.50 -0.53 0.30 2.40 0.00 -0.28 -4.92 105.19 100.66 1lrn n GLY 2144Ca 0.06 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1lrn n GLY 2144CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lrn n GLY 2145N 1.04 0.71 3.75 -0.02 0.00 -0.45 -3.70 105.19 106.51 1lrn n GLY 2145Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1lrn n GLY 2145CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lrn s ALA 2146N -2.14 3.38 -0.02 4.61 0.00 -0.35 -4.90 121.76 122.34 1lrn s ALA 2146Ca 0.00 0.83 0.03 0.00 0.00 0.00 0.00 51.96 52.82 1lrn s ALA 2146Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1lrn s ALA 2146CO 0.00 -0.16 0.05 1.63 0.00 0.00 0.00 175.76 177.28 1lrn n LYS 2147N 1.90 1.81 -3.75 0.00 5.02 -1.26 -4.32 118.16 117.55 1lrn n LYS 2147Ca 0.01 -0.02 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 1lrn n LYS 2147Cb 0.46 -1.09 -0.11 0.00 -0.02 0.00 0.00 35.03 34.27 1lrn n LYS 2147CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1lrn s GLU 2148N -2.17 2.07 -0.11 1.97 2.12 -1.26 -5.07 118.70 116.25 1lrn s GLU 2148Ca -0.02 -1.79 0.02 0.00 0.36 0.00 0.00 54.97 53.54 1lrn s GLU 2148Cb 0.02 -3.61 -0.01 0.00 0.26 0.00 0.00 34.13 30.78 1lrn s GLU 2148CO 0.15 -1.07 -0.16 0.42 -0.54 0.00 0.00 175.26 174.05 1lrn s ILE 2149N 1.17 2.77 0.03 -3.70 1.01 -1.26 -1.07 121.20 120.15 1lrn s ILE 2149Ca 0.08 -0.77 0.08 0.00 0.00 0.00 0.00 60.65 60.03 1lrn s ILE 2149Cb -0.23 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 1lrn s ILE 2149CO -0.04 0.54 -0.22 -0.31 0.00 0.00 0.00 174.94 174.91 1lrn s TYR 2150N 0.20 1.96 -0.15 3.97 1.51 0.28 -3.00 117.35 122.13 1lrn s TYR 2150Ca -0.10 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.59 1lrn s TYR 2150Cb -0.16 -1.19 0.01 0.00 -0.11 0.00 0.00 41.96 40.51 1lrn s TYR 2150CO 0.06 0.07 -0.19 -0.51 -1.11 0.00 0.00 175.55 173.87 1lrn s LEU 2151N -1.05 2.24 -0.21 -1.29 1.43 -0.29 -0.24 118.68 119.25 1lrn s LEU 2151Ca 0.09 -0.56 -0.05 0.00 -1.03 0.00 0.00 54.13 52.57 1lrn s LEU 2151Cb -0.09 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.62 1lrn s LEU 2151CO 0.01 0.07 0.01 -0.89 0.23 0.00 0.00 176.35 175.78 1lrn s THR 2152N 0.87 3.93 -0.11 5.49 2.01 -0.14 -1.05 115.64 126.64 1lrn s THR 2152Ca -0.05 -0.31 -0.30 0.00 0.31 0.00 0.00 61.69 61.34 1lrn s THR 2152Cb -0.15 -2.79 -0.02 0.00 0.01 0.00 0.00 72.50 69.55 1lrn s THR 2152CO -0.02 0.41 1.13 -0.70 -0.69 0.00 0.00 174.62 174.75 1lrn s GLU 2153N 1.22 4.34 -0.04 4.92 2.56 0.07 -0.75 118.70 131.02 1lrn s GLU 2153Ca 0.03 1.55 0.08 0.00 0.00 0.00 0.00 54.97 56.63 1lrn s GLU 2153Cb -0.15 -3.60 0.14 0.00 2.00 0.00 0.00 34.13 32.53 1lrn s GLU 2153CO 0.01 -0.48 1.07 2.89 -0.56 0.00 0.00 175.26 178.19 1lrn n ARG 2154N 5.53 0.41 0.00 4.30 -4.01 -1.26 -0.62 116.66 121.00 1lrn n ARG 2154Ca 0.11 -1.63 0.00 0.00 -1.04 0.00 0.00 57.85 55.29 1lrn n ARG 2154Cb 0.47 -0.76 0.00 0.00 -3.04 0.00 0.00 32.46 29.12 1lrn n ARG 2154CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1lrn n GLY 2155N -0.38 1.53 3.09 2.89 0.00 -1.26 -3.79 105.19 107.27 1lrn n GLY 2155Ca 0.06 -1.86 -0.21 0.00 0.00 0.00 0.00 46.02 44.01 1lrn n GLY 2155CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lrn s THR 2156N -2.82 0.98 -0.13 2.61 2.01 0.50 -4.31 115.64 114.48 1lrn s THR 2156Ca 0.00 -0.61 -0.38 0.00 0.31 0.00 0.00 61.69 61.01 1lrn s THR 2156Cb 0.00 -0.84 -0.15 0.00 0.01 0.00 0.00 72.50 71.52 1lrn s THR 2156CO 0.00 0.22 1.68 0.41 -0.69 0.00 0.00 174.62 176.23 1lrn n THR 2157N 2.60 0.28 -3.67 -0.82 -1.04 -0.43 -1.56 114.28 109.64 1lrn n THR 2157Ca -0.15 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.52 1lrn n THR 2157Cb 0.56 -1.30 -0.13 0.00 -1.82 0.00 0.00 70.33 67.64 1lrn n THR 2157CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1lrn s PHE 2158N 2.84 1.78 0.00 -1.42 5.36 -0.58 -4.85 117.98 121.11 1lrn s PHE 2158Ca 0.93 -2.30 0.00 0.00 -0.96 0.00 0.00 56.93 54.60 1lrn s PHE 2158Cb -0.94 -1.73 0.00 0.00 -0.34 0.00 0.00 43.02 40.01 1lrn s PHE 2158CO 0.57 -0.79 0.00 0.41 -1.46 0.00 0.00 175.22 173.95 1lrn n GLY 2159N 3.62 -0.51 3.85 13.12 0.00 -1.26 -4.33 105.19 119.68 1lrn n GLY 2159Ca 0.09 -1.10 -0.37 0.00 0.00 0.00 0.00 46.02 44.64 1lrn n GLY 2159CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lrn s TYR 2160N 0.00 3.66 -1.52 1.61 2.02 -1.26 -4.42 117.35 117.44 1lrn s TYR 2160Ca 0.00 0.86 -0.12 0.00 -0.37 0.00 0.00 57.07 57.44 1lrn s TYR 2160Cb 0.00 -2.20 0.08 0.00 -0.40 0.00 0.00 41.96 39.45 1lrn s TYR 2160CO 0.00 0.62 0.91 0.09 -1.57 0.00 0.00 175.55 175.59 1lrn n ASN 2161N 1.52 -4.04 -3.63 2.29 3.02 -1.26 -4.96 115.26 108.20 1lrn n ASN 2161Ca -0.13 -0.82 -0.15 0.00 -0.03 0.00 0.00 54.58 53.45 1lrn n ASN 2161Cb 0.53 -3.74 -0.07 0.00 -0.61 0.00 0.00 39.78 35.88 1lrn n ASN 2161CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1lrn s ASN 2162N -3.47 -0.61 -0.02 6.41 3.04 -1.26 -4.22 114.94 114.81 1lrn s ASN 2162Ca 0.57 0.96 0.05 0.00 0.04 0.00 0.00 52.86 54.49 1lrn s ASN 2162Cb -0.29 0.94 -0.01 0.00 -1.54 0.00 0.00 41.25 40.35 1lrn s ASN 2162CO 0.84 -0.37 -0.18 -0.76 -3.04 0.00 0.00 177.10 173.59 1lrn s LEU 2163N -0.33 1.99 0.05 3.21 1.43 -1.26 -1.53 118.68 122.23 1lrn s LEU 2163Ca -0.05 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.78 1lrn s LEU 2163Cb -0.03 -0.96 -0.03 0.00 0.03 0.00 0.00 46.19 45.20 1lrn s LEU 2163CO 0.04 0.20 -0.18 0.54 0.23 0.00 0.00 176.35 177.18 1lrn s VAL 2164N -0.27 2.78 -0.34 -1.59 0.11 -0.60 -4.82 120.40 115.66 1lrn s VAL 2164Ca 0.03 -1.21 -0.12 0.00 -2.93 0.00 0.00 61.98 57.75 1lrn s VAL 2164Cb -0.09 -2.17 -0.01 0.00 -1.53 0.00 0.00 36.38 32.58 1lrn s VAL 2164CO 0.00 0.32 0.22 -0.69 -3.33 0.00 0.00 175.10 171.63 1lrn s VAL 2165N -0.94 5.03 -0.63 2.04 1.01 -1.26 -0.37 120.40 125.28 1lrn s VAL 2165Ca 0.15 -0.39 -0.19 0.00 0.00 0.00 0.00 61.98 61.55 1lrn s VAL 2165Cb -0.10 -3.63 0.11 0.00 0.00 0.00 0.00 36.38 32.76 1lrn s VAL 2165CO 0.05 -0.05 0.74 -0.62 0.00 0.00 0.00 175.10 175.23 1lrn s ASP 2166N 1.67 6.25 0.00 3.32 -1.08 -1.26 -4.90 116.67 120.67 1lrn s ASP 2166Ca 0.05 -1.55 0.06 0.00 -0.52 0.00 0.00 52.55 50.59 1lrn s ASP 2166Cb -0.18 -2.30 0.29 0.00 -1.46 0.00 0.00 42.92 39.27 1lrn s ASP 2166CO 0.09 -1.08 1.03 0.49 0.52 0.00 0.00 175.17 176.21 1lrn n PHE 2167N 6.22 0.00 0.25 -5.34 3.01 -1.26 -1.46 117.46 118.88 1lrn n PHE 2167Ca -0.06 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.52 1lrn n PHE 2167Cb 0.43 -0.28 0.64 0.00 -0.01 0.00 0.00 39.48 40.26 1lrn n PHE 2167CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1lrn h ARG 2168N 0.00 0.00 -0.59 -1.08 3.08 -2.03 -2.99 114.38 110.77 1lrn h ARG 2168Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1lrn h ARG 2168Cb 0.05 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 1lrn h ARG 2168CO 0.00 0.16 0.32 0.66 -1.07 0.00 0.00 179.97 180.04 1lrn h SER 2169N 0.00 0.72 0.48 7.04 4.64 -1.68 -3.04 113.55 121.71 1lrn h SER 2169Ca -0.00 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 1lrn h SER 2169Cb 0.47 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 1lrn h SER 2169CO 0.02 0.58 -0.51 -0.07 -0.87 0.00 0.00 176.83 175.99 1lrn h LEU 2170N 0.82 -1.40 -1.71 5.97 4.07 -1.75 0.12 115.31 121.43 1lrn h LEU 2170Ca 0.21 0.11 -0.03 0.00 0.08 0.00 0.00 57.88 58.25 1lrn h LEU 2170Cb 0.02 0.46 -0.00 0.00 1.08 0.00 0.00 40.66 42.22 1lrn h LEU 2170CO -0.03 -0.66 -0.15 1.55 -1.08 0.00 0.00 178.44 178.07 1lrn h PRO 2171N -0.99 0.00 -0.08 1.13 0.13 -1.75 -2.02 132.00 128.42 1lrn h PRO 2171Ca -0.06 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.04 1lrn h PRO 2171Cb 0.86 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.99 1lrn h PRO 2171CO -0.08 0.15 -0.06 0.82 -0.23 0.00 0.00 178.00 178.60 1lrn h ILE 2172N 0.00 1.35 0.00 -3.56 2.04 -1.35 -3.23 117.51 112.76 1lrn h ILE 2172Ca -0.00 -1.15 -0.06 0.00 1.00 0.00 0.00 64.86 64.65 1lrn h ILE 2172Cb 0.27 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1lrn h ILE 2172CO 0.02 0.32 -0.29 0.24 0.00 0.00 0.00 178.15 178.44 1lrn h MET 2173N -0.22 0.00 0.00 2.37 2.86 -0.59 -2.92 114.93 116.43 1lrn h MET 2173Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1lrn h MET 2173Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1lrn h MET 2173CO 0.02 0.29 0.00 1.17 1.06 0.00 0.00 176.91 179.45 1lrn n LYS 2174N -3.71 0.10 0.22 1.72 3.00 -0.78 -2.18 118.16 116.54 1lrn n LYS 2174Ca -0.01 0.48 0.09 0.00 -0.00 0.00 0.00 58.31 58.87 1lrn n LYS 2174Cb 0.40 -1.76 0.49 0.00 0.00 0.00 0.00 35.03 34.16 1lrn n LYS 2174CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 1lrn h GLN 2175N 0.00 0.00 0.00 1.64 4.20 -1.63 -3.34 115.11 115.98 1lrn h GLN 2175Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1lrn h GLN 2175Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1lrn h GLN 2175CO 0.00 0.25 0.00 -2.67 -0.67 0.00 0.00 178.83 175.74 1lrn n TRP 2176N -3.57 0.00 -3.56 2.96 2.14 -0.93 -5.11 117.44 109.38 1lrn n TRP 2176Ca -0.01 -0.10 -0.06 0.00 2.07 0.00 0.00 57.50 59.40 1lrn n TRP 2176Cb 0.39 -0.01 -0.02 0.00 -0.81 0.00 0.00 31.31 30.86 1lrn n TRP 2176CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1lrn s ALA 2177N -0.19 -1.90 0.28 -1.67 0.00 -0.99 -4.99 121.76 112.29 1lrn s ALA 2177Ca 0.00 1.09 -0.29 0.00 0.00 0.00 0.00 51.96 52.75 1lrn s ALA 2177Cb 0.00 0.28 -0.09 0.00 0.00 0.00 0.00 23.12 23.30 1lrn s ALA 2177CO 0.00 -0.71 1.13 0.15 0.00 0.00 0.00 175.76 176.33 1lrn s LYS 2178N -2.89 4.59 -0.14 0.00 1.02 -1.16 -3.95 119.74 117.21 1lrn s LYS 2178Ca 0.07 1.86 -0.03 0.00 0.02 0.00 0.00 55.97 57.89 1lrn s LYS 2178Cb -0.01 -3.18 -0.03 0.00 -0.52 0.00 0.00 37.83 34.09 1lrn s LYS 2178CO -0.06 0.13 -0.03 0.08 -0.92 0.00 0.00 175.35 174.55 1lrn s VAL 2179N -1.05 3.96 0.03 3.17 1.01 -1.26 -1.14 120.40 125.12 1lrn s VAL 2179Ca 0.46 -0.34 0.06 0.00 0.00 0.00 0.00 61.98 62.16 1lrn s VAL 2179Cb -0.33 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.29 1lrn s VAL 2179CO 0.42 0.51 -0.16 -0.63 0.00 0.00 0.00 175.10 175.24 1lrn s ILE 2180N 0.17 2.92 -0.22 2.22 -1.09 -0.21 0.27 121.20 125.25 1lrn s ILE 2180Ca -0.01 -1.11 -0.05 0.00 -2.23 0.00 0.00 60.65 57.25 1lrn s ILE 2180Cb -0.14 -2.23 -0.02 0.00 -1.58 0.00 0.00 42.46 38.49 1lrn s ILE 2180CO 0.03 0.35 0.00 -0.47 -1.23 0.00 0.00 174.94 173.62 1lrn s TYR 2181N -0.93 3.01 -0.73 3.97 5.04 -0.00 -0.75 117.35 126.96 1lrn s TYR 2181Ca 0.15 -0.67 -0.24 0.00 -2.44 0.00 0.00 57.07 53.87 1lrn s TYR 2181Cb -0.11 -2.14 0.06 0.00 0.35 0.00 0.00 41.96 40.12 1lrn s TYR 2181CO 0.05 -0.42 1.14 0.34 -1.34 0.00 0.00 175.55 175.33 1lrn s ASP 2182N 1.41 6.22 0.46 4.32 -1.08 0.20 0.14 116.67 128.34 1lrn s ASP 2182Ca 0.05 -0.86 0.26 0.00 -0.52 0.00 0.00 52.55 51.48 1lrn s ASP 2182Cb -0.15 -2.49 0.96 0.00 -1.46 0.00 0.00 42.92 39.79 1lrn s ASP 2182CO 0.00 -1.59 1.84 0.00 0.52 0.00 0.00 175.17 175.94 1lrn h ALA 2183N 9.74 1.00 0.00 3.66 0.00 -1.16 -2.84 119.26 129.65 1lrn h ALA 2183Ca -0.22 -0.14 -0.36 0.00 0.00 0.00 0.00 54.91 54.18 1lrn h ALA 2183Cb 1.05 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 1lrn h ALA 2183CO 1.24 0.19 -2.36 0.25 0.00 0.00 0.00 179.25 178.57 1lrn n THR 2184N -3.28 1.36 0.13 0.00 -2.24 -1.25 -4.39 114.28 104.62 1lrn n THR 2184Ca 0.01 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1lrn n THR 2184Cb 0.42 -0.54 0.10 0.00 -2.10 0.00 0.00 70.33 68.20 1lrn n THR 2184CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1lrn h GLY 2185N 3.75 0.00 2.00 3.38 0.00 -1.88 -3.27 103.07 107.05 1lrn h GLY 2185Ca -0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1lrn h GLY 2185CO 0.02 0.00 0.00 1.76 0.00 0.00 0.00 176.54 178.32 1lrn h SER 2186N 0.00 0.00 -0.02 0.19 0.02 -1.59 -3.07 113.55 109.08 1lrn h SER 2186Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1lrn h SER 2186Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 1lrn h SER 2186CO 0.08 0.00 -0.07 1.33 -1.14 0.00 0.00 176.83 177.02 1lrn n VAL 2187N -2.69 0.00 -2.07 2.27 0.24 -1.23 -4.73 118.33 110.11 1lrn n VAL 2187Ca 0.02 -0.46 -0.33 0.00 -2.04 0.00 0.00 64.34 61.53 1lrn n VAL 2187Cb 0.30 1.32 0.01 0.00 -1.47 0.00 0.00 33.84 34.00 1lrn n VAL 2187CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lrn s GLN 2188N -1.52 3.38 -0.38 7.34 -2.07 -1.16 -2.47 119.66 122.77 1lrn s GLN 2188Ca 0.18 1.17 -0.05 0.00 -1.82 0.00 0.00 55.36 54.85 1lrn s GLN 2188Cb 0.14 -2.04 0.08 0.00 -1.09 0.00 0.00 33.01 30.09 1lrn s GLN 2188CO 0.25 -0.76 0.17 -0.51 -1.32 0.00 0.00 175.29 173.12 1lrn s LEU 2189N -4.47 4.82 0.00 2.60 1.43 -1.26 -4.34 118.68 117.46 1lrn s LEU 2189Ca 0.63 -1.59 0.00 0.00 -1.03 0.00 0.00 54.13 52.14 1lrn s LEU 2189Cb -0.15 -1.86 0.00 0.00 0.03 0.00 0.00 46.19 44.21 1lrn s LEU 2189CO 0.37 -0.46 0.00 -2.65 0.23 0.00 0.00 176.35 173.84 1lrn n PRO 2190N 4.73 0.00 -3.84 1.29 -0.02 -1.26 -4.90 135.00 131.01 1lrn n PRO 2190Ca -0.08 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.33 1lrn n PRO 2190Cb 0.43 -0.78 -0.02 0.00 -0.02 0.00 0.00 33.50 33.11 1lrn n PRO 2190CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1lrn s GLY 2199N 0.50 -0.12 -0.39 -1.23 0.00 -1.26 -4.28 107.32 100.53 1lrn s GLY 2199Ca 0.00 -0.22 -0.14 0.00 0.00 0.00 0.00 44.72 44.36 1lrn s GLY 2199CO 0.00 -0.07 0.28 1.06 0.00 0.00 0.00 173.10 174.37 1lrn s MET 2200N -3.80 3.02 0.50 2.90 -1.94 -1.03 -4.69 119.30 114.27 1lrn s MET 2200Ca 0.11 -0.97 0.22 0.00 -1.71 0.00 0.00 55.69 53.34 1lrn s MET 2200Cb -0.05 -3.91 1.33 0.00 2.01 0.00 0.00 34.83 34.21 1lrn s MET 2200CO 0.06 -0.70 2.07 -0.09 -0.01 0.00 0.00 175.02 176.36 1lrn h ARG 2201N 8.58 0.00 0.00 2.03 2.43 -1.90 -2.50 114.38 123.02 1lrn h ARG 2201Ca -0.27 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1lrn h ARG 2201Cb 1.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1lrn h ARG 2201CO 0.71 0.12 0.00 1.05 -1.51 0.00 0.00 179.97 180.34 1lrn h GLU 2202N 0.00 0.00 -0.02 0.20 4.11 -1.94 -1.78 114.58 115.15 1lrn h GLU 2202Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1lrn h GLU 2202Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1lrn h GLU 2202CO 0.02 0.00 -0.33 1.19 0.07 0.00 0.00 179.01 179.96 1lrn n PHE 2203N -2.93 0.00 0.29 2.06 3.72 -0.94 -4.54 117.46 115.12 1lrn n PHE 2203Ca -0.02 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.21 1lrn n PHE 2203Cb 0.08 -0.01 -0.08 0.00 -0.94 0.00 0.00 39.48 38.52 1lrn n PHE 2203CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1lrn h ILE 2204N 2.81 0.48 -0.24 4.37 2.04 -1.45 -2.65 117.51 122.88 1lrn h ILE 2204Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 1lrn h ILE 2204Cb 0.77 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1lrn h ILE 2204CO 0.00 0.00 0.04 0.15 0.00 0.00 0.00 178.15 178.34 1lrn h PHE 2205N -0.70 0.41 -0.49 1.37 -0.00 -1.80 -1.71 116.94 114.02 1lrn h PHE 2205Ca -0.07 -0.06 0.07 0.00 -0.00 0.00 0.00 57.97 57.92 1lrn h PHE 2205Cb 0.54 -0.11 -0.06 0.00 -0.00 0.00 0.00 35.95 36.32 1lrn h PHE 2205CO -0.05 0.51 0.15 -1.35 -0.00 0.00 0.00 178.31 177.57 1lrn h PRO 2206N 0.20 0.30 0.00 6.41 0.11 -1.80 -1.18 132.00 136.03 1lrn h PRO 2206Ca 0.07 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 66.06 1lrn h PRO 2206Cb 0.32 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 1lrn h PRO 2206CO 0.00 0.20 -0.51 -0.07 -0.21 0.00 0.00 178.00 177.41 1lrn h LEU 2207N 0.31 0.00 -0.57 2.35 3.38 -1.43 -2.38 115.31 116.97 1lrn h LEU 2207Ca 0.24 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.05 1lrn h LEU 2207Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1lrn h LEU 2207CO -0.27 0.51 -0.55 -0.29 0.09 0.00 0.00 178.44 177.93 1lrn h ILE 2208N 0.00 1.33 -0.77 1.22 2.10 -0.90 -1.45 117.51 119.04 1lrn h ILE 2208Ca -0.01 -1.82 -0.05 0.00 1.08 0.00 0.00 64.86 64.07 1lrn h ILE 2208Cb 1.12 1.81 -0.03 0.00 -1.09 0.00 0.00 36.82 38.63 1lrn h ILE 2208CO 0.07 0.56 0.30 0.03 -1.08 0.00 0.00 178.15 178.02 1lrn h ARG 2209N 0.37 1.16 -0.70 2.19 3.08 -0.97 -2.42 114.38 117.08 1lrn h ARG 2209Ca 0.01 -0.21 -0.07 0.00 0.07 0.00 0.00 59.98 59.77 1lrn h ARG 2209Cb 1.08 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 1lrn h ARG 2209CO 0.10 0.94 0.16 0.00 -1.07 0.00 0.00 179.97 180.10 1lrn h ALA 2210N 1.20 0.94 -0.59 0.04 0.00 -1.12 -2.05 119.26 117.67 1lrn h ALA 2210Ca 0.26 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1lrn h ALA 2210Cb 0.22 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1lrn h ALA 2210CO -0.02 0.67 0.38 0.00 0.00 0.00 0.00 179.25 180.28 1lrn h ALA 2211N 1.09 0.76 0.00 0.00 0.00 -0.79 -0.70 119.26 119.61 1lrn h ALA 2211Ca 0.22 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1lrn h ALA 2211Cb 0.39 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1lrn h ALA 2211CO 0.01 0.15 -0.48 -0.39 0.00 0.00 0.00 179.25 178.53 1lrn h VAL 2212N 0.76 0.90 -0.09 0.00 -1.51 -1.37 0.79 116.25 115.74 1lrn h VAL 2212Ca 0.23 -2.03 -0.17 0.00 -1.23 0.00 0.00 66.70 63.51 1lrn h VAL 2212Cb -0.05 2.27 -0.01 0.00 -2.13 0.00 0.00 31.29 31.38 1lrn h VAL 2212CO -0.07 0.47 -0.65 0.00 -1.23 0.00 0.00 177.57 176.09 1lrn h ALA 2213N 1.52 0.71 -0.02 5.19 0.00 -1.02 -3.16 119.26 122.48 1lrn h ALA 2213Ca -0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 54.91 54.25 1lrn h ALA 2213Cb 1.23 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.95 1lrn h ALA 2213CO 0.06 0.74 -0.34 0.28 0.00 0.00 0.00 179.25 180.00 1lrn h VAL 2214N 0.25 1.49 0.00 0.00 2.07 -1.01 -3.47 116.25 115.58 1lrn h VAL 2214Ca -0.01 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1lrn h VAL 2214Cb 1.20 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.57 1lrn h VAL 2214CO 0.11 0.53 0.00 0.61 0.02 0.00 0.00 177.57 178.84 1lrn n GLY 2215N 0.94 2.60 3.29 2.17 0.00 0.26 -4.81 105.19 109.64 1lrn n GLY 2215Ca -0.09 -0.96 -0.11 0.00 0.00 0.00 0.00 46.02 44.86 1lrn n GLY 2215CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lrn n ASP 2217N -0.28 2.07 0.00 0.00 8.00 0.14 -4.99 116.55 121.49 1lrn n ASP 2217Ca 0.00 -1.60 0.00 0.00 0.71 0.00 0.00 54.79 53.90 1lrn n ASP 2217Cb 0.65 0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.84 1lrn n ASP 2217CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lrn n GLY 2218N 1.30 1.09 3.39 0.44 0.00 -1.09 -1.80 105.19 108.52 1lrn n GLY 2218Ca 0.15 -0.82 -0.26 0.00 0.00 0.00 0.00 46.02 45.09 1lrn n GLY 2218CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lrn s VAL 2219N -2.00 2.19 -0.09 1.61 1.01 -0.45 -0.82 120.40 121.84 1lrn s VAL 2219Ca 0.00 -1.95 0.02 0.00 0.00 0.00 0.00 61.98 60.05 1lrn s VAL 2219Cb 0.00 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.38 1lrn s VAL 2219CO 0.00 -0.13 -0.13 0.12 0.00 0.00 0.00 175.10 174.96 1lrn s PHE 2220N -1.66 1.66 -0.05 5.22 2.19 0.12 -1.36 117.98 124.10 1lrn s PHE 2220Ca 0.18 -0.71 -0.03 0.00 0.33 0.00 0.00 56.93 56.69 1lrn s PHE 2220Cb -0.08 -1.23 0.03 0.00 -1.31 0.00 0.00 43.02 40.43 1lrn s PHE 2220CO 0.08 -0.39 0.13 -1.64 1.83 0.00 0.00 175.22 175.23 1lrn s MET 2221N 0.95 0.11 -0.26 10.12 -1.94 0.05 -0.62 119.30 127.71 1lrn s MET 2221Ca -0.09 0.26 -0.17 0.00 -1.71 0.00 0.00 55.69 53.99 1lrn s MET 2221Cb -0.15 -0.07 -0.03 0.00 2.01 0.00 0.00 34.83 36.59 1lrn s MET 2221CO -0.00 -0.09 0.45 -1.21 -0.01 0.00 0.00 175.02 174.16 1lrn s GLU 2222N 0.63 4.07 0.02 2.03 2.02 -1.26 -2.72 118.70 123.49 1lrn s GLU 2222Ca -0.05 0.21 0.07 0.00 0.02 0.00 0.00 54.97 55.22 1lrn s GLU 2222Cb -0.06 -3.64 -0.02 0.00 0.10 0.00 0.00 34.13 30.51 1lrn s GLU 2222CO -0.03 -0.28 -0.20 -0.08 0.02 0.00 0.00 175.26 174.69 1lrn s THR 2223N 2.09 1.61 -0.10 3.63 -1.32 0.54 -0.23 115.64 121.86 1lrn s THR 2223Ca 0.19 -1.05 -0.09 0.00 -1.21 0.00 0.00 61.69 59.52 1lrn s THR 2223Cb -0.16 -1.38 0.03 0.00 -1.51 0.00 0.00 72.50 69.48 1lrn s THR 2223CO 0.09 0.29 0.27 -2.28 -2.21 0.00 0.00 174.62 170.78 1lrn s HIS 2224N -0.67 -0.28 0.26 9.09 5.04 -0.53 -2.00 115.29 126.19 1lrn s HIS 2224Ca 0.07 0.69 -0.02 0.00 -1.54 0.00 0.00 55.06 54.26 1lrn s HIS 2224Cb -0.08 0.10 0.53 0.00 0.04 0.00 0.00 32.58 33.16 1lrn s HIS 2224CO 0.01 -0.15 1.72 -1.35 -2.34 0.00 0.00 174.74 172.62 1lrn h PRO 2225N 5.64 0.41 -2.51 2.88 0.11 -1.94 -2.52 132.00 134.06 1lrn h PRO 2225Ca -0.26 -0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.23 1lrn h PRO 2225Cb 1.19 -0.09 -0.39 0.00 0.11 0.00 0.00 31.00 31.82 1lrn h PRO 2225CO 0.34 0.27 -0.87 0.39 -0.21 0.00 0.00 178.00 177.92 1lrn n GLU 2226N -5.03 0.76 -0.32 1.05 1.02 -1.26 -4.44 120.64 112.41 1lrn n GLU 2226Ca 0.16 -3.58 0.21 0.00 -0.02 0.00 0.00 57.16 53.93 1lrn n GLU 2226Cb 0.48 -1.81 0.42 0.00 -0.02 0.00 0.00 31.44 30.51 1lrn n GLU 2226CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1lrn h PRO 2227N 5.36 0.17 -0.04 3.49 0.11 -1.85 0.52 132.00 139.75 1lrn h PRO 2227Ca 0.22 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.33 1lrn h PRO 2227Cb 0.86 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.93 1lrn h PRO 2227CO 0.49 0.11 0.06 1.05 -0.21 0.00 0.00 178.00 179.49 1lrn h GLU 2228N 0.17 0.00 -0.01 1.05 4.11 -1.93 -0.42 114.58 117.55 1lrn h GLU 2228Ca 0.69 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.12 1lrn h GLU 2228Cb 1.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.83 1lrn h GLU 2228CO -0.70 0.00 -0.80 1.63 0.07 0.00 0.00 179.01 179.21 1lrn n LYS 2229N -3.70 0.40 -1.69 1.06 5.02 0.18 -4.98 118.16 114.44 1lrn n LYS 2229Ca -0.02 -0.33 -0.38 0.00 -2.02 0.00 0.00 58.31 55.56 1lrn n LYS 2229Cb 0.14 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.71 1lrn n LYS 2229CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lrn n ALA 2230N -1.02 0.99 1.27 7.82 0.00 -0.17 -4.90 120.51 124.50 1lrn n ALA 2230Ca 0.06 0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.70 1lrn n ALA 2230Cb 0.37 -2.26 0.53 0.00 0.00 0.00 0.00 19.45 18.09 1lrn n ALA 2230CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1lrn n LEU 2231N -1.05 0.49 -3.91 0.00 4.77 -1.26 -4.54 117.00 111.50 1lrn n LEU 2231Ca 0.13 0.03 -0.10 0.00 -0.03 0.00 0.00 56.01 56.03 1lrn n LEU 2231Cb 0.46 -0.22 -0.11 0.00 -2.33 0.00 0.00 43.42 41.22 1lrn n LEU 2231CO 0.51 0.10 -0.26 -0.44 -1.33 0.00 0.00 177.39 175.97 1lrn s SER 2232N -2.62 0.10 -1.13 -1.43 0.01 -1.26 -4.59 113.70 102.77 1lrn s SER 2232Ca 0.24 -0.29 -0.04 0.00 1.31 0.00 0.00 55.95 57.17 1lrn s SER 2232Cb 0.19 0.16 0.01 0.00 0.21 0.00 0.00 66.02 66.59 1lrn s SER 2232CO 0.52 -0.31 0.08 0.47 0.41 0.00 0.00 173.24 174.41 1lrn n ASP 2233N 1.67 0.16 0.27 2.44 8.00 -1.26 -4.78 116.55 123.06 1lrn n ASP 2233Ca -0.22 -0.97 0.18 0.00 0.71 0.00 0.00 54.79 54.48 1lrn n ASP 2233Cb 0.56 -1.20 0.77 0.00 -0.02 0.00 0.00 41.12 41.23 1lrn n ASP 2233CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lrn h ALA 2234N 1.23 1.00 0.00 2.24 0.00 -1.80 -1.79 119.26 120.14 1lrn h ALA 2234Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1lrn h ALA 2234Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1lrn h ALA 2234CO 0.52 0.00 -0.76 0.43 0.00 0.00 0.00 179.25 179.44 1lrn n SER 2235N -2.98 0.63 0.00 0.00 7.64 -1.26 -3.91 113.62 113.75 1lrn n SER 2235Ca -0.00 -0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.78 1lrn n SER 2235Cb 0.24 0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 1lrn n SER 2235CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1lrn n THR 2236N -1.92 0.00 -2.22 0.44 -2.24 -1.06 -4.10 114.28 103.17 1lrn n THR 2236Ca 0.03 -0.43 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 1lrn n THR 2236Cb 0.42 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.61 1lrn n THR 2236CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1lrn s GLN 2237N -0.87 4.43 0.07 -0.78 -0.21 -0.70 -4.78 119.66 116.82 1lrn s GLN 2237Ca 0.00 2.09 -0.29 0.00 0.02 0.00 0.00 55.36 57.18 1lrn s GLN 2237Cb 0.00 -3.12 -0.05 0.00 1.00 0.00 0.00 33.01 30.84 1lrn s GLN 2237CO 0.00 -0.10 0.92 -1.17 -2.12 0.00 0.00 175.29 172.82 1lrn s LEU 2238N -1.44 4.45 0.13 2.90 2.96 0.68 -4.76 118.68 123.61 1lrn s LEU 2238Ca 0.49 1.68 -0.31 0.00 -0.22 0.00 0.00 54.13 55.77 1lrn s LEU 2238Cb -0.37 -3.51 -0.10 0.00 0.50 0.00 0.00 46.19 42.71 1lrn s LEU 2238CO 0.48 -0.10 1.71 -2.84 -1.32 0.00 0.00 176.35 174.28 1lrn s PRO 2239N 0.25 4.17 0.33 0.98 0.02 -1.26 -1.45 135.00 138.04 1lrn s PRO 2239Ca 0.46 2.48 0.12 0.00 0.02 0.00 0.00 61.00 64.08 1lrn s PRO 2239Cb -0.22 -3.42 0.99 0.00 0.02 0.00 0.00 34.50 31.87 1lrn s PRO 2239CO 0.28 -0.75 1.68 1.25 -0.33 0.00 0.00 177.00 179.13 1lrn h LEU 2240N 7.95 0.53 -2.53 -5.54 6.46 -1.66 0.73 115.31 121.25 1lrn h LEU 2240Ca -0.44 0.17 -0.00 0.00 -0.12 0.00 0.00 57.88 57.49 1lrn h LEU 2240Cb 1.21 0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 41.25 1lrn h LEU 2240CO 0.94 -0.05 -0.01 0.77 -0.62 0.00 0.00 178.44 179.47 1lrn h SER 2241N 0.41 0.00 0.48 1.25 4.64 -1.89 -2.44 113.55 116.00 1lrn h SER 2241Ca 0.69 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.01 1lrn h SER 2241Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1lrn h SER 2241CO -0.56 0.01 -0.58 0.00 -0.87 0.00 0.00 176.83 174.83 1lrn n GLN 2242N -3.14 0.04 0.02 4.77 6.02 0.25 -4.47 117.38 120.86 1lrn n GLN 2242Ca -0.02 0.01 -0.11 0.00 -0.01 0.00 0.00 57.00 56.87 1lrn n GLN 2242Cb 0.14 -1.52 -0.05 0.00 1.02 0.00 0.00 30.24 29.83 1lrn n GLN 2242CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1lrn h LEU 2243N 0.00 -0.13 -0.33 1.08 5.85 -1.48 -2.57 115.31 117.72 1lrn h LEU 2243Ca 0.00 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1lrn h LEU 2243Cb 0.53 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1lrn h LEU 2243CO 0.00 -0.06 0.04 -0.08 -0.34 0.00 0.00 178.44 178.00 1lrn h GLU 2244N -0.04 0.14 -0.78 1.25 4.81 -1.79 -0.27 114.58 117.90 1lrn h GLU 2244Ca 0.04 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1lrn h GLU 2244Cb 0.10 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.40 1lrn h GLU 2244CO -0.09 0.09 0.48 0.78 -0.73 0.00 0.00 179.01 179.55 1lrn h GLY 2245N 0.15 1.14 1.19 1.92 0.00 -1.81 -0.51 103.07 105.15 1lrn h GLY 2245Ca 0.16 -0.36 -0.14 0.00 0.00 0.00 0.00 47.33 46.99 1lrn h GLY 2245CO -0.23 0.28 -0.29 -2.22 0.00 0.00 0.00 176.54 174.08 1lrn h ILE 2246N 0.92 1.27 -0.38 2.60 2.04 -1.01 -1.90 117.51 121.04 1lrn h ILE 2246Ca 0.32 -1.45 -0.03 0.00 1.00 0.00 0.00 64.86 64.70 1lrn h ILE 2246Cb 0.08 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1lrn h ILE 2246CO -0.14 0.49 0.14 0.40 0.00 0.00 0.00 178.15 179.04 1lrn h ILE 2247N 0.77 1.20 -0.58 -0.67 2.04 -0.59 -0.55 117.51 119.12 1lrn h ILE 2247Ca 0.09 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.32 1lrn h ILE 2247Cb 0.86 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 1lrn h ILE 2247CO 0.08 0.23 0.36 -0.08 0.00 0.00 0.00 178.15 178.74 1lrn h GLU 2248N 0.48 0.70 -0.29 2.37 4.57 -1.03 -1.46 114.58 119.92 1lrn h GLU 2248Ca 0.13 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1lrn h GLU 2248Cb 0.22 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 1lrn h GLU 2248CO -0.01 0.46 0.18 0.00 -1.18 0.00 0.00 179.01 178.46 1lrn h ALA 2249N 1.25 0.37 0.00 2.92 0.00 -1.02 -1.94 119.26 120.83 1lrn h ALA 2249Ca 0.23 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 1lrn h ALA 2249Cb -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1lrn h ALA 2249CO -0.09 -0.14 -0.40 -0.84 0.00 0.00 0.00 179.25 177.79 1lrn h ILE 2250N 0.37 0.99 -0.24 0.00 3.07 -0.84 -1.70 117.51 119.17 1lrn h ILE 2250Ca 0.10 -1.52 -0.19 0.00 1.55 0.00 0.00 64.86 64.80 1lrn h ILE 2250Cb -0.00 1.90 0.00 0.00 -0.27 0.00 0.00 36.82 38.45 1lrn h ILE 2250CO -0.02 0.39 -0.61 -0.07 -1.05 0.00 0.00 178.15 176.79 1lrn h LEU 2251N 0.00 0.90 -0.30 0.16 3.38 -1.06 0.16 115.31 118.54 1lrn h LEU 2251Ca -0.00 -0.51 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 1lrn h LEU 2251Cb 0.87 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1lrn h LEU 2251CO 0.05 1.29 0.11 -0.33 0.09 0.00 0.00 178.44 179.66 1lrn h GLU 2252N 0.59 0.46 -0.45 1.13 5.08 -1.15 0.23 114.58 120.48 1lrn h GLU 2252Ca -0.00 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 1lrn h GLU 2252Cb 1.21 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1lrn h GLU 2252CO 0.13 0.49 0.13 0.82 -1.00 0.00 0.00 179.01 179.58 1lrn h ILE 2253N 0.34 1.23 -0.56 3.13 2.04 -1.27 -2.67 117.51 119.74 1lrn h ILE 2253Ca 0.10 -0.76 0.04 0.00 1.00 0.00 0.00 64.86 65.24 1lrn h ILE 2253Cb 0.21 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 1lrn h ILE 2253CO -0.01 0.27 0.30 -0.09 0.00 0.00 0.00 178.15 178.63 1lrn h ARG 2254N 0.59 0.57 -0.47 2.37 2.43 -0.80 0.15 114.38 119.22 1lrn h ARG 2254Ca 0.14 -0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.36 1lrn h ARG 2254Cb 0.28 -0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 29.64 1lrn h ARG 2254CO -0.00 0.38 0.05 1.49 -1.51 0.00 0.00 179.97 180.38 1lrn h GLU 2255N 0.59 0.17 0.01 0.20 4.22 -0.62 0.35 114.58 119.50 1lrn h GLU 2255Ca 0.24 -0.01 -0.19 0.00 0.08 0.00 0.00 59.36 59.48 1lrn h GLU 2255Cb 0.11 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 29.34 1lrn h GLU 2255CO -0.15 0.11 -0.75 0.28 -2.18 0.00 0.00 179.01 176.33 1lrn h VAL 2256N 0.18 1.39 -0.12 0.32 2.07 -1.20 -3.37 116.25 115.53 1lrn h VAL 2256Ca 0.23 -2.16 -0.18 0.00 0.82 0.00 0.00 66.70 65.42 1lrn h VAL 2256Cb 0.32 2.58 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1lrn h VAL 2256CO -0.34 0.64 -0.67 0.00 0.02 0.00 0.00 177.57 177.22 1lrn h ALA 2257N 0.33 0.63 -0.85 1.67 0.00 -0.42 -3.24 119.26 117.37 1lrn h ALA 2257Ca -0.10 -0.57 0.25 0.00 0.00 0.00 0.00 54.91 54.49 1lrn h ALA 2257Cb 1.45 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 1lrn h ALA 2257CO 0.15 0.73 0.78 0.66 0.00 0.00 0.00 179.25 181.57 1lrn h SER 2258N 0.33 0.00 -0.20 0.00 4.64 -0.45 0.44 113.55 118.31 1lrn h SER 2258Ca -0.02 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.36 1lrn h SER 2258Cb 1.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 1lrn h SER 2258CO 0.12 0.00 0.14 0.50 -0.87 0.00 0.00 176.83 176.72 1lrn h LYS 2259N 0.00 0.01 -0.27 4.77 3.64 -1.77 -2.71 116.57 120.24 1lrn h LYS 2259Ca 0.40 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 1lrn h LYS 2259Cb 1.96 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.78 1lrn h LYS 2259CO -0.00 0.01 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 1lrn n TYR 2260N -4.48 0.34 -1.74 1.91 4.02 0.15 -4.98 117.16 112.39 1lrn n TYR 2260Ca 0.02 -0.21 -0.42 0.00 -0.01 0.00 0.00 57.90 57.28 1lrn n TYR 2260Cb 0.28 -0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.57 1lrn n TYR 2260CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1lrn s TYR 2261N -1.36 2.86 0.51 -0.72 2.02 -1.02 -4.93 117.35 114.71 1lrn s TYR 2261Ca 0.30 0.46 -0.21 0.00 -0.37 0.00 0.00 57.07 57.25 1lrn s TYR 2261Cb 0.18 -4.13 -0.06 0.00 -0.40 0.00 0.00 41.96 37.56 1lrn s TYR 2261CO 0.26 -4.14 1.20 -1.21 -1.57 0.00 0.00 175.55 170.09 1lrn s GLU 2262N 0.70 3.45 -0.08 -0.62 8.01 -1.26 -4.93 118.70 123.97 1lrn s GLU 2262Ca 0.72 1.84 -0.29 0.00 0.01 0.00 0.00 54.97 57.24 1lrn s GLU 2262Cb -0.49 -2.23 -0.06 0.00 -4.31 0.00 0.00 34.13 27.03 1lrn s GLU 2262CO 0.37 -0.83 1.81 0.99 0.01 0.00 0.00 175.26 177.61 1lrn s THR 2263N -1.54 3.36 0.00 3.63 2.01 -1.26 -5.16 115.64 116.68 1lrn s THR 2263Ca 0.69 0.42 0.00 0.00 0.31 0.00 0.00 61.69 63.11 1lrn s THR 2263Cb -0.30 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 68.89 1lrn s THR 2263CO 0.36 -0.08 0.00 0.00 -0.69 0.00 0.00 174.62 174.20