#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fq8 s LYS 2008N 0.00 3.84 -0.06 -4.13 0.00 -1.26 -4.95 119.74 113.18 3fq8 s LYS 2008Ca 0.00 -0.08 0.12 0.00 0.00 0.00 0.00 55.97 56.01 3fq8 s LYS 2008Cb 0.00 -3.30 0.23 0.00 0.00 0.00 0.00 37.83 34.76 3fq8 s LYS 2008CO 0.00 0.54 1.11 0.25 0.00 0.00 0.00 175.35 177.24 3fq8 n THR 2009N 2.69 0.74 -0.09 3.79 -2.24 -1.26 -4.85 114.28 113.06 3fq8 n THR 2009Ca -0.17 -1.21 -0.06 0.00 -2.27 0.00 0.00 64.05 60.34 3fq8 n THR 2009Cb 0.53 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 3fq8 n THR 2009CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3fq8 h ILE 2010N 4.57 0.72 -0.61 2.28 1.08 -1.98 -0.41 117.51 123.15 3fq8 h ILE 2010Ca -0.05 -0.01 -0.00 0.00 -0.39 0.00 0.00 64.86 64.40 3fq8 h ILE 2010Cb 1.37 0.68 -0.03 0.00 -3.07 0.00 0.00 36.82 35.77 3fq8 h ILE 2010CO 0.02 0.01 0.37 0.11 -0.69 0.00 0.00 178.15 177.97 3fq8 h LYS 2011N 0.04 0.83 0.13 2.37 1.79 -1.90 -1.57 116.57 118.26 3fq8 h LYS 2011Ca 0.15 -0.08 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 3fq8 h LYS 2011Cb 0.22 -0.17 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 3fq8 h LYS 2011CO -0.30 0.60 -0.06 0.77 -1.08 0.00 0.00 179.45 179.38 3fq8 h SER 2012N 0.83 -0.15 -0.97 0.86 0.02 -1.77 -1.54 113.55 110.84 3fq8 h SER 2012Ca 0.22 -0.06 0.11 0.00 -0.84 0.00 0.00 61.79 61.22 3fq8 h SER 2012Cb -0.02 0.04 -0.08 0.00 0.14 0.00 0.00 62.40 62.48 3fq8 h SER 2012CO -0.04 -0.04 0.60 0.44 -1.14 0.00 0.00 176.83 176.65 3fq8 h ASP 2013N -0.24 0.89 0.40 3.07 3.32 -0.93 0.13 116.42 123.05 3fq8 h ASP 2013Ca -0.02 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 3fq8 h ASP 2013Cb 0.19 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3fq8 h ASP 2013CO 0.03 0.50 -0.19 -0.08 -1.72 0.00 0.00 179.24 177.78 3fq8 h GLU 2014N 0.98 -0.51 -0.83 3.56 4.81 -1.06 -0.07 114.58 121.46 3fq8 h GLU 2014Ca 0.47 0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.70 3fq8 h GLU 2014Cb 0.41 0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.87 3fq8 h GLU 2014CO -0.25 -0.26 0.39 0.82 -0.73 0.00 0.00 179.01 178.98 3fq8 h ILE 2015N -0.69 1.26 -0.45 2.32 2.04 -0.90 -1.96 117.51 119.13 3fq8 h ILE 2015Ca -0.05 -0.74 -0.10 0.00 1.00 0.00 0.00 64.86 64.97 3fq8 h ILE 2015Cb 0.49 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 3fq8 h ILE 2015CO 0.09 0.32 -0.10 0.15 0.00 0.00 0.00 178.15 178.61 3fq8 h PHE 2016N 1.18 0.97 -0.65 1.37 3.57 -0.72 -0.54 116.94 122.12 3fq8 h PHE 2016Ca 0.28 -0.20 0.01 0.00 3.53 0.00 0.00 57.97 61.59 3fq8 h PHE 2016Cb 0.14 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 3fq8 h PHE 2016CO 0.02 0.96 0.42 0.00 -2.23 0.00 0.00 178.31 177.48 3fq8 h ALA 2017N 0.88 0.83 -0.49 2.41 0.00 -0.78 -1.67 119.26 120.44 3fq8 h ALA 2017Ca 0.12 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3fq8 h ALA 2017Cb 0.63 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3fq8 h ALA 2017CO 0.04 0.23 -0.02 0.00 0.00 0.00 0.00 179.25 179.50 3fq8 h ALA 2018N 1.25 1.05 -0.87 0.00 0.00 -1.18 -3.04 119.26 116.47 3fq8 h ALA 2018Ca 0.24 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3fq8 h ALA 2018Cb -0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 3fq8 h ALA 2018CO -0.06 0.59 0.50 0.00 0.00 0.00 0.00 179.25 180.28 3fq8 h ALA 2019N 1.21 1.25 0.00 0.00 0.00 -0.28 -2.34 119.26 119.10 3fq8 h ALA 2019Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3fq8 h ALA 2019Cb 0.49 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3fq8 h ALA 2019CO 0.02 0.63 0.00 1.96 0.00 0.00 0.00 179.25 181.86 3fq8 h GLN 2020N 1.20 0.00 -0.00 0.00 4.20 -1.21 0.14 115.11 119.44 3fq8 h GLN 2020Ca 0.31 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.02 3fq8 h GLN 2020Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 3fq8 h GLN 2020CO -0.05 0.00 -0.66 1.63 -0.67 0.00 0.00 178.83 179.08 3fq8 n LYS 2021N -2.33 0.37 -0.04 1.46 5.02 -0.88 -4.40 118.16 117.36 3fq8 n LYS 2021Ca -0.01 -0.28 -0.04 0.00 -2.02 0.00 0.00 58.31 55.96 3fq8 n LYS 2021Cb 0.07 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.52 3fq8 n LYS 2021CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3fq8 n LEU 2022N -1.07 0.25 -4.10 -0.35 4.77 0.29 -5.05 117.00 111.74 3fq8 n LEU 2022Ca 0.07 -0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.90 3fq8 n LEU 2022Cb 0.36 0.15 -0.11 0.00 -2.33 0.00 0.00 43.42 41.49 3fq8 n LEU 2022CO 0.35 0.24 -0.41 -0.04 -1.33 0.00 0.00 177.39 176.21 3fq8 s MET 2023N -2.20 0.63 -0.21 3.23 -1.94 -0.02 -5.05 119.30 113.75 3fq8 s MET 2023Ca -0.05 -0.88 -0.33 0.00 -1.71 0.00 0.00 55.69 52.71 3fq8 s MET 2023Cb 0.03 -0.39 -0.10 0.00 2.01 0.00 0.00 34.83 36.37 3fq8 s MET 2023CO 0.33 0.07 2.05 -2.30 -0.01 0.00 0.00 175.02 175.16 3fq8 n PRO 2024N 1.20 1.73 -0.91 2.03 -0.02 -1.26 0.19 135.00 137.96 3fq8 n PRO 2024Ca -0.21 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 3fq8 n PRO 2024Cb 0.55 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3fq8 n PRO 2024CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fq8 n GLY 2025N 5.41 0.40 2.31 -1.23 0.00 -1.26 -2.91 105.19 107.90 3fq8 n GLY 2025Ca 0.31 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.22 3fq8 n GLY 2025CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fq8 n GLY 2026N -1.55 1.09 3.18 -0.02 0.00 0.13 -4.74 105.19 103.28 3fq8 n GLY 2026Ca 0.00 -0.52 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 3fq8 n GLY 2026CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fq8 s VAL 2027N -2.42 0.17 -0.74 1.61 -7.23 -1.15 -4.60 120.40 106.05 3fq8 s VAL 2027Ca 0.00 -1.95 0.22 0.00 -1.81 0.00 0.00 61.98 58.44 3fq8 s VAL 2027Cb 0.00 -2.21 -0.20 0.00 0.56 0.00 0.00 36.38 34.52 3fq8 s VAL 2027CO 0.00 -0.31 0.90 -1.20 -0.31 0.00 0.00 175.10 174.18 3fq8 n SER 2028N -0.18 0.69 -3.70 4.85 7.64 -1.26 -4.47 113.62 117.18 3fq8 n SER 2028Ca -0.03 -0.57 -0.11 0.00 1.01 0.00 0.00 58.87 59.17 3fq8 n SER 2028Cb 0.64 1.07 -0.11 0.00 -1.01 0.00 0.00 64.21 64.80 3fq8 n SER 2028CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3fq8 s SER 2029N -3.49 -0.42 0.20 6.43 0.15 -1.26 -5.09 113.70 110.22 3fq8 s SER 2029Ca 0.04 0.79 -0.19 0.00 0.70 0.00 0.00 55.95 57.30 3fq8 s SER 2029Cb 0.15 0.69 0.17 0.00 -1.71 0.00 0.00 66.02 65.32 3fq8 s SER 2029CO 0.85 -0.19 1.43 -2.65 1.20 0.00 0.00 173.24 173.88 3fq8 n PRO 2030N 4.31 -0.25 -0.01 5.44 -0.02 -1.26 -1.47 135.00 141.74 3fq8 n PRO 2030Ca -0.23 1.42 0.23 0.00 -2.02 0.00 0.00 63.50 62.90 3fq8 n PRO 2030Cb 0.54 -2.10 0.72 0.00 -0.02 0.00 0.00 33.50 32.64 3fq8 n PRO 2030CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3fq8 h VAL 2031N 0.00 0.41 0.00 -1.45 3.04 -1.94 -1.78 116.25 114.53 3fq8 h VAL 2031Ca 0.29 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.98 3fq8 h VAL 2031Cb 0.52 0.58 0.00 0.00 -2.01 0.00 0.00 31.29 30.38 3fq8 h VAL 2031CO -0.91 0.00 0.00 0.54 -1.01 0.00 0.00 177.57 176.19 3fq8 n ARG 2032N -3.85 0.12 0.00 4.17 1.74 -0.54 -3.34 116.66 114.96 3fq8 n ARG 2032Ca 0.12 0.27 0.14 0.00 -0.77 0.00 0.00 57.85 57.60 3fq8 n ARG 2032Cb 0.78 -1.69 0.76 0.00 -1.02 0.00 0.00 32.46 31.28 3fq8 n ARG 2032CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3fq8 n ALA 2033N -1.65 2.45 -1.41 7.54 0.00 -0.67 -4.73 120.51 122.03 3fq8 n ALA 2033Ca 0.04 -0.15 -0.14 0.00 0.00 0.00 0.00 53.44 53.19 3fq8 n ALA 2033Cb 0.27 -1.46 -0.06 0.00 0.00 0.00 0.00 19.45 18.20 3fq8 n ALA 2033CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3fq8 n PHE 2034N -1.17 -0.01 -0.33 0.00 3.01 -1.21 -4.35 117.46 113.40 3fq8 n PHE 2034Ca 0.17 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.76 3fq8 n PHE 2034Cb 0.17 -3.01 0.35 0.00 -0.01 0.00 0.00 39.48 36.98 3fq8 n PHE 2034CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3fq8 h LYS 2035N 0.00 0.70 -0.01 -1.08 1.57 -1.87 0.60 116.57 116.48 3fq8 h LYS 2035Ca -0.29 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 3fq8 h LYS 2035Cb 1.24 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.39 3fq8 h LYS 2035CO 0.43 0.46 -0.02 -1.13 -0.57 0.00 0.00 179.45 178.62 3fq8 n SER 2036N -4.70 0.58 -1.40 0.86 3.41 -1.26 -3.83 113.62 107.28 3fq8 n SER 2036Ca 0.22 -1.05 0.01 0.00 -0.26 0.00 0.00 58.87 57.79 3fq8 n SER 2036Cb 0.57 -0.02 0.09 0.00 -0.26 0.00 0.00 64.21 64.60 3fq8 n SER 2036CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 3fq8 n VAL 2037N -0.62 1.22 0.00 -3.33 3.14 0.28 -4.74 118.33 114.29 3fq8 n VAL 2037Ca 0.20 -2.39 0.00 0.00 -2.96 0.00 0.00 64.34 59.19 3fq8 n VAL 2037Cb 0.23 0.36 0.00 0.00 -1.06 0.00 0.00 33.84 33.37 3fq8 n VAL 2037CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3fq8 n GLY 2038N -0.35 2.07 2.25 7.55 0.00 -1.01 -4.68 105.19 111.02 3fq8 n GLY 2038Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 3fq8 n GLY 2038CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fq8 n GLY 2039N -1.52 0.84 2.99 -0.02 0.00 0.18 -4.95 105.19 102.72 3fq8 n GLY 2039Ca 0.00 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 3fq8 n GLY 2039CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fq8 n GLN 2040N -2.53 2.61 -1.59 1.61 1.13 -1.26 -4.87 117.38 112.48 3fq8 n GLN 2040Ca -0.06 -4.51 -0.33 0.00 -1.94 0.00 0.00 57.00 50.16 3fq8 n GLN 2040Cb 0.24 -2.38 0.06 0.00 0.11 0.00 0.00 30.24 28.27 3fq8 n GLN 2040CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 3fq8 s PRO 2041N -1.63 2.57 -0.14 -1.09 0.04 -1.26 -5.00 135.00 128.50 3fq8 s PRO 2041Ca 0.29 1.38 -0.06 0.00 0.04 0.00 0.00 61.00 62.65 3fq8 s PRO 2041Cb -0.03 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 3fq8 s PRO 2041CO -0.11 -1.43 0.06 0.96 0.04 0.00 0.00 177.00 176.53 3fq8 s ILE 2042N -2.45 4.82 -0.16 0.56 -4.36 -1.26 -4.69 121.20 113.66 3fq8 s ILE 2042Ca 0.66 -0.04 -0.22 0.00 -0.26 0.00 0.00 60.65 60.79 3fq8 s ILE 2042Cb -0.20 -3.11 -0.03 0.00 1.25 0.00 0.00 42.46 40.37 3fq8 s ILE 2042CO 0.46 0.55 0.68 -0.69 0.24 0.00 0.00 174.94 176.17 3fq8 s VAL 2043N -0.37 5.00 0.30 8.37 1.01 -1.26 -5.05 120.40 128.40 3fq8 s VAL 2043Ca 0.09 1.32 -0.22 0.00 0.00 0.00 0.00 61.98 63.17 3fq8 s VAL 2043Cb -0.12 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 3fq8 s VAL 2043CO 0.02 0.13 0.86 -0.36 0.00 0.00 0.00 175.10 175.74 3fq8 s PHE 2044N 1.71 3.60 -0.12 5.22 2.99 -1.26 -1.89 117.98 128.23 3fq8 s PHE 2044Ca 0.32 1.59 -0.02 0.00 0.00 0.00 0.00 56.93 58.82 3fq8 s PHE 2044Cb -0.16 -2.78 -0.07 0.00 0.00 0.00 0.00 43.02 40.01 3fq8 s PHE 2044CO 0.12 0.20 -0.13 -3.47 -0.00 0.00 0.00 175.22 171.95 3fq8 n ASP 2045N 0.39 2.16 -3.69 1.36 -0.08 0.04 -4.75 116.55 111.98 3fq8 n ASP 2045Ca 0.01 0.03 -0.10 0.00 -1.51 0.00 0.00 54.79 53.22 3fq8 n ASP 2045Cb 0.51 -0.26 -0.04 0.00 2.34 0.00 0.00 41.12 43.67 3fq8 n ASP 2045CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3fq8 s ARG 2046N -2.23 1.28 -0.01 -0.67 1.70 -1.16 -5.03 118.95 112.83 3fq8 s ARG 2046Ca -0.16 -0.80 -0.01 0.00 -0.47 0.00 0.00 55.73 54.29 3fq8 s ARG 2046Cb 0.05 0.51 -0.00 0.00 -0.57 0.00 0.00 34.95 34.94 3fq8 s ARG 2046CO 0.25 -0.53 0.03 0.14 -1.08 0.00 0.00 175.30 174.10 3fq8 s VAL 2047N -3.85 0.03 -0.24 4.99 -7.23 -1.26 -0.51 120.40 112.32 3fq8 s VAL 2047Ca 0.07 -0.21 -0.19 0.00 -1.81 0.00 0.00 61.98 59.84 3fq8 s VAL 2047Cb -0.00 -0.12 0.07 0.00 0.56 0.00 0.00 36.38 36.89 3fq8 s VAL 2047CO -0.06 -0.12 0.62 -0.75 -0.31 0.00 0.00 175.10 174.48 3fq8 s LYS 2048N -0.35 0.68 5.94 4.82 2.20 -0.16 -4.41 119.74 128.47 3fq8 s LYS 2048Ca -0.04 0.96 0.00 0.00 -0.36 0.00 0.00 55.97 56.53 3fq8 s LYS 2048Cb -0.03 0.25 0.00 0.00 -1.51 0.00 0.00 37.83 36.54 3fq8 s LYS 2048CO -0.00 -0.11 0.00 -0.25 -0.36 0.00 0.00 175.35 174.63 3fq8 n ASP 2049N 3.36 0.00 -1.63 1.43 8.00 -0.10 -0.42 116.55 127.20 3fq8 n ASP 2049Ca -0.17 0.00 0.10 0.00 0.71 0.00 0.00 54.79 55.43 3fq8 n ASP 2049Cb 0.57 0.00 0.37 0.00 -0.02 0.00 0.00 41.12 42.03 3fq8 n ASP 2049CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fq8 n ALA 2050N 12.09 3.09 -2.48 2.24 0.00 -1.26 -0.17 120.51 134.02 3fq8 n ALA 2050Ca 0.00 -1.60 -0.24 0.00 0.00 0.00 0.00 53.44 51.60 3fq8 n ALA 2050Cb 0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 19.45 18.32 3fq8 n ALA 2050CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3fq8 s TYR 2051N -1.83 2.34 0.02 0.00 1.51 0.44 -0.37 117.35 119.46 3fq8 s TYR 2051Ca 0.52 -0.32 0.03 0.00 -1.01 0.00 0.00 57.07 56.29 3fq8 s TYR 2051Cb 0.33 -1.04 -0.02 0.00 -0.11 0.00 0.00 41.96 41.13 3fq8 s TYR 2051CO 0.26 0.68 -0.09 0.00 -1.11 0.00 0.00 175.55 175.28 3fq8 s ALA 2052N -2.36 0.76 -0.07 3.71 0.00 -0.62 -0.99 121.76 122.18 3fq8 s ALA 2052Ca 0.29 -0.58 0.05 0.00 0.00 0.00 0.00 51.96 51.71 3fq8 s ALA 2052Cb -0.06 -0.11 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 3fq8 s ALA 2052CO 0.15 0.12 -0.22 -1.58 0.00 0.00 0.00 175.76 174.23 3fq8 s TRP 2053N -0.69 2.30 0.91 0.00 0.51 0.33 -0.62 118.94 121.68 3fq8 s TRP 2053Ca -0.01 -0.81 -0.12 0.00 -2.12 0.00 0.00 56.10 53.04 3fq8 s TRP 2053Cb -0.06 -1.53 0.13 0.00 -0.81 0.00 0.00 33.47 31.20 3fq8 s TRP 2053CO 0.00 -0.30 1.09 -0.51 -0.51 0.00 0.00 176.95 176.73 3fq8 s ASP 2054N 0.15 3.39 0.01 2.95 1.01 0.79 -0.78 116.67 124.19 3fq8 s ASP 2054Ca -0.11 1.47 0.27 0.00 0.71 0.00 0.00 52.55 54.89 3fq8 s ASP 2054Cb -0.15 -2.15 1.14 0.00 1.01 0.00 0.00 42.92 42.77 3fq8 s ASP 2054CO 0.06 -2.69 1.86 1.33 0.21 0.00 0.00 175.17 175.94 3fq8 n VAL 2055N -3.91 0.16 1.16 -1.27 0.24 -0.79 -2.27 118.33 111.64 3fq8 n VAL 2055Ca 0.07 0.02 0.12 0.00 -2.04 0.00 0.00 64.34 62.51 3fq8 n VAL 2055Cb 0.55 -0.57 0.23 0.00 -1.47 0.00 0.00 33.84 32.59 3fq8 n VAL 2055CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3fq8 n ASP 2056N -1.55 1.54 0.00 -1.34 8.00 -1.26 -4.87 116.55 117.06 3fq8 n ASP 2056Ca 0.06 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.34 3fq8 n ASP 2056Cb 0.32 0.25 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 3fq8 n ASP 2056CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fq8 n GLY 2057N 1.36 0.55 3.76 0.44 0.00 -0.96 -5.03 105.19 105.31 3fq8 n GLY 2057Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3fq8 n GLY 2057CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3fq8 s ASN 2058N -2.84 7.13 -0.06 1.61 0.02 -1.26 -4.74 114.94 114.79 3fq8 s ASN 2058Ca 0.00 2.37 -0.00 0.00 -1.02 0.00 0.00 52.86 54.21 3fq8 s ASN 2058Cb 0.00 -2.63 -0.03 0.00 0.02 0.00 0.00 41.25 38.61 3fq8 s ASN 2058CO 0.00 -0.26 -0.02 -0.60 0.02 0.00 0.00 177.10 176.23 3fq8 s ARG 2059N -1.41 2.86 0.05 -0.60 3.00 -1.26 -0.15 118.95 121.44 3fq8 s ARG 2059Ca 0.46 -0.50 0.04 0.00 -1.00 0.00 0.00 55.73 54.74 3fq8 s ARG 2059Cb -0.34 -2.70 -0.03 0.00 0.00 0.00 0.00 34.95 31.89 3fq8 s ARG 2059CO 0.44 0.68 -0.11 0.71 0.00 0.00 0.00 175.30 177.01 3fq8 s TYR 2060N -0.90 0.96 -0.35 5.12 1.51 0.21 -4.65 117.35 119.26 3fq8 s TYR 2060Ca 0.14 -0.46 -0.21 0.00 -1.01 0.00 0.00 57.07 55.53 3fq8 s TYR 2060Cb -0.11 -0.56 0.00 0.00 -0.11 0.00 0.00 41.96 41.18 3fq8 s TYR 2060CO 0.03 -0.01 0.68 0.42 -1.11 0.00 0.00 175.55 175.57 3fq8 s ILE 2061N -1.24 4.85 -0.20 2.71 1.01 -0.15 -1.59 121.20 126.59 3fq8 s ILE 2061Ca -0.05 0.71 -0.24 0.00 0.00 0.00 0.00 60.65 61.07 3fq8 s ILE 2061Cb -0.10 -4.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.26 3fq8 s ILE 2061CO 0.01 -0.32 0.81 -0.62 0.00 0.00 0.00 174.94 174.82 3fq8 s ASP 2062N 1.78 6.87 -0.14 3.58 3.68 0.50 -1.43 116.67 131.51 3fq8 s ASP 2062Ca 0.26 1.08 0.16 0.00 2.13 0.00 0.00 52.55 56.19 3fq8 s ASP 2062Cb -0.14 -2.43 0.41 0.00 -1.45 0.00 0.00 42.92 39.30 3fq8 s ASP 2062CO 0.15 -0.44 1.29 -1.22 0.13 0.00 0.00 175.17 175.09 3fq8 n TYR 2063N 5.55 0.53 -0.07 -5.34 4.01 -0.34 -4.46 117.16 117.04 3fq8 n TYR 2063Ca 0.04 -0.88 -0.09 0.00 -0.16 0.00 0.00 57.90 56.82 3fq8 n TYR 2063Cb 0.48 -0.23 -0.10 0.00 -0.31 0.00 0.00 39.34 39.19 3fq8 n TYR 2063CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3fq8 n VAL 2064N -0.78 0.95 -4.02 -0.72 0.31 -1.26 -0.91 118.33 111.90 3fq8 n VAL 2064Ca 0.18 -0.49 -0.28 0.00 -0.01 0.00 0.00 64.34 63.74 3fq8 n VAL 2064Cb 0.74 -0.83 -0.02 0.00 -0.91 0.00 0.00 33.84 32.82 3fq8 n VAL 2064CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3fq8 n GLY 2065N 2.37 -0.27 2.71 2.92 0.00 -1.26 0.33 105.19 111.99 3fq8 n GLY 2065Ca -0.25 0.15 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 3fq8 n GLY 2065CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3fq8 n THR 2066N -4.42 -0.64 -2.21 2.61 5.66 -1.26 -1.52 114.28 112.50 3fq8 n THR 2066Ca -0.22 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 60.74 3fq8 n THR 2066Cb 0.64 -1.58 0.00 0.00 -1.55 0.00 0.00 70.33 67.85 3fq8 n THR 2066CO 0.00 0.00 0.00 0.79 -3.05 0.00 0.00 175.07 172.81 3fq8 n TRP 2067N -3.44 -0.26 0.00 1.09 7.02 0.15 -4.35 117.44 117.65 3fq8 n TRP 2067Ca -0.09 0.04 0.00 0.00 -1.02 0.00 0.00 57.50 56.43 3fq8 n TRP 2067Cb 0.58 -1.60 0.00 0.00 -2.42 0.00 0.00 31.31 27.86 3fq8 n TRP 2067CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3fq8 n GLY 2068N -0.96 3.17 0.36 6.99 0.00 -0.57 -4.99 105.19 109.19 3fq8 n GLY 2068Ca -0.04 -1.12 0.06 0.00 0.00 0.00 0.00 46.02 44.93 3fq8 n GLY 2068CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fq8 h PRO 2069N 0.00 0.87 -2.03 1.61 0.11 -1.75 -3.28 132.00 127.54 3fq8 h PRO 2069Ca 0.00 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.02 3fq8 h PRO 2069Cb 0.00 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.90 3fq8 h PRO 2069CO 0.00 0.57 -0.06 0.00 -0.21 0.00 0.00 178.00 178.30 3fq8 n ALA 2070N -2.41 4.14 0.21 -0.75 0.00 -1.10 -4.52 120.51 116.08 3fq8 n ALA 2070Ca 0.14 -0.36 0.06 0.00 0.00 0.00 0.00 53.44 53.27 3fq8 n ALA 2070Cb 0.27 -1.40 0.52 0.00 0.00 0.00 0.00 19.45 18.84 3fq8 n ALA 2070CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3fq8 h ILE 2071N 1.36 1.11 -0.12 0.00 2.10 -1.86 -1.62 117.51 118.48 3fq8 h ILE 2071Ca 0.04 -0.49 0.00 0.00 1.08 0.00 0.00 64.86 65.48 3fq8 h ILE 2071Cb 0.98 1.23 0.00 0.00 -1.09 0.00 0.00 36.82 37.93 3fq8 h ILE 2071CO 0.06 0.14 0.00 0.00 -1.08 0.00 0.00 178.15 177.27 3fq8 n GLY 2073N 1.13 2.59 3.78 0.00 0.00 -0.61 -4.19 105.19 107.89 3fq8 n GLY 2073Ca 0.17 -1.85 -0.37 0.00 0.00 0.00 0.00 46.02 43.97 3fq8 n GLY 2073CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fq8 s HIS 2074N -2.57 3.30 -1.37 1.61 3.76 0.76 -3.95 115.29 116.82 3fq8 s HIS 2074Ca 0.00 1.65 -0.19 0.00 -0.15 0.00 0.00 55.06 56.37 3fq8 s HIS 2074Cb 0.00 -3.18 0.03 0.00 1.11 0.00 0.00 32.58 30.54 3fq8 s HIS 2074CO 0.00 -0.68 0.36 0.00 -0.85 0.00 0.00 174.74 173.58 3fq8 n ALA 2075N 0.15 -2.33 -1.73 -1.40 0.00 -1.26 -0.92 120.51 113.02 3fq8 n ALA 2075Ca 0.04 -0.51 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 3fq8 n ALA 2075Cb 0.48 -1.75 -0.03 0.00 0.00 0.00 0.00 19.45 18.15 3fq8 n ALA 2075CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3fq8 s HIS 2076N -3.93 2.69 0.35 0.00 5.04 -1.25 -4.75 115.29 113.43 3fq8 s HIS 2076Ca 0.26 0.24 0.11 0.00 -1.54 0.00 0.00 55.06 54.14 3fq8 s HIS 2076Cb -0.15 -4.15 0.89 0.00 0.04 0.00 0.00 32.58 29.22 3fq8 s HIS 2076CO 0.99 -4.47 1.80 -1.00 -2.34 0.00 0.00 174.74 169.72 3fq8 h PRO 2077N 7.31 0.59 -0.00 2.88 0.13 -1.96 0.01 132.00 140.95 3fq8 h PRO 2077Ca -0.44 -0.04 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 3fq8 h PRO 2077Cb 1.21 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 3fq8 h PRO 2077CO 0.95 0.39 -0.61 0.93 -0.23 0.00 0.00 178.00 179.43 3fq8 h GLU 2078N 0.61 0.01 -0.06 0.86 5.08 -1.99 -1.20 114.58 117.89 3fq8 h GLU 2078Ca 0.55 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.81 3fq8 h GLU 2078Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 3fq8 h GLU 2078CO -0.31 0.62 -0.32 0.28 -1.00 0.00 0.00 179.01 178.28 3fq8 h VAL 2079N 0.01 1.44 -0.29 3.13 2.07 -1.44 -2.10 116.25 119.07 3fq8 h VAL 2079Ca -0.01 -1.75 0.02 0.00 0.82 0.00 0.00 66.70 65.79 3fq8 h VAL 2079Cb 1.09 2.38 -0.03 0.00 -1.52 0.00 0.00 31.29 33.21 3fq8 h VAL 2079CO 0.08 0.50 0.13 0.40 0.02 0.00 0.00 177.57 178.70 3fq8 h ILE 2080N -0.19 0.97 -0.53 4.57 1.08 -1.05 -1.29 117.51 121.07 3fq8 h ILE 2080Ca -0.02 -0.09 0.03 0.00 -0.39 0.00 0.00 64.86 64.38 3fq8 h ILE 2080Cb 0.98 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 35.36 3fq8 h ILE 2080CO 0.07 0.05 0.30 -0.08 -0.69 0.00 0.00 178.15 177.80 3fq8 h GLU 2081N 0.28 0.58 -0.70 2.37 4.57 -1.26 0.51 114.58 120.92 3fq8 h GLU 2081Ca 0.12 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.24 3fq8 h GLU 2081Cb 0.06 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.48 3fq8 h GLU 2081CO -0.10 0.38 0.34 0.00 -1.18 0.00 0.00 179.01 178.46 3fq8 h ALA 2082N 1.25 1.28 -0.30 2.92 0.00 -0.98 -1.69 119.26 121.74 3fq8 h ALA 2082Ca 0.22 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 3fq8 h ALA 2082Cb 0.07 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3fq8 h ALA 2082CO -0.12 0.56 -0.37 -0.07 0.00 0.00 0.00 179.25 179.26 3fq8 h LEU 2083N 0.99 0.84 -0.63 0.00 3.38 -0.43 -1.64 115.31 117.82 3fq8 h LEU 2083Ca 0.25 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3fq8 h LEU 2083Cb 0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3fq8 h LEU 2083CO -0.03 1.16 0.39 0.11 0.09 0.00 0.00 178.44 180.16 3fq8 h LYS 2084N 0.53 0.86 -0.30 1.13 1.57 -0.58 0.14 116.57 119.92 3fq8 h LYS 2084Ca 0.04 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 3fq8 h LYS 2084Cb 0.95 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 3fq8 h LYS 2084CO 0.09 0.60 0.05 0.28 -0.57 0.00 0.00 179.45 179.90 3fq8 h VAL 2085N 0.86 1.23 -0.48 0.50 2.07 -1.31 -3.23 116.25 115.89 3fq8 h VAL 2085Ca 0.23 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 3fq8 h VAL 2085Cb -0.04 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3fq8 h VAL 2085CO -0.04 0.27 0.17 0.00 0.02 0.00 0.00 177.57 177.98 3fq8 h ALA 2086N 0.88 0.62 0.00 1.67 0.00 -0.85 -3.05 119.26 118.53 3fq8 h ALA 2086Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3fq8 h ALA 2086Cb 0.35 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3fq8 h ALA 2086CO 0.01 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.51 3fq8 h MET 2087N 0.63 0.00 0.00 0.00 -0.00 -0.76 -1.10 114.93 113.70 3fq8 h MET 2087Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.86 3fq8 h MET 2087Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.84 3fq8 h MET 2087CO -0.01 0.00 0.00 0.93 -0.00 0.00 0.00 176.91 177.83 3fq8 h GLU 2088N 0.00 0.00 -0.63 -0.10 4.39 -1.58 -1.03 114.58 115.63 3fq8 h GLU 2088Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3fq8 h GLU 2088Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 3fq8 h GLU 2088CO 0.00 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.48 3fq8 n LYS 2089N -2.55 2.67 0.00 2.33 5.02 -0.41 -5.05 118.16 120.17 3fq8 n LYS 2089Ca -0.00 -2.55 0.00 0.00 -2.02 0.00 0.00 58.31 53.74 3fq8 n LYS 2089Cb 0.16 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.62 3fq8 n LYS 2089CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fq8 n GLY 2090N 1.59 2.50 0.10 0.72 0.00 -0.39 -4.93 105.19 104.79 3fq8 n GLY 2090Ca 0.23 -1.69 0.10 0.00 0.00 0.00 0.00 46.02 44.66 3fq8 n GLY 2090CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fq8 n THR 2091N 1.29 0.64 -3.72 2.61 -2.24 -1.26 -4.59 114.28 107.01 3fq8 n THR 2091Ca 0.00 -0.56 -0.12 0.00 -2.27 0.00 0.00 64.05 61.10 3fq8 n THR 2091Cb 0.00 -0.36 -0.10 0.00 -2.10 0.00 0.00 70.33 67.77 3fq8 n THR 2091CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3fq8 s SER 2092N -5.34 -0.47 -0.22 3.42 0.15 -1.26 -4.05 113.70 105.92 3fq8 s SER 2092Ca -0.01 0.86 -0.09 0.00 0.70 0.00 0.00 55.95 57.41 3fq8 s SER 2092Cb 0.10 0.82 -0.10 0.00 -1.71 0.00 0.00 66.02 65.13 3fq8 s SER 2092CO 0.80 -0.17 -0.27 0.49 1.20 0.00 0.00 173.24 175.30 3fq8 n PHE 2093N 3.45 0.00 -0.72 3.44 3.72 -1.26 -5.00 117.46 121.09 3fq8 n PHE 2093Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 3fq8 n PHE 2093Cb 0.56 -0.79 0.00 0.00 -0.94 0.00 0.00 39.48 38.31 3fq8 n PHE 2093CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fq8 n GLY 2094N 1.75 0.59 3.41 1.37 0.00 -1.26 -5.02 105.19 106.03 3fq8 n GLY 2094Ca -0.42 -0.47 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 3fq8 n GLY 2094CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fq8 s ALA 2095N -2.00 -0.01 0.61 4.61 0.00 -1.26 -5.15 121.76 118.56 3fq8 s ALA 2095Ca 0.00 -0.93 -0.19 0.00 0.00 0.00 0.00 51.96 50.84 3fq8 s ALA 2095Cb 0.00 0.98 -0.02 0.00 0.00 0.00 0.00 23.12 24.08 3fq8 s ALA 2095CO 0.00 -0.72 1.29 -2.14 0.00 0.00 0.00 175.76 174.20 3fq8 s PRO 2096N -4.00 2.77 0.02 0.00 0.02 -1.26 -5.04 135.00 127.52 3fq8 s PRO 2096Ca 0.21 2.06 -0.07 0.00 0.02 0.00 0.00 61.00 63.21 3fq8 s PRO 2096Cb 0.02 -1.95 -0.00 0.00 0.02 0.00 0.00 34.50 32.58 3fq8 s PRO 2096CO 0.04 -1.43 0.13 0.00 -0.33 0.00 0.00 177.00 175.41 3fq8 h ALA 2098N 3.88 2.01 -0.54 0.00 0.00 -1.99 -2.41 119.26 120.20 3fq8 h ALA 2098Ca -0.32 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.65 3fq8 h ALA 2098Cb 1.19 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 3fq8 h ALA 2098CO 0.46 -0.17 0.36 -0.07 0.00 0.00 0.00 179.25 179.83 3fq8 h LEU 2099N 0.45 0.44 -0.58 0.00 3.38 -1.96 -1.82 115.31 115.23 3fq8 h LEU 2099Ca 0.32 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.27 3fq8 h LEU 2099Cb 0.62 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 3fq8 h LEU 2099CO -0.10 0.29 0.28 -0.33 0.09 0.00 0.00 178.44 178.67 3fq8 h GLU 2100N 0.50 0.83 -0.76 1.13 5.08 -1.73 -1.76 114.58 117.87 3fq8 h GLU 2100Ca 0.23 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 3fq8 h GLU 2100Cb 0.29 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 3fq8 h GLU 2100CO -0.06 0.67 0.45 -0.91 -1.00 0.00 0.00 179.01 178.16 3fq8 h ASN 2101N 0.78 0.91 0.04 1.42 4.21 -1.45 0.32 115.58 121.81 3fq8 h ASN 2101Ca 0.20 -0.07 -0.00 0.00 1.21 0.00 0.00 56.30 57.64 3fq8 h ASN 2101Cb 0.12 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.09 3fq8 h ASN 2101CO -0.03 0.71 -0.02 0.58 -1.29 0.00 0.00 177.43 177.39 3fq8 h VAL 2102N 1.03 1.04 -0.48 2.81 2.07 -1.12 -0.80 116.25 120.81 3fq8 h VAL 2102Ca 0.27 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.43 3fq8 h VAL 2102Cb -0.03 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3fq8 h VAL 2102CO -0.05 0.07 -0.07 0.25 0.02 0.00 0.00 177.57 177.79 3fq8 h LEU 2103N -0.18 0.83 -0.36 2.57 6.46 -1.21 -1.79 115.31 121.62 3fq8 h LEU 2103Ca -0.01 -0.24 0.01 0.00 -0.12 0.00 0.00 57.88 57.52 3fq8 h LEU 2103Cb 0.16 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 3fq8 h LEU 2103CO 0.01 0.94 0.23 0.00 -0.62 0.00 0.00 178.44 178.99 3fq8 h ALA 2104N 1.14 0.46 -0.68 1.25 0.00 -0.74 0.02 119.26 120.71 3fq8 h ALA 2104Ca 0.13 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3fq8 h ALA 2104Cb 0.57 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 3fq8 h ALA 2104CO 0.03 -0.10 0.28 0.93 0.00 0.00 0.00 179.25 180.39 3fq8 h GLU 2105N 0.47 1.01 -0.49 0.00 5.08 -0.95 -1.00 114.58 118.69 3fq8 h GLU 2105Ca 0.14 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3fq8 h GLU 2105Cb -0.03 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 3fq8 h GLU 2105CO -0.05 0.84 0.25 0.52 -1.00 0.00 0.00 179.01 179.58 3fq8 h MET 2106N 0.96 0.69 -0.39 2.33 2.86 -0.84 -0.53 114.93 120.01 3fq8 h MET 2106Ca 0.23 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.73 3fq8 h MET 2106Cb 0.20 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 3fq8 h MET 2106CO -0.02 0.56 0.07 0.28 1.06 0.00 0.00 176.91 178.86 3fq8 h VAL 2107N 0.65 1.24 -0.35 -2.22 2.07 -0.81 -0.77 116.25 116.06 3fq8 h VAL 2107Ca 0.17 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 66.86 3fq8 h VAL 2107Cb 0.08 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3fq8 h VAL 2107CO -0.02 0.29 0.20 0.78 0.02 0.00 0.00 177.57 178.84 3fq8 h ASN 2108N 0.50 0.32 0.09 0.57 2.35 -0.95 -0.74 115.58 117.71 3fq8 h ASN 2108Ca 0.12 0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.79 3fq8 h ASN 2108Cb 0.36 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3fq8 h ASN 2108CO 0.01 0.23 -0.27 0.44 -1.65 0.00 0.00 177.43 176.19 3fq8 h ASP 2109N 0.41 0.30 0.00 5.81 3.32 -0.96 -3.28 116.42 122.02 3fq8 h ASP 2109Ca 0.14 -0.09 -0.19 0.00 0.02 0.00 0.00 57.03 56.91 3fq8 h ASP 2109Cb 0.01 -0.08 0.02 0.00 0.22 0.00 0.00 39.33 39.50 3fq8 h ASP 2109CO -0.07 0.57 -0.73 0.00 -1.72 0.00 0.00 179.24 177.29 3fq8 h ALA 2110N 1.46 0.08 -2.78 3.45 0.00 -0.65 -3.44 119.26 117.37 3fq8 h ALA 2110Ca 0.04 -0.61 -0.65 0.00 0.00 0.00 0.00 54.91 53.69 3fq8 h ALA 2110Cb 0.62 0.04 -0.17 0.00 0.00 0.00 0.00 17.79 18.28 3fq8 h ALA 2110CO 0.04 0.44 -0.42 0.08 0.00 0.00 0.00 179.25 179.39 3fq8 s VAL 2111N -3.22 5.26 0.21 0.00 1.01 -0.33 -4.00 120.40 119.34 3fq8 s VAL 2111Ca -0.12 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.83 3fq8 s VAL 2111Cb 0.04 -3.64 0.21 0.00 0.00 0.00 0.00 36.38 32.99 3fq8 s VAL 2111CO 0.85 0.13 1.59 -0.65 0.00 0.00 0.00 175.10 177.01 3fq8 h PRO 2112N 8.37 -0.08 0.00 2.72 0.11 -1.83 -2.19 132.00 139.11 3fq8 h PRO 2112Ca -0.33 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3fq8 h PRO 2112Cb 1.17 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3fq8 h PRO 2112CO 0.61 -0.05 0.00 0.66 -0.21 0.00 0.00 178.00 179.01 3fq8 h SER 2113N -0.08 0.00 -3.42 -2.05 4.64 -1.93 -3.44 113.55 107.26 3fq8 h SER 2113Ca 0.30 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 61.02 3fq8 h SER 2113Cb 0.56 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.55 3fq8 h SER 2113CO -0.77 0.00 0.25 -0.63 -0.87 0.00 0.00 176.83 174.80 3fq8 s ILE 2114N -3.26 4.94 -0.03 0.95 1.01 -0.82 -2.68 121.20 121.31 3fq8 s ILE 2114Ca 0.07 1.25 0.05 0.00 0.00 0.00 0.00 60.65 62.01 3fq8 s ILE 2114Cb 0.10 -3.98 -0.07 0.00 0.01 0.00 0.00 42.46 38.52 3fq8 s ILE 2114CO 0.52 0.00 0.06 -0.62 0.00 0.00 0.00 174.94 174.90 3fq8 n GLU 2115N 5.78 1.90 -3.88 2.79 1.02 -0.49 -4.63 120.64 123.13 3fq8 n GLU 2115Ca 0.01 -0.02 -0.11 0.00 -0.02 0.00 0.00 57.16 57.02 3fq8 n GLU 2115Cb 0.49 -1.12 -0.12 0.00 -0.02 0.00 0.00 31.44 30.66 3fq8 n GLU 2115CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 3fq8 s MET 2116N -2.22 0.17 0.02 3.49 0.00 -1.16 -4.90 119.30 114.71 3fq8 s MET 2116Ca -0.02 -0.14 -0.00 0.00 0.00 0.00 0.00 55.69 55.53 3fq8 s MET 2116Cb 0.02 0.07 -0.02 0.00 0.00 0.00 0.00 34.83 34.90 3fq8 s MET 2116CO 0.20 -0.03 -0.03 0.54 0.00 0.00 0.00 175.02 175.70 3fq8 s VAL 2117N -0.48 0.12 -0.10 10.11 0.11 -1.26 -2.48 120.40 126.42 3fq8 s VAL 2117Ca -0.05 -0.99 0.01 0.00 -2.93 0.00 0.00 61.98 58.01 3fq8 s VAL 2117Cb -0.03 -0.38 0.02 0.00 -1.53 0.00 0.00 36.38 34.45 3fq8 s VAL 2117CO 0.00 -0.55 -0.11 -0.60 -3.33 0.00 0.00 175.10 170.51 3fq8 s ARG 2118N -1.69 1.77 0.29 1.54 6.06 -0.47 -5.01 118.95 121.44 3fq8 s ARG 2118Ca -0.14 -0.38 -0.19 0.00 -2.50 0.00 0.00 55.73 52.52 3fq8 s ARG 2118Cb -0.08 -1.64 -0.09 0.00 0.06 0.00 0.00 34.95 33.20 3fq8 s ARG 2118CO -0.02 -0.15 0.78 -0.06 -2.50 0.00 0.00 175.30 173.35 3fq8 s PHE 2119N 1.26 3.54 0.00 5.12 0.40 -1.26 -1.93 117.98 125.10 3fq8 s PHE 2119Ca -0.03 1.40 0.00 0.00 -0.60 0.00 0.00 56.93 57.71 3fq8 s PHE 2119Cb -0.14 -2.65 0.00 0.00 0.51 0.00 0.00 43.02 40.74 3fq8 s PHE 2119CO -0.04 0.20 0.00 1.33 0.70 0.00 0.00 175.22 177.41 3fq8 n VAL 2120N 0.23 0.00 0.22 -0.44 0.24 0.10 -4.61 118.33 114.07 3fq8 n VAL 2120Ca 0.01 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.37 3fq8 n VAL 2120Cb 0.52 0.00 0.10 0.00 -1.47 0.00 0.00 33.84 32.99 3fq8 n VAL 2120CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3fq8 n ASN 2121N -1.84 2.41 -3.64 -1.34 4.13 -1.26 -1.55 115.26 112.17 3fq8 n ASN 2121Ca 0.00 -1.70 -0.03 0.00 1.68 0.00 0.00 54.58 54.52 3fq8 n ASN 2121Cb 0.00 -0.10 -0.01 0.00 -1.54 0.00 0.00 39.78 38.12 3fq8 n ASN 2121CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 3fq8 s SER 2122N -1.00 -0.18 0.36 6.41 1.04 -1.26 -3.25 113.70 115.82 3fq8 s SER 2122Ca 0.19 -0.19 0.12 0.00 0.48 0.00 0.00 55.95 56.54 3fq8 s SER 2122Cb 0.11 0.33 0.68 0.00 0.10 0.00 0.00 66.02 67.25 3fq8 s SER 2122CO 0.16 -0.59 1.81 1.23 0.98 0.00 0.00 173.24 176.82 3fq8 h GLY 2123N 2.00 0.04 0.92 7.32 0.00 -1.81 -2.44 103.07 109.10 3fq8 h GLY 2123Ca -0.23 -0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 3fq8 h GLY 2123CO 0.27 0.03 0.10 -0.84 0.00 0.00 0.00 176.54 176.11 3fq8 h THR 2124N 0.03 1.21 -0.60 4.70 2.02 -1.94 -0.48 112.91 117.86 3fq8 h THR 2124Ca 0.00 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.44 3fq8 h THR 2124Cb 0.68 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 3fq8 h THR 2124CO 0.05 0.24 0.21 -0.33 0.37 0.00 0.00 175.52 176.06 3fq8 h GLU 2125N 0.42 0.91 -0.46 6.66 5.08 -1.90 -0.21 114.58 125.09 3fq8 h GLU 2125Ca 0.11 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3fq8 h GLU 2125Cb 0.27 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3fq8 h GLU 2125CO -0.00 0.80 0.29 0.00 -1.00 0.00 0.00 179.01 179.10 3fq8 h ALA 2126N 1.07 0.58 -0.49 3.43 0.00 -1.20 -1.15 119.26 121.50 3fq8 h ALA 2126Ca 0.19 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 3fq8 h ALA 2126Cb 0.26 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3fq8 h ALA 2126CO -0.01 0.06 -0.05 0.00 0.00 0.00 0.00 179.25 179.25 3fq8 h MET 2128N 0.79 0.16 -0.00 0.00 2.07 -0.62 -1.83 114.93 115.49 3fq8 h MET 2128Ca 0.14 -0.01 -0.00 0.00 -2.07 0.00 0.00 59.70 57.76 3fq8 h MET 2128Cb 0.54 -0.04 -0.00 0.00 -1.87 0.00 0.00 31.60 30.24 3fq8 h MET 2128CO 0.03 0.11 0.00 0.00 1.07 0.00 0.00 176.91 178.12 3fq8 h ALA 2129N 1.09 0.01 -0.31 6.32 0.00 -0.94 -2.41 119.26 123.01 3fq8 h ALA 2129Ca 0.07 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3fq8 h ALA 2129Cb 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3fq8 h ALA 2129CO -0.05 -0.41 0.13 -0.24 0.00 0.00 0.00 179.25 178.67 3fq8 h VAL 2130N -0.16 1.12 -0.32 0.00 3.04 -1.00 0.21 116.25 119.15 3fq8 h VAL 2130Ca 0.00 -0.37 -0.05 0.00 -1.01 0.00 0.00 66.70 65.27 3fq8 h VAL 2130Cb 0.16 0.75 -0.01 0.00 -2.01 0.00 0.00 31.29 30.18 3fq8 h VAL 2130CO -0.00 0.14 0.02 0.25 -1.01 0.00 0.00 177.57 176.97 3fq8 h LEU 2131N 0.43 0.53 -0.49 3.16 7.12 -1.22 -0.14 115.31 124.71 3fq8 h LEU 2131Ca 0.11 -0.29 -0.06 0.00 0.13 0.00 0.00 57.88 57.76 3fq8 h LEU 2131Cb 0.09 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.05 3fq8 h LEU 2131CO -0.01 0.69 0.06 -0.09 -0.13 0.00 0.00 178.44 178.97 3fq8 h ARG 2132N 0.35 0.82 -0.82 1.25 2.43 -0.81 -2.92 114.38 114.68 3fq8 h ARG 2132Ca 0.09 -0.23 -0.04 0.00 -0.81 0.00 0.00 59.98 59.00 3fq8 h ARG 2132Cb 0.41 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 3fq8 h ARG 2132CO 0.01 0.83 0.37 0.97 -1.51 0.00 0.00 179.97 180.64 3fq8 h ILE 2133N 0.69 1.26 -0.87 1.20 6.09 -0.39 -0.32 117.51 125.18 3fq8 h ILE 2133Ca 0.15 -0.76 0.02 0.00 -1.37 0.00 0.00 64.86 62.90 3fq8 h ILE 2133Cb 0.42 0.23 -0.05 0.00 0.47 0.00 0.00 36.82 37.89 3fq8 h ILE 2133CO 0.01 0.32 0.57 0.24 -3.07 0.00 0.00 178.15 176.22 3fq8 h MET 2134N 1.17 1.09 -0.10 2.19 2.86 -0.90 0.84 114.93 122.09 3fq8 h MET 2134Ca 0.28 -0.07 -0.21 0.00 -2.06 0.00 0.00 59.70 57.64 3fq8 h MET 2134Cb 0.15 -0.25 0.01 0.00 0.06 0.00 0.00 31.60 31.58 3fq8 h MET 2134CO -0.03 0.72 -0.76 0.00 1.06 0.00 0.00 176.91 177.91 3fq8 h ARG 2135N 1.13 0.69 -0.60 1.72 3.08 -1.28 -2.61 114.38 116.51 3fq8 h ARG 2135Ca 0.33 -0.61 -0.08 0.00 0.07 0.00 0.00 59.98 59.69 3fq8 h ARG 2135Cb -0.06 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 3fq8 h ARG 2135CO -0.09 1.22 0.05 0.00 -1.07 0.00 0.00 179.97 180.07 3fq8 h ALA 2136N 0.48 0.97 -0.19 0.04 0.00 -0.78 0.40 119.26 120.18 3fq8 h ALA 2136Ca -0.07 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 3fq8 h ALA 2136Cb 1.40 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 3fq8 h ALA 2136CO 0.15 0.64 -0.25 -0.92 0.00 0.00 0.00 179.25 178.87 3fq8 h TYR 2137N 0.93 0.62 0.00 0.00 3.20 -0.88 -3.31 116.97 117.52 3fq8 h TYR 2137Ca 0.18 -0.20 -0.15 0.00 3.14 0.00 0.00 58.73 61.70 3fq8 h TYR 2137Cb 0.47 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 3fq8 h TYR 2137CO 0.03 0.90 -1.17 1.79 -1.64 0.00 0.00 178.16 178.07 3fq8 h THR 2138N 0.16 0.57 0.00 1.81 1.35 -1.47 -3.48 112.91 111.86 3fq8 h THR 2138Ca 0.02 -2.01 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 3fq8 h THR 2138Cb 0.82 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 3fq8 h THR 2138CO 0.06 0.33 0.00 0.61 -0.25 0.00 0.00 175.52 176.27 3fq8 n GLY 2139N 1.34 0.56 3.68 5.82 0.00 0.14 -5.04 105.19 111.69 3fq8 n GLY 2139Ca -0.06 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 3fq8 n GLY 2139CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fq8 s ARG 2140N -0.19 2.51 -0.01 1.61 0.52 -1.21 -5.03 118.95 117.15 3fq8 s ARG 2140Ca 0.00 -0.86 0.22 0.00 -0.52 0.00 0.00 55.73 54.56 3fq8 s ARG 2140Cb 0.00 -2.51 -0.25 0.00 0.52 0.00 0.00 34.95 32.71 3fq8 s ARG 2140CO 0.00 0.53 0.73 -0.25 0.02 0.00 0.00 175.30 176.33 3fq8 n ASP 2141N 0.55 0.51 -4.77 0.23 8.00 -1.23 -4.35 116.55 115.49 3fq8 n ASP 2141Ca -0.11 -0.46 -0.39 0.00 0.71 0.00 0.00 54.79 54.54 3fq8 n ASP 2141Cb 0.52 1.42 -0.06 0.00 -0.02 0.00 0.00 41.12 42.98 3fq8 n ASP 2141CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3fq8 s LYS 2142N -3.26 4.34 -0.02 -1.24 -0.14 0.31 -4.72 119.74 115.02 3fq8 s LYS 2142Ca 0.00 0.82 0.05 0.00 -1.36 0.00 0.00 55.97 55.49 3fq8 s LYS 2142Cb 0.15 -3.32 -0.01 0.00 -1.68 0.00 0.00 37.83 32.97 3fq8 s LYS 2142CO 0.88 0.42 -0.18 0.42 -0.76 0.00 0.00 175.35 176.13 3fq8 s ILE 2143N -0.40 1.45 -0.19 2.17 1.09 0.75 0.12 121.20 126.19 3fq8 s ILE 2143Ca 0.32 -0.78 -0.07 0.00 -1.10 0.00 0.00 60.65 59.03 3fq8 s ILE 2143Cb -0.19 -1.21 -0.04 0.00 -1.06 0.00 0.00 42.46 39.96 3fq8 s ILE 2143CO 0.19 0.41 0.05 -0.63 -0.10 0.00 0.00 174.94 174.86 3fq8 s ILE 2144N -0.38 4.58 0.22 2.92 1.01 -0.53 0.13 121.20 129.16 3fq8 s ILE 2144Ca 0.06 -0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.64 3fq8 s ILE 2144Cb -0.08 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 39.27 3fq8 s ILE 2144CO -0.00 0.44 0.00 -1.59 0.00 0.00 0.00 174.94 173.79 3fq8 s LYS 2145N 0.62 1.31 0.04 2.79 -2.85 0.13 -1.51 119.74 120.27 3fq8 s LYS 2145Ca 0.03 -1.66 0.02 0.00 -1.00 0.00 0.00 55.97 53.35 3fq8 s LYS 2145Cb -0.13 -0.55 -0.04 0.00 -2.06 0.00 0.00 37.83 35.05 3fq8 s LYS 2145CO 0.02 -0.11 0.05 -0.06 0.10 0.00 0.00 175.35 175.35 3fq8 s PHE 2146N -3.47 3.17 0.17 1.78 0.08 -1.26 -1.69 117.98 116.76 3fq8 s PHE 2146Ca 0.28 0.10 -0.31 0.00 0.12 0.00 0.00 56.93 57.12 3fq8 s PHE 2146Cb 0.06 -1.65 -0.10 0.00 -0.57 0.00 0.00 43.02 40.76 3fq8 s PHE 2146CO 0.08 0.51 1.53 -2.00 -0.10 0.00 0.00 175.22 175.25 3fq8 s GLU 2147N -2.01 4.23 0.00 0.44 2.12 -0.55 -2.23 118.70 120.71 3fq8 s GLU 2147Ca 0.25 2.32 0.00 0.00 0.36 0.00 0.00 54.97 57.90 3fq8 s GLU 2147Cb -0.12 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.11 3fq8 s GLU 2147CO 0.17 -0.57 0.00 0.41 -0.54 0.00 0.00 175.26 174.73 3fq8 n GLY 2148N 3.54 2.60 3.85 -1.50 0.00 -0.92 -4.37 105.19 108.39 3fq8 n GLY 2148Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3fq8 n GLY 2148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fq8 s TYR 2150N -2.12 1.17 -0.35 0.00 5.04 -1.26 -0.11 117.35 119.72 3fq8 s TYR 2150Ca 0.56 -0.29 0.15 0.00 -2.44 0.00 0.00 57.07 55.05 3fq8 s TYR 2150Cb -0.10 -0.80 0.40 0.00 0.35 0.00 0.00 41.96 41.82 3fq8 s TYR 2150CO 0.19 -0.09 0.85 0.72 -1.34 0.00 0.00 175.55 175.88 3fq8 n HIS 2151N 3.13 0.58 -2.25 4.97 8.25 -1.26 -4.93 115.22 123.70 3fq8 n HIS 2151Ca -0.17 -3.27 0.00 0.00 -0.26 0.00 0.00 57.72 54.02 3fq8 n HIS 2151Cb 0.54 -0.35 -0.00 0.00 1.12 0.00 0.00 29.99 31.30 3fq8 n HIS 2151CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fq8 n GLY 2152N 0.10 -2.16 1.90 -1.41 0.00 -1.26 -4.46 105.19 97.90 3fq8 n GLY 2152Ca 0.17 -1.47 -0.22 0.00 0.00 0.00 0.00 46.02 44.50 3fq8 n GLY 2152CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3fq8 n HIS 2153N -0.52 2.45 -1.90 1.61 1.44 -1.26 -4.89 115.22 112.15 3fq8 n HIS 2153Ca 0.00 -2.24 -0.28 0.00 -2.01 0.00 0.00 57.72 53.19 3fq8 n HIS 2153Cb 0.01 -0.83 -0.05 0.00 0.12 0.00 0.00 29.99 29.24 3fq8 n HIS 2153CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3fq8 s ALA 2154N -3.52 1.60 0.00 1.59 0.00 -1.26 -4.82 121.76 115.34 3fq8 s ALA 2154Ca 0.54 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 51.52 3fq8 s ALA 2154Cb 0.45 -4.47 0.00 0.00 0.00 0.00 0.00 23.12 19.10 3fq8 s ALA 2154CO 0.02 -4.76 0.00 -0.25 0.00 0.00 0.00 175.76 170.77 3fq8 n ASP 2155N 14.80 0.00 -0.18 0.00 9.92 -1.26 0.24 116.55 140.07 3fq8 n ASP 2155Ca 0.36 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.62 3fq8 n ASP 2155Cb 0.48 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 3fq8 n ASP 2155CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 3fq8 n MET 2156N -0.72 0.00 0.00 -1.24 2.81 -1.26 -1.63 117.12 115.08 3fq8 n MET 2156Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 3fq8 n MET 2156Cb 0.00 -0.97 0.00 0.00 -0.71 0.00 0.00 33.22 31.54 3fq8 n MET 2156CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3fq8 n PHE 2157N -0.11 0.00 -1.42 2.03 -0.00 0.66 -4.74 117.46 113.88 3fq8 n PHE 2157Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.17 3fq8 n PHE 2157Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 39.48 39.38 3fq8 n PHE 2157CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 3fq8 n LEU 2158N -1.39 2.07 -3.07 -2.13 7.99 -0.64 -4.30 117.00 115.52 3fq8 n LEU 2158Ca 0.00 -2.51 0.02 0.00 -0.01 0.00 0.00 56.01 53.51 3fq8 n LEU 2158Cb 0.14 -1.39 -0.00 0.00 -0.11 0.00 0.00 43.42 42.05 3fq8 n LEU 2158CO 0.00 -2.42 0.25 0.68 -1.51 0.00 0.00 177.39 174.38 3fq8 s VAL 2159N 12.00 -0.69 0.00 4.08 -7.23 -1.26 -4.56 120.40 122.74 3fq8 s VAL 2159Ca 0.73 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.90 3fq8 s VAL 2159Cb 0.03 -0.20 0.00 0.00 0.56 0.00 0.00 36.38 36.77 3fq8 s VAL 2159CO 0.20 0.00 0.00 0.29 -0.31 0.00 0.00 175.10 175.28 3fq8 n LYS 2160N 4.47 0.00 -1.48 4.82 4.01 -1.26 -4.90 118.16 123.82 3fq8 n LYS 2160Ca 0.08 0.06 -0.37 0.00 -0.51 0.00 0.00 58.31 57.57 3fq8 n LYS 2160Cb 0.58 -2.16 0.05 0.00 -0.51 0.00 0.00 35.03 33.00 3fq8 n LYS 2160CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3fq8 n ALA 2161N 0.03 -0.62 -2.80 7.82 0.00 -1.26 -2.16 120.51 121.52 3fq8 n ALA 2161Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3fq8 n ALA 2161Cb 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.48 3fq8 n ALA 2161CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fq8 n GLY 2162N 1.51 4.48 7.00 0.00 0.00 0.84 -4.48 105.19 114.54 3fq8 n GLY 2162Ca 0.12 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.41 3fq8 n GLY 2162CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3fq8 n SER 2163N 0.00 0.00 0.17 1.61 2.88 0.13 -2.01 113.62 116.40 3fq8 n SER 2163Ca 0.00 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.56 3fq8 n SER 2163Cb 0.00 0.00 0.37 0.00 -0.75 0.00 0.00 64.21 63.83 3fq8 n SER 2163CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 3fq8 h GLY 2164N 0.00 0.05 0.54 0.46 0.00 -1.90 -3.01 103.07 99.22 3fq8 h GLY 2164Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.29 3fq8 h GLY 2164CO 0.00 0.04 0.71 -2.08 0.00 0.00 0.00 176.54 175.21 3fq8 h VAL 2165N 0.04 0.00 0.02 4.60 2.07 -1.69 0.16 116.25 121.45 3fq8 h VAL 2165Ca 0.00 0.00 -0.38 0.00 0.82 0.00 0.00 66.70 67.14 3fq8 h VAL 2165Cb 0.59 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 3fq8 h VAL 2165CO 0.04 0.00 -2.15 0.00 0.02 0.00 0.00 177.57 175.48 3fq8 n ALA 2166N -1.63 1.11 -0.24 1.67 0.00 -1.14 -1.98 120.51 118.31 3fq8 n ALA 2166Ca -0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 53.44 52.51 3fq8 n ALA 2166Cb 0.73 -0.21 0.01 0.00 0.00 0.00 0.00 19.45 19.99 3fq8 n ALA 2166CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3fq8 n THR 2167N -3.94 1.94 0.00 0.00 -1.04 0.53 -3.44 114.28 108.32 3fq8 n THR 2167Ca -0.44 -0.63 0.00 0.00 -2.04 0.00 0.00 64.05 60.94 3fq8 n THR 2167Cb 0.89 -1.32 0.00 0.00 -1.82 0.00 0.00 70.33 68.08 3fq8 n THR 2167CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3fq8 n LEU 2168N 0.98 0.00 -3.27 -4.42 4.77 -1.13 -4.17 117.00 109.76 3fq8 n LEU 2168Ca 0.07 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.93 3fq8 n LEU 2168Cb 0.55 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.61 3fq8 n LEU 2168CO 0.09 0.00 -0.16 0.61 -1.33 0.00 0.00 177.39 176.60 3fq8 n GLY 2169N 0.00 -0.08 3.86 -0.72 0.00 -1.22 -4.85 105.19 102.17 3fq8 n GLY 2169Ca 0.00 0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3fq8 n GLY 2169CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fq8 s LEU 2170N -4.80 3.38 0.00 0.99 2.01 -0.84 -5.06 118.68 114.36 3fq8 s LEU 2170Ca 0.03 1.47 0.00 0.00 0.01 0.00 0.00 54.13 55.64 3fq8 s LEU 2170Cb -0.01 -4.48 0.00 0.00 0.01 0.00 0.00 46.19 41.71 3fq8 s LEU 2170CO 0.37 -0.76 0.00 -0.81 1.01 0.00 0.00 176.35 176.15 3fq8 n PRO 2171N -2.32 3.45 -1.71 1.29 -0.04 -1.26 -4.86 135.00 129.55 3fq8 n PRO 2171Ca 0.06 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.20 3fq8 n PRO 2171Cb 0.54 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.97 3fq8 n PRO 2171CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3fq8 n SER 2172N 0.00 6.96 -0.51 3.54 7.64 -1.26 -4.83 113.62 125.16 3fq8 n SER 2172Ca 0.00 -3.33 0.00 0.00 1.01 0.00 0.00 58.87 56.55 3fq8 n SER 2172Cb 0.00 -1.22 0.00 0.00 -1.01 0.00 0.00 64.21 61.98 3fq8 n SER 2172CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3fq8 n SER 2173N 0.71 -0.34 -4.21 6.43 2.88 -1.26 -4.70 113.62 113.13 3fq8 n SER 2173Ca 0.52 0.03 -0.35 0.00 -1.33 0.00 0.00 58.87 57.74 3fq8 n SER 2173Cb 0.43 -0.08 0.07 0.00 -0.75 0.00 0.00 64.21 63.89 3fq8 n SER 2173CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3fq8 n PRO 2174N 0.68 -0.10 0.00 -1.46 -0.04 -1.26 -3.53 135.00 129.28 3fq8 n PRO 2174Ca 0.00 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 3fq8 n PRO 2174Cb 0.02 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 3fq8 n PRO 2174CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fq8 n GLY 2175N 2.52 3.31 3.40 0.55 0.00 -1.26 -5.00 105.19 108.71 3fq8 n GLY 2175Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 3fq8 n GLY 2175CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fq8 s VAL 2176N -2.92 4.67 -0.07 1.61 0.11 -1.23 -5.00 120.40 117.57 3fq8 s VAL 2176Ca 0.00 -0.88 -0.30 0.00 -2.93 0.00 0.00 61.98 57.87 3fq8 s VAL 2176Cb 0.00 -4.58 -0.14 0.00 -1.53 0.00 0.00 36.38 30.13 3fq8 s VAL 2176CO 0.00 -1.27 0.85 -2.65 -3.33 0.00 0.00 175.10 168.70 3fq8 n PRO 2177N 6.73 0.00 0.25 1.54 -0.02 -1.26 -4.69 135.00 137.55 3fq8 n PRO 2177Ca -0.04 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.58 3fq8 n PRO 2177Cb 0.44 -1.09 0.62 0.00 -0.02 0.00 0.00 33.50 33.45 3fq8 n PRO 2177CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3fq8 h LYS 2178N 2.44 0.00 0.15 -0.52 6.56 -1.96 0.31 116.57 123.55 3fq8 h LYS 2178Ca -0.36 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.02 3fq8 h LYS 2178Cb 1.03 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.71 3fq8 h LYS 2178CO 0.52 0.00 -0.96 -0.22 -2.06 0.00 0.00 179.45 176.72 3fq8 h LYS 2179N 0.00 0.31 -0.58 3.15 3.64 -2.00 -3.27 116.57 117.83 3fq8 h LYS 2179Ca 0.07 -0.54 0.10 0.00 -1.27 0.00 0.00 60.65 59.02 3fq8 h LYS 2179Cb 1.16 0.20 -0.08 0.00 -0.41 0.00 0.00 32.23 33.11 3fq8 h LYS 2179CO -0.00 1.26 0.14 1.79 -2.27 0.00 0.00 179.45 180.37 3fq8 h THR 2180N -0.32 0.69 -0.28 1.00 1.35 -0.69 0.21 112.91 114.88 3fq8 h THR 2180Ca -0.18 -0.10 -0.12 0.00 -0.55 0.00 0.00 66.41 65.46 3fq8 h THR 2180Cb 1.71 0.38 -0.07 0.00 -1.73 0.00 0.00 68.15 68.43 3fq8 h THR 2180CO 0.15 0.05 0.16 0.35 -0.25 0.00 0.00 175.52 175.98 3fq8 n THR 2181N -5.09 1.50 0.60 6.82 -2.24 -1.10 -3.83 114.28 110.93 3fq8 n THR 2181Ca 0.08 -0.55 0.11 0.00 -2.27 0.00 0.00 64.05 61.42 3fq8 n THR 2181Cb 0.29 -0.75 0.07 0.00 -2.10 0.00 0.00 70.33 67.84 3fq8 n THR 2181CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fq8 n ALA 2182N 0.04 3.30 -1.12 6.98 0.00 0.75 -3.90 120.51 126.57 3fq8 n ALA 2182Ca 0.16 -0.36 -0.04 0.00 0.00 0.00 0.00 53.44 53.19 3fq8 n ALA 2182Cb 0.79 -1.03 0.27 0.00 0.00 0.00 0.00 19.45 19.49 3fq8 n ALA 2182CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3fq8 n ASN 2183N -1.97 4.25 -4.05 0.00 3.02 -1.25 -4.87 115.26 110.40 3fq8 n ASN 2183Ca 0.02 -3.30 -0.31 0.00 -0.03 0.00 0.00 54.58 50.96 3fq8 n ASN 2183Cb 0.43 -0.70 -0.16 0.00 -0.61 0.00 0.00 39.78 38.74 3fq8 n ASN 2183CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3fq8 s THR 2184N -3.03 1.76 -0.02 3.41 2.01 -1.25 -0.18 115.64 118.34 3fq8 s THR 2184Ca 0.52 -0.87 -0.01 0.00 0.31 0.00 0.00 61.69 61.64 3fq8 s THR 2184Cb 0.42 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 3fq8 s THR 2184CO 0.10 0.39 0.06 -0.76 -0.69 0.00 0.00 174.62 173.73 3fq8 s LEU 2185N 1.39 3.84 0.19 4.42 1.02 0.34 -4.93 118.68 124.94 3fq8 s LEU 2185Ca 0.03 0.15 0.08 0.00 0.02 0.00 0.00 54.13 54.41 3fq8 s LEU 2185Cb -0.14 -2.16 -0.04 0.00 0.02 0.00 0.00 46.19 43.87 3fq8 s LEU 2185CO -0.10 0.30 -0.17 0.42 0.02 0.00 0.00 176.35 176.81 3fq8 s THR 2186N -1.12 1.83 0.14 5.49 -4.23 -1.25 0.19 115.64 116.68 3fq8 s THR 2186Ca 0.20 -2.05 -0.11 0.00 -1.18 0.00 0.00 61.69 58.55 3fq8 s THR 2186Cb -0.12 -1.94 0.01 0.00 1.34 0.00 0.00 72.50 71.79 3fq8 s THR 2186CO 0.11 -0.42 0.31 0.28 -0.54 0.00 0.00 174.62 174.36 3fq8 s THR 2187N -2.40 0.09 0.42 3.99 -1.32 -0.69 -4.93 115.64 110.80 3fq8 s THR 2187Ca 0.19 -1.07 -0.25 0.00 -1.21 0.00 0.00 61.69 59.36 3fq8 s THR 2187Cb -0.04 -1.50 -0.08 0.00 -1.51 0.00 0.00 72.50 69.37 3fq8 s THR 2187CO 0.07 -0.39 1.20 -2.84 -2.21 0.00 0.00 174.62 170.45 3fq8 s PRO 2188N -3.89 3.93 0.45 7.08 0.02 -1.26 -1.48 135.00 139.85 3fq8 s PRO 2188Ca 0.09 1.89 -0.25 0.00 0.02 0.00 0.00 61.00 62.75 3fq8 s PRO 2188Cb 0.03 -2.60 -0.08 0.00 0.02 0.00 0.00 34.50 31.87 3fq8 s PRO 2188CO -0.06 -0.44 1.33 -0.47 -0.33 0.00 0.00 177.00 177.03 3fq8 s TYR 2189N -1.42 2.63 -0.57 6.54 5.04 -1.26 -2.21 117.35 126.10 3fq8 s TYR 2189Ca 0.59 1.37 0.00 0.00 -2.44 0.00 0.00 57.07 56.60 3fq8 s TYR 2189Cb -0.32 -3.73 0.00 0.00 0.35 0.00 0.00 41.96 38.26 3fq8 s TYR 2189CO 0.39 -2.41 0.00 0.09 -1.34 0.00 0.00 175.55 172.28 3fq8 n ASN 2190N -0.24 -4.30 -4.09 4.32 5.03 -1.26 -4.59 115.26 110.13 3fq8 n ASN 2190Ca 0.06 0.13 -0.36 0.00 0.87 0.00 0.00 54.58 55.28 3fq8 n ASN 2190Cb 0.44 -2.27 -0.10 0.00 -1.02 0.00 0.00 39.78 36.83 3fq8 n ASN 2190CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3fq8 s ASP 2191N -2.48 5.20 0.22 6.41 -1.08 -0.94 -4.93 116.67 119.07 3fq8 s ASP 2191Ca 0.00 -2.93 -0.06 0.00 -0.52 0.00 0.00 52.55 49.05 3fq8 s ASP 2191Cb 0.00 -1.84 0.19 0.00 -1.46 0.00 0.00 42.92 39.81 3fq8 s ASP 2191CO 0.00 -0.35 1.70 -0.07 0.52 0.00 0.00 175.17 176.98 3fq8 h LEU 2192N 6.92 0.94 -0.91 -1.34 3.38 -1.93 -2.98 115.31 119.39 3fq8 h LEU 2192Ca -0.01 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3fq8 h LEU 2192Cb 0.94 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 3fq8 h LEU 2192CO 0.71 0.98 0.56 -0.33 0.09 0.00 0.00 178.44 180.45 3fq8 h GLU 2193N 0.90 1.23 -0.32 1.13 4.39 -1.98 -1.45 114.58 118.47 3fq8 h GLU 2193Ca 0.17 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.72 3fq8 h GLU 2193Cb 0.49 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 3fq8 h GLU 2193CO 0.02 0.85 -0.01 0.00 -1.16 0.00 0.00 179.01 178.72 3fq8 h ALA 2194N 1.31 1.40 -0.29 3.43 0.00 -1.92 -2.08 119.26 121.11 3fq8 h ALA 2194Ca 0.33 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 3fq8 h ALA 2194Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3fq8 h ALA 2194CO -0.06 0.42 -0.20 0.28 0.00 0.00 0.00 179.25 179.69 3fq8 h VAL 2195N 0.47 1.30 -0.78 0.00 2.07 -1.19 -2.52 116.25 115.61 3fq8 h VAL 2195Ca 0.10 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.27 3fq8 h VAL 2195Cb 0.32 1.52 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 3fq8 h VAL 2195CO 0.01 0.42 0.40 0.11 0.02 0.00 0.00 177.57 178.54 3fq8 h LYS 2196N 0.39 1.11 -0.94 1.57 1.57 -1.05 -2.38 116.57 116.85 3fq8 h LYS 2196Ca 0.06 -0.15 0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3fq8 h LYS 2196Cb 0.74 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.79 3fq8 h LYS 2196CO 0.05 0.84 0.62 0.00 -0.57 0.00 0.00 179.45 180.39 3fq8 h ALA 2197N 1.21 1.21 -0.78 3.86 0.00 -1.30 -0.94 119.26 122.51 3fq8 h ALA 2197Ca 0.27 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 3fq8 h ALA 2197Cb 0.08 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3fq8 h ALA 2197CO -0.04 0.54 0.34 -0.07 0.00 0.00 0.00 179.25 180.02 3fq8 h LEU 2198N 1.23 1.05 -0.23 0.00 3.38 -0.98 -0.34 115.31 119.42 3fq8 h LEU 2198Ca 0.36 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 3fq8 h LEU 2198Cb -0.08 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.39 3fq8 h LEU 2198CO -0.09 0.92 -0.03 -0.26 0.09 0.00 0.00 178.44 179.06 3fq8 h PHE 2199N 1.13 0.48 -0.69 1.13 -1.00 -1.04 -2.35 116.94 114.60 3fq8 h PHE 2199Ca 0.27 -0.09 0.03 0.00 2.81 0.00 0.00 57.97 60.98 3fq8 h PHE 2199Cb 0.17 -0.12 -0.04 0.00 3.61 0.00 0.00 35.95 39.58 3fq8 h PHE 2199CO 0.02 0.64 0.45 0.00 -1.61 0.00 0.00 178.31 177.81 3fq8 h ALA 2200N 0.77 1.59 -0.00 2.45 0.00 -0.90 -1.44 119.26 121.74 3fq8 h ALA 2200Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3fq8 h ALA 2200Cb 0.47 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3fq8 h ALA 2200CO 0.02 0.34 -0.09 0.39 0.00 0.00 0.00 179.25 179.91 3fq8 n GLU 2201N -4.45 0.60 -2.95 0.00 1.02 -0.16 -4.15 120.64 110.55 3fq8 n GLU 2201Ca 0.08 -0.17 -0.14 0.00 -0.02 0.00 0.00 57.16 56.92 3fq8 n GLU 2201Cb 0.11 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.05 3fq8 n GLU 2201CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3fq8 n ASN 2202N -1.05 0.35 -4.64 1.62 3.02 -0.59 -5.07 115.26 108.89 3fq8 n ASN 2202Ca 0.14 -2.99 -0.44 0.00 -0.03 0.00 0.00 54.58 51.26 3fq8 n ASN 2202Cb 0.27 -0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.29 3fq8 n ASN 2202CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3fq8 n PRO 2203N 0.14 2.44 -0.92 3.52 -0.04 -0.91 -1.96 135.00 137.26 3fq8 n PRO 2203Ca 0.16 0.85 0.00 0.00 -0.04 0.00 0.00 63.50 64.47 3fq8 n PRO 2203Cb 0.72 -2.95 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 3fq8 n PRO 2203CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fq8 n GLY 2204N 4.86 0.48 0.02 0.55 0.00 -1.26 -4.91 105.19 104.93 3fq8 n GLY 2204Ca 0.24 -0.50 0.01 0.00 0.00 0.00 0.00 46.02 45.77 3fq8 n GLY 2204CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fq8 n GLU 2205N -2.92 4.95 -3.10 1.61 1.02 -0.83 -4.87 120.64 116.49 3fq8 n GLU 2205Ca 0.00 -0.12 -0.43 0.00 -0.02 0.00 0.00 57.16 56.59 3fq8 n GLU 2205Cb 0.00 -0.70 -0.07 0.00 -0.02 0.00 0.00 31.44 30.66 3fq8 n GLU 2205CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3fq8 s ILE 2206N -1.05 4.81 0.31 -3.67 -1.09 -1.25 -0.53 121.20 118.72 3fq8 s ILE 2206Ca 0.01 0.02 0.03 0.00 -2.23 0.00 0.00 60.65 58.49 3fq8 s ILE 2206Cb 0.02 -4.24 0.12 0.00 -1.58 0.00 0.00 42.46 36.78 3fq8 s ILE 2206CO 0.09 -0.66 1.81 0.00 -1.23 0.00 0.00 174.94 174.95 3fq8 h ALA 2207N 8.92 1.25 0.00 9.38 0.00 0.74 -3.43 119.26 136.12 3fq8 h ALA 2207Ca -0.26 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3fq8 h ALA 2207Cb 1.09 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3fq8 h ALA 2207CO 0.92 0.49 0.00 0.41 0.00 0.00 0.00 179.25 181.07 3fq8 n GLY 2208N -0.68 -1.82 3.25 0.00 0.00 -1.24 -1.19 105.19 103.51 3fq8 n GLY 2208Ca 0.01 -1.16 -0.33 0.00 0.00 0.00 0.00 46.02 44.55 3fq8 n GLY 2208CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fq8 s VAL 2209N -2.54 2.41 -0.00 1.61 1.01 0.75 -1.46 120.40 122.18 3fq8 s VAL 2209Ca 0.00 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.18 3fq8 s VAL 2209Cb 0.00 -1.97 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 3fq8 s VAL 2209CO 0.00 0.54 -0.25 -0.51 0.00 0.00 0.00 175.10 174.88 3fq8 s ILE 2210N 0.52 2.15 0.09 2.22 2.07 -0.57 0.12 121.20 127.81 3fq8 s ILE 2210Ca -0.12 -1.17 -0.26 0.00 -1.41 0.00 0.00 60.65 57.69 3fq8 s ILE 2210Cb -0.17 -1.78 0.08 0.00 0.13 0.00 0.00 42.46 40.73 3fq8 s ILE 2210CO 0.05 0.52 0.87 -1.48 -1.91 0.00 0.00 174.94 172.98 3fq8 s LEU 2211N -0.81 -0.31 -0.34 8.50 2.34 -0.76 -4.27 118.68 123.03 3fq8 s LEU 2211Ca 0.11 -0.19 -0.24 0.00 0.06 0.00 0.00 54.13 53.87 3fq8 s LEU 2211Cb -0.10 2.19 0.01 0.00 -0.56 0.00 0.00 46.19 47.72 3fq8 s LEU 2211CO 0.00 -0.81 0.84 -1.61 -1.06 0.00 0.00 176.35 173.71 3fq8 s GLU 2212N -3.31 3.86 0.55 1.48 2.02 -1.26 -0.44 118.70 121.60 3fq8 s GLU 2212Ca 0.08 0.51 0.29 0.00 0.02 0.00 0.00 54.97 55.87 3fq8 s GLU 2212Cb -0.01 -3.78 1.46 0.00 0.10 0.00 0.00 34.13 31.90 3fq8 s GLU 2212CO -0.04 -0.82 1.92 -1.00 0.02 0.00 0.00 175.26 175.33 3fq8 h PRO 2213N 8.34 0.00 -3.68 0.39 0.13 -1.94 -3.33 132.00 131.91 3fq8 h PRO 2213Ca -0.24 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.52 3fq8 h PRO 2213Cb 1.09 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.86 3fq8 h PRO 2213CO 0.93 0.00 -0.75 0.42 -0.23 0.00 0.00 178.00 178.36 3fq8 s ILE 2214N -4.89 0.20 0.28 -3.56 1.01 -1.26 -4.30 121.20 108.68 3fq8 s ILE 2214Ca -0.05 0.13 -0.27 0.00 0.00 0.00 0.00 60.65 60.46 3fq8 s ILE 2214Cb 0.19 -0.32 -0.09 0.00 0.01 0.00 0.00 42.46 42.25 3fq8 s ILE 2214CO 0.70 0.18 0.91 -0.69 0.00 0.00 0.00 174.94 176.04 3fq8 s VAL 2215N 1.34 4.21 0.00 2.92 1.01 0.46 -4.87 120.40 125.48 3fq8 s VAL 2215Ca -0.05 1.84 0.00 0.00 0.00 0.00 0.00 61.98 63.77 3fq8 s VAL 2215Cb -0.13 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.16 3fq8 s VAL 2215CO -0.02 0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.96 3fq8 n GLY 2216N 0.89 0.79 0.78 4.51 0.00 -1.23 -1.72 105.19 109.21 3fq8 n GLY 2216Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3fq8 n GLY 2216CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fq8 n ASN 2217N -0.32 2.39 -1.93 1.61 3.02 -1.26 -1.27 115.26 117.50 3fq8 n ASN 2217Ca 0.00 -1.80 -0.01 0.00 -0.03 0.00 0.00 54.58 52.75 3fq8 n ASN 2217Cb 0.00 -0.05 0.06 0.00 -0.61 0.00 0.00 39.78 39.17 3fq8 n ASN 2217CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3fq8 n SER 2218N 0.84 1.79 0.00 6.41 3.41 -1.16 -0.69 113.62 124.22 3fq8 n SER 2218Ca 0.17 -2.48 0.00 0.00 -0.26 0.00 0.00 58.87 56.30 3fq8 n SER 2218Cb 0.48 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 3fq8 n SER 2218CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fq8 n GLY 2219N -0.26 -0.28 3.68 5.00 0.00 -0.92 -4.82 105.19 107.59 3fq8 n GLY 2219Ca 0.13 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.89 3fq8 n GLY 2219CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3fq8 s PHE 2220N -1.31 3.42 -0.07 1.61 5.36 -1.26 -3.54 117.98 122.18 3fq8 s PHE 2220Ca 0.00 1.50 -0.03 0.00 -0.96 0.00 0.00 56.93 57.44 3fq8 s PHE 2220Cb 0.00 -3.25 0.04 0.00 -0.34 0.00 0.00 43.02 39.48 3fq8 s PHE 2220CO 0.00 -0.48 0.14 0.42 -1.46 0.00 0.00 175.22 173.84 3fq8 s ILE 2221N 2.27 -0.22 0.22 3.12 1.01 -0.70 -4.87 121.20 122.03 3fq8 s ILE 2221Ca 0.49 0.35 -0.07 0.00 0.00 0.00 0.00 60.65 61.42 3fq8 s ILE 2221Cb -0.19 -0.26 -0.06 0.00 0.01 0.00 0.00 42.46 41.96 3fq8 s ILE 2221CO 0.17 0.15 0.50 -0.69 0.00 0.00 0.00 174.94 175.06 3fq8 s VAL 2222N 2.15 5.02 0.30 2.92 1.01 -1.26 -0.40 120.40 130.14 3fq8 s VAL 2222Ca 0.02 0.24 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 3fq8 s VAL 2222Cb -0.12 -3.65 -0.10 0.00 0.00 0.00 0.00 36.38 32.52 3fq8 s VAL 2222CO -0.05 -0.10 1.12 -2.16 0.00 0.00 0.00 175.10 173.91 3fq8 s PRO 2223N -2.96 4.55 0.96 2.72 0.04 -1.26 -4.96 135.00 134.09 3fq8 s PRO 2223Ca 0.45 1.84 -0.11 0.00 0.04 0.00 0.00 61.00 63.21 3fq8 s PRO 2223Cb -0.11 -3.11 0.17 0.00 0.04 0.00 0.00 34.50 31.48 3fq8 s PRO 2223CO 0.24 0.12 1.09 -0.51 0.04 0.00 0.00 177.00 177.98 3fq8 s ASP 2224N -0.88 2.77 0.22 6.66 1.01 -1.26 -4.88 116.67 120.30 3fq8 s ASP 2224Ca 0.46 1.73 -0.32 0.00 0.71 0.00 0.00 52.55 55.13 3fq8 s ASP 2224Cb -0.32 -2.35 -0.12 0.00 1.01 0.00 0.00 42.92 41.14 3fq8 s ASP 2224CO 0.42 -3.12 1.71 0.00 0.21 0.00 0.00 175.17 174.38 3fq8 n ALA 2225N -4.22 2.80 -0.12 5.23 0.00 -1.26 -1.93 120.51 121.01 3fq8 n ALA 2225Ca 0.08 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3fq8 n ALA 2225Cb 0.54 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.47 3fq8 n ALA 2225CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fq8 n GLY 2226N 3.71 2.23 0.21 0.00 0.00 -1.26 -4.93 105.19 105.15 3fq8 n GLY 2226Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 3fq8 n GLY 2226CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3fq8 h PHE 2227N 0.00 -0.43 -0.73 1.61 3.57 -1.73 0.75 116.94 119.99 3fq8 h PHE 2227Ca 0.00 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 3fq8 h PHE 2227Cb 0.00 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 3fq8 h PHE 2227CO 0.00 -0.11 0.39 -0.07 -2.23 0.00 0.00 178.31 176.28 3fq8 h LEU 2228N -0.75 0.92 -0.42 0.59 3.38 -1.92 -1.55 115.31 115.56 3fq8 h LEU 2228Ca -0.05 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3fq8 h LEU 2228Cb 0.51 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3fq8 h LEU 2228CO 0.08 0.76 0.27 -0.33 0.09 0.00 0.00 178.44 179.31 3fq8 h GLU 2229N 1.01 0.55 -0.41 1.13 3.07 -1.93 -1.87 114.58 116.14 3fq8 h GLU 2229Ca 0.25 -0.04 0.01 0.00 -0.50 0.00 0.00 59.36 59.09 3fq8 h GLU 2229Cb 0.06 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.82 3fq8 h GLU 2229CO -0.04 0.37 0.25 0.78 -1.40 0.00 0.00 179.01 178.97 3fq8 h GLY 2230N 0.57 0.57 0.87 -3.84 0.00 -0.42 -0.55 103.07 100.27 3fq8 h GLY 2230Ca 0.15 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.33 3fq8 h GLY 2230CO -0.03 0.17 0.61 1.41 0.00 0.00 0.00 176.54 178.70 3fq8 h LEU 2231N 0.50 1.02 -0.27 3.11 3.38 -1.04 0.04 115.31 122.04 3fq8 h LEU 2231Ca 0.16 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3fq8 h LEU 2231Cb -0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3fq8 h LEU 2231CO -0.06 0.69 0.13 -0.09 0.09 0.00 0.00 178.44 179.20 3fq8 h ARG 2232N 1.18 0.40 0.37 1.13 9.65 -0.73 -1.58 114.38 124.80 3fq8 h ARG 2232Ca 0.38 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 59.19 3fq8 h ARG 2232Cb 0.01 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.51 3fq8 h ARG 2232CO -0.12 0.39 -0.27 1.49 2.80 0.00 0.00 179.97 184.26 3fq8 h GLU 2233N 0.31 -0.61 -0.36 0.20 4.81 -0.24 -2.22 114.58 116.46 3fq8 h GLU 2233Ca 0.09 0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.28 3fq8 h GLU 2233Cb 0.13 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3fq8 h GLU 2233CO -0.01 -0.41 -0.12 -0.84 -0.73 0.00 0.00 179.01 176.90 3fq8 h ILE 2234N -0.63 1.25 -0.75 2.32 3.07 -0.98 -0.78 117.51 120.99 3fq8 h ILE 2234Ca -0.03 -1.11 -0.06 0.00 1.55 0.00 0.00 64.86 65.21 3fq8 h ILE 2234Cb 0.54 1.11 -0.03 0.00 -0.27 0.00 0.00 36.82 38.16 3fq8 h ILE 2234CO 0.01 0.37 0.25 0.71 -1.05 0.00 0.00 178.15 178.44 3fq8 h THR 2235N 0.58 1.26 -0.69 0.16 1.35 -1.24 -1.60 112.91 112.73 3fq8 h THR 2235Ca 0.10 -0.90 -0.05 0.00 -0.55 0.00 0.00 66.41 65.02 3fq8 h THR 2235Cb 0.55 0.42 -0.03 0.00 -1.73 0.00 0.00 68.15 67.36 3fq8 h THR 2235CO 0.03 0.36 0.24 -0.07 -0.25 0.00 0.00 175.52 175.83 3fq8 h LEU 2236N 1.12 0.98 -0.58 3.87 3.38 -0.97 0.41 115.31 123.51 3fq8 h LEU 2236Ca 0.25 -0.20 0.06 0.00 0.09 0.00 0.00 57.88 58.08 3fq8 h LEU 2236Cb 0.29 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 3fq8 h LEU 2236CO -0.01 0.91 0.28 -0.08 0.09 0.00 0.00 178.44 179.64 3fq8 h GLU 2237N 1.00 0.51 -0.66 1.13 4.81 -0.38 -2.43 114.58 118.56 3fq8 h GLU 2237Ca 0.22 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.38 3fq8 h GLU 2237Cb 0.27 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 3fq8 h GLU 2237CO -0.01 0.34 0.05 0.72 -0.73 0.00 0.00 179.01 179.38 3fq8 n HIS 2238N -4.88 1.93 -3.47 0.92 8.25 -0.68 -4.92 115.22 112.37 3fq8 n HIS 2238Ca 0.07 -0.74 -0.25 0.00 -0.26 0.00 0.00 57.72 56.54 3fq8 n HIS 2238Cb 0.18 -0.51 0.01 0.00 1.12 0.00 0.00 29.99 30.80 3fq8 n HIS 2238CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3fq8 n ASP 2239N 0.42 -4.48 -4.81 0.41 8.00 -0.79 -4.96 116.55 110.34 3fq8 n ASP 2239Ca 0.27 -0.49 -0.22 0.00 0.71 0.00 0.00 54.79 55.06 3fq8 n ASP 2239Cb 1.13 -3.64 -0.04 0.00 -0.02 0.00 0.00 41.12 38.55 3fq8 n ASP 2239CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fq8 s ALA 2240N -3.09 3.58 0.22 2.24 0.00 0.14 -5.01 121.76 119.84 3fq8 s ALA 2240Ca 0.46 -1.47 -0.11 0.00 0.00 0.00 0.00 51.96 50.85 3fq8 s ALA 2240Cb -0.24 -1.24 -0.07 0.00 0.00 0.00 0.00 23.12 21.57 3fq8 s ALA 2240CO 0.57 0.22 0.57 -0.51 0.00 0.00 0.00 175.76 176.62 3fq8 s LEU 2241N -3.85 4.20 -0.23 0.00 1.02 -0.34 -4.18 118.68 115.31 3fq8 s LEU 2241Ca 0.34 1.00 -0.04 0.00 0.02 0.00 0.00 54.13 55.45 3fq8 s LEU 2241Cb -0.07 -3.63 -0.00 0.00 0.02 0.00 0.00 46.19 42.50 3fq8 s LEU 2241CO 0.25 -0.05 -0.03 -0.22 0.02 0.00 0.00 176.35 176.32 3fq8 s LEU 2242N -2.63 3.01 -0.14 1.79 2.96 -1.26 -0.18 118.68 122.22 3fq8 s LEU 2242Ca 0.46 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.93 3fq8 s LEU 2242Cb -0.12 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.83 3fq8 s LEU 2242CO 0.20 -0.04 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.30 3fq8 s VAL 2243N 1.47 2.28 -0.24 1.68 1.01 0.12 -0.62 120.40 126.10 3fq8 s VAL 2243Ca 0.05 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 3fq8 s VAL 2243Cb -0.15 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 3fq8 s VAL 2243CO -0.03 0.54 0.17 -0.36 0.00 0.00 0.00 175.10 175.42 3fq8 s PHE 2244N 0.76 3.32 -0.67 5.22 0.40 -0.49 -1.82 117.98 124.70 3fq8 s PHE 2244Ca -0.08 0.25 -0.19 0.00 -0.60 0.00 0.00 56.93 56.31 3fq8 s PHE 2244Cb -0.16 -2.28 0.12 0.00 0.51 0.00 0.00 43.02 41.21 3fq8 s PHE 2244CO -0.00 0.06 0.80 0.34 0.70 0.00 0.00 175.22 177.13 3fq8 s ASP 2245N 1.05 6.31 -0.48 1.36 -1.08 0.41 -1.49 116.67 122.75 3fq8 s ASP 2245Ca 0.08 -1.60 0.03 0.00 -0.52 0.00 0.00 52.55 50.54 3fq8 s ASP 2245Cb -0.14 -2.32 0.49 0.00 -1.46 0.00 0.00 42.92 39.49 3fq8 s ASP 2245CO 0.05 -1.09 1.70 -0.62 0.52 0.00 0.00 175.17 175.72 3fq8 n GLU 2246N 6.29 2.77 -0.28 4.34 1.02 -0.34 -4.29 120.64 130.14 3fq8 n GLU 2246Ca -0.02 -3.49 -0.05 0.00 -0.02 0.00 0.00 57.16 53.58 3fq8 n GLU 2246Cb 0.44 -2.20 0.06 0.00 -0.02 0.00 0.00 31.44 29.72 3fq8 n GLU 2246CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3fq8 h VAL 2247N 1.33 1.25 0.00 2.62 2.07 -1.84 0.33 116.25 122.01 3fq8 h VAL 2247Ca 0.49 -0.68 -0.17 0.00 0.82 0.00 0.00 66.70 67.15 3fq8 h VAL 2247Cb 1.37 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 3fq8 h VAL 2247CO 1.12 0.29 -1.00 0.40 0.02 0.00 0.00 177.57 178.40 3fq8 h ILE 2248N 1.10 0.84 0.00 4.57 2.04 -1.89 -3.35 117.51 120.82 3fq8 h ILE 2248Ca 0.27 -1.99 -0.07 0.00 1.00 0.00 0.00 64.86 64.07 3fq8 h ILE 2248Cb 0.11 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 3fq8 h ILE 2248CO -0.03 0.28 -0.32 0.71 0.00 0.00 0.00 178.15 178.79 3fq8 h THR 2249N -1.00 1.03 -2.07 -0.27 1.35 -1.85 -3.41 112.91 106.68 3fq8 h THR 2249Ca -0.26 -1.18 -0.61 0.00 -0.55 0.00 0.00 66.41 63.81 3fq8 h THR 2249Cb 1.13 1.67 0.04 0.00 -1.73 0.00 0.00 68.15 69.26 3fq8 h THR 2249CO -0.15 0.31 0.91 0.61 -0.25 0.00 0.00 175.52 176.95 3fq8 n GLY 2250N -0.35 1.20 3.20 5.82 0.00 0.12 -1.20 105.19 113.98 3fq8 n GLY 2250Ca -0.01 0.77 0.00 0.00 0.00 0.00 0.00 46.02 46.77 3fq8 n GLY 2250CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3fq8 n PHE 2251N 4.88 0.00 -0.05 1.61 3.01 -1.12 -4.75 117.46 121.03 3fq8 n PHE 2251Ca 0.20 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.54 3fq8 n PHE 2251Cb 0.27 -1.06 -0.04 0.00 -0.01 0.00 0.00 39.48 38.65 3fq8 n PHE 2251CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3fq8 n ARG 2252N -1.38 0.28 0.10 -1.08 0.63 -0.34 -4.62 116.66 110.25 3fq8 n ARG 2252Ca 0.00 0.12 0.01 0.00 -0.92 0.00 0.00 57.85 57.06 3fq8 n ARG 2252Cb 0.13 -0.97 0.33 0.00 0.45 0.00 0.00 32.46 32.40 3fq8 n ARG 2252CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 3fq8 h ILE 2253N -0.48 1.22 -1.76 5.15 1.08 -1.65 -3.37 117.51 117.70 3fq8 h ILE 2253Ca -0.25 -1.02 0.24 0.00 -0.39 0.00 0.00 64.86 63.44 3fq8 h ILE 2253Cb 1.09 1.34 -0.14 0.00 -3.07 0.00 0.00 36.82 36.04 3fq8 h ILE 2253CO -0.15 0.31 0.71 0.00 -0.69 0.00 0.00 178.15 178.33 3fq8 s ALA 2254N -4.56 -2.01 0.39 1.87 0.00 -1.26 -4.69 121.76 111.49 3fq8 s ALA 2254Ca -0.05 0.88 0.07 0.00 0.00 0.00 0.00 51.96 52.86 3fq8 s ALA 2254Cb 0.15 0.29 0.81 0.00 0.00 0.00 0.00 23.12 24.37 3fq8 s ALA 2254CO 0.75 -0.87 1.99 -0.92 0.00 0.00 0.00 175.76 176.71 3fq8 h TYR 2255N 2.00 0.65 -0.60 0.00 3.20 -1.89 0.62 116.97 120.93 3fq8 h TYR 2255Ca -0.22 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.67 3fq8 h TYR 2255Cb 1.20 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.26 3fq8 h TYR 2255CO 0.31 0.36 0.00 0.41 -1.64 0.00 0.00 178.16 177.60 3fq8 n GLY 2256N -1.47 2.40 6.53 1.82 0.00 -1.26 -4.15 105.19 109.07 3fq8 n GLY 2256Ca 0.08 -0.76 0.01 0.00 0.00 0.00 0.00 46.02 45.35 3fq8 n GLY 2256CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fq8 n GLY 2257N 1.15 -1.46 0.33 -0.02 0.00 0.19 -2.98 105.19 102.41 3fq8 n GLY 2257Ca 0.23 -1.18 -0.03 0.00 0.00 0.00 0.00 46.02 45.04 3fq8 n GLY 2257CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3fq8 h VAL 2258N -0.06 1.21 -0.85 1.61 2.07 -1.87 -1.79 116.25 116.58 3fq8 h VAL 2258Ca 0.00 -0.40 0.12 0.00 0.82 0.00 0.00 66.70 67.24 3fq8 h VAL 2258Cb 0.06 -0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 29.72 3fq8 h VAL 2258CO 0.00 0.21 0.55 0.06 0.02 0.00 0.00 177.57 178.41 3fq8 h GLN 2259N 1.16 0.69 0.00 1.57 3.07 -1.77 0.64 115.11 120.47 3fq8 h GLN 2259Ca 0.32 -0.04 -0.02 0.00 0.09 0.00 0.00 58.65 58.99 3fq8 h GLN 2259Cb -0.12 -0.16 0.00 0.00 0.08 0.00 0.00 27.48 27.29 3fq8 h GLN 2259CO -0.07 0.46 -0.10 1.49 0.09 0.00 0.00 178.83 180.70 3fq8 h GLU 2260N 0.71 0.06 -0.85 0.06 4.81 -1.32 -1.75 114.58 116.31 3fq8 h GLU 2260Ca 0.41 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.55 3fq8 h GLU 2260Cb 0.59 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.95 3fq8 h GLU 2260CO -0.17 0.85 0.48 -0.22 -0.73 0.00 0.00 179.01 179.22 3fq8 h LYS 2261N -0.70 1.18 -0.10 1.92 3.64 -0.81 -2.84 116.57 118.87 3fq8 h LYS 2261Ca -0.01 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 3fq8 h LYS 2261Cb 0.89 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 3fq8 h LYS 2261CO 0.02 0.86 0.00 1.19 -2.27 0.00 0.00 179.45 179.25 3fq8 n PHE 2262N -4.39 0.10 -3.26 1.91 0.99 0.17 -4.99 117.46 108.01 3fq8 n PHE 2262Ca 0.09 -0.05 -0.20 0.00 -0.00 0.00 0.00 57.45 57.28 3fq8 n PHE 2262Cb 0.09 0.00 0.06 0.00 -1.00 0.00 0.00 39.48 38.62 3fq8 n PHE 2262CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3fq8 n GLY 2263N 1.28 -0.36 2.96 1.37 0.00 -0.85 -5.01 105.19 104.58 3fq8 n GLY 2263Ca 0.17 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 3fq8 n GLY 2263CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fq8 s VAL 2264N -3.21 1.31 -0.34 1.61 1.01 -0.72 -5.04 120.40 115.02 3fq8 s VAL 2264Ca 0.42 -0.53 -0.16 0.00 0.00 0.00 0.00 61.98 61.72 3fq8 s VAL 2264Cb -0.19 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 3fq8 s VAL 2264CO 0.52 0.36 0.38 -0.89 0.00 0.00 0.00 175.10 175.47 3fq8 s THR 2265N 1.58 5.15 0.90 3.92 2.01 -1.26 -4.41 115.64 123.53 3fq8 s THR 2265Ca 0.04 0.09 -0.13 0.00 0.31 0.00 0.00 61.69 62.00 3fq8 s THR 2265Cb -0.13 -3.84 0.20 0.00 0.01 0.00 0.00 72.50 68.74 3fq8 s THR 2265CO -0.09 -0.10 1.22 -0.81 -0.69 0.00 0.00 174.62 174.15 3fq8 n PRO 2266N 5.43 -1.02 -0.00 4.92 -0.04 -1.26 -5.00 135.00 138.02 3fq8 n PRO 2266Ca -0.09 -2.13 -0.01 0.00 -0.04 0.00 0.00 63.50 61.23 3fq8 n PRO 2266Cb 0.49 -1.18 -0.11 0.00 -0.04 0.00 0.00 33.50 32.66 3fq8 n PRO 2266CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3fq8 n ASP 2267N -3.64 0.59 -3.80 3.54 9.92 0.21 -4.67 116.55 118.70 3fq8 n ASP 2267Ca 0.16 0.26 -0.13 0.00 -0.53 0.00 0.00 54.79 54.56 3fq8 n ASP 2267Cb 0.56 0.53 -0.09 0.00 -0.64 0.00 0.00 41.12 41.48 3fq8 n ASP 2267CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3fq8 s LEU 2268N -5.59 1.11 -0.06 0.64 1.02 -1.17 -1.87 118.68 112.76 3fq8 s LEU 2268Ca -0.05 -0.02 -0.11 0.00 0.02 0.00 0.00 54.13 53.98 3fq8 s LEU 2268Cb 0.09 1.05 0.02 0.00 0.02 0.00 0.00 46.19 47.37 3fq8 s LEU 2268CO 0.83 -0.42 0.26 0.42 0.02 0.00 0.00 176.35 177.46 3fq8 s THR 2269N -1.34 0.03 0.04 5.49 -4.23 -0.03 -1.40 115.64 114.21 3fq8 s THR 2269Ca -0.14 -0.26 0.00 0.00 -1.18 0.00 0.00 61.69 60.11 3fq8 s THR 2269Cb -0.06 -0.46 -0.04 0.00 1.34 0.00 0.00 72.50 73.28 3fq8 s THR 2269CO 0.03 -0.15 0.13 0.42 -0.54 0.00 0.00 174.62 174.52 3fq8 s THR 2270N -0.56 4.94 0.19 3.99 -4.23 -0.56 -1.88 115.64 117.54 3fq8 s THR 2270Ca -0.07 -0.48 0.04 0.00 -1.18 0.00 0.00 61.69 60.01 3fq8 s THR 2270Cb -0.04 -3.34 -0.05 0.00 1.34 0.00 0.00 72.50 70.41 3fq8 s THR 2270CO 0.02 0.23 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.52 3fq8 s LEU 2271N -2.16 2.32 0.00 4.79 1.43 0.28 -1.20 118.68 124.14 3fq8 s LEU 2271Ca 0.29 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 3fq8 s LEU 2271Cb -0.12 -0.28 0.00 0.00 0.03 0.00 0.00 46.19 45.81 3fq8 s LEU 2271CO 0.21 -0.44 0.00 0.61 0.23 0.00 0.00 176.35 176.95 3fq8 n GLY 2272N -0.31 1.24 6.62 -3.19 0.00 -1.25 -1.49 105.19 106.80 3fq8 n GLY 2272Ca -0.07 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3fq8 n GLY 2272CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fq8 n LYS 2273N 0.00 0.00 -0.33 1.61 5.02 -1.24 -2.26 118.16 120.96 3fq8 n LYS 2273Ca 0.00 0.00 0.19 0.00 -2.02 0.00 0.00 58.31 56.48 3fq8 n LYS 2273Cb 0.00 0.00 0.43 0.00 -0.02 0.00 0.00 35.03 35.44 3fq8 n LYS 2273CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3fq8 h ILE 2274N 0.00 0.57 0.00 -0.18 2.04 -1.79 0.77 117.51 118.91 3fq8 h ILE 2274Ca 0.00 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.68 3fq8 h ILE 2274Cb 0.00 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.06 3fq8 h ILE 2274CO 0.00 0.10 0.00 2.30 0.00 0.00 0.00 178.15 180.55 3fq8 n ILE 2275N -4.75 1.29 1.00 -0.67 -5.35 -0.96 -1.08 119.36 108.85 3fq8 n ILE 2275Ca 0.25 0.51 0.10 0.00 -0.27 0.00 0.00 62.75 63.35 3fq8 n ILE 2275Cb 0.76 -1.47 -0.06 0.00 -1.74 0.00 0.00 39.64 37.13 3fq8 n ILE 2275CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fq8 n GLY 2276N -0.96 -0.72 2.41 3.28 0.00 0.26 -3.55 105.19 105.90 3fq8 n GLY 2276Ca 0.00 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.26 3fq8 n GLY 2276CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fq8 n GLY 2277N 1.48 1.54 0.00 -0.02 0.00 -0.24 -1.22 105.19 106.72 3fq8 n GLY 2277Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3fq8 n GLY 2277CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fq8 n GLY 2278N -0.22 1.63 3.85 -0.02 0.00 -1.26 -4.93 105.19 104.24 3fq8 n GLY 2278Ca -0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 3fq8 n GLY 2278CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fq8 s LEU 2279N 0.00 3.92 -0.32 0.99 1.02 -0.36 -5.03 118.68 118.90 3fq8 s LEU 2279Ca 0.00 -0.16 -0.28 0.00 0.02 0.00 0.00 54.13 53.71 3fq8 s LEU 2279Cb 0.00 -2.47 -0.04 0.00 0.02 0.00 0.00 46.19 43.71 3fq8 s LEU 2279CO 0.00 -0.03 2.03 -2.84 0.02 0.00 0.00 176.35 175.53 3fq8 s PRO 2280N -3.77 3.08 -0.12 1.29 0.02 -1.26 -4.45 135.00 129.80 3fq8 s PRO 2280Ca 0.33 1.61 -0.11 0.00 0.02 0.00 0.00 61.00 62.85 3fq8 s PRO 2280Cb -0.08 -4.32 0.03 0.00 0.02 0.00 0.00 34.50 30.15 3fq8 s PRO 2280CO 0.26 -2.16 0.31 0.08 -0.33 0.00 0.00 177.00 175.16 3fq8 s VAL 2281N 8.13 0.00 0.23 3.83 1.01 -1.20 -4.73 120.40 127.67 3fq8 s VAL 2281Ca 0.89 -0.00 -0.06 0.00 0.00 0.00 0.00 61.98 62.81 3fq8 s VAL 2281Cb -0.25 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 3fq8 s VAL 2281CO 0.33 -0.00 0.31 -0.83 0.00 0.00 0.00 175.10 174.90 3fq8 s GLY 2282N 0.16 1.08 -0.11 4.51 0.00 -0.60 -3.60 107.32 108.76 3fq8 s GLY 2282Ca -0.00 -1.34 -0.31 0.00 0.00 0.00 0.00 44.72 43.07 3fq8 s GLY 2282CO 0.00 -1.04 1.01 0.00 0.00 0.00 0.00 173.10 173.07 3fq8 s ALA 2283N -4.01 -1.93 -0.02 3.20 0.00 -0.56 0.03 121.76 118.47 3fq8 s ALA 2283Ca 0.31 1.39 -0.02 0.00 0.00 0.00 0.00 51.96 53.64 3fq8 s ALA 2283Cb 0.03 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.95 3fq8 s ALA 2283CO 0.12 -0.51 0.05 1.52 0.00 0.00 0.00 175.76 176.94 3fq8 s TYR 2284N -2.12 -0.05 0.35 0.00 -0.85 -0.81 0.99 117.35 114.85 3fq8 s TYR 2284Ca 0.03 0.12 -0.17 0.00 -0.52 0.00 0.00 57.07 56.53 3fq8 s TYR 2284Cb -0.01 0.01 0.06 0.00 0.38 0.00 0.00 41.96 42.40 3fq8 s TYR 2284CO -0.04 -0.04 0.84 0.20 -1.52 0.00 0.00 175.55 175.00 3fq8 s GLY 2285N -0.05 0.34 0.00 5.49 0.00 -0.79 -1.37 107.32 110.95 3fq8 s GLY 2285Ca -0.01 -0.69 0.00 0.00 0.00 0.00 0.00 44.72 44.02 3fq8 s GLY 2285CO 0.00 0.27 0.00 0.61 0.00 0.00 0.00 173.10 173.98 3fq8 n GLY 2286N -0.57 -0.57 3.66 0.20 0.00 -1.03 -0.85 105.19 106.03 3fq8 n GLY 2286Ca -0.07 -0.61 -0.46 0.00 0.00 0.00 0.00 46.02 44.88 3fq8 n GLY 2286CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fq8 n LYS 2287N 0.00 2.00 -0.20 1.61 5.02 -0.78 -1.40 118.16 124.40 3fq8 n LYS 2287Ca 0.00 0.72 0.01 0.00 -2.02 0.00 0.00 58.31 57.02 3fq8 n LYS 2287Cb 0.00 -2.41 0.11 0.00 -0.02 0.00 0.00 35.03 32.72 3fq8 n LYS 2287CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3fq8 h ARG 2288N 4.80 0.18 -0.25 1.97 2.43 -1.90 -1.70 114.38 119.89 3fq8 h ARG 2288Ca -0.45 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3fq8 h ARG 2288Cb 1.27 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 3fq8 h ARG 2288CO 0.80 0.12 0.17 1.05 -1.51 0.00 0.00 179.97 180.60 3fq8 h GLU 2289N 0.18 0.33 0.06 0.20 9.09 -2.00 -1.37 114.58 121.07 3fq8 h GLU 2289Ca 0.33 -0.02 -0.14 0.00 0.05 0.00 0.00 59.36 59.58 3fq8 h GLU 2289Cb 0.52 -0.07 0.01 0.00 -1.65 0.00 0.00 28.75 27.56 3fq8 h GLU 2289CO -0.48 0.22 -0.60 0.82 0.05 0.00 0.00 179.01 179.02 3fq8 h ILE 2290N 0.34 1.52 0.00 -1.06 2.04 -1.73 -3.20 117.51 115.41 3fq8 h ILE 2290Ca 0.09 -2.29 0.00 0.00 1.00 0.00 0.00 64.86 63.66 3fq8 h ILE 2290Cb -0.03 2.97 0.00 0.00 -0.74 0.00 0.00 36.82 39.02 3fq8 h ILE 2290CO -0.02 0.65 0.00 0.24 0.00 0.00 0.00 178.15 179.02 3fq8 h MET 2291N -0.36 0.00 0.00 2.37 2.86 -1.03 -2.14 114.93 116.63 3fq8 h MET 2291Ca -0.09 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 3fq8 h MET 2291Cb 1.39 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.05 3fq8 h MET 2291CO 0.11 0.00 -0.01 0.37 1.06 0.00 0.00 176.91 178.45 3fq8 h GLN 2292N 0.00 0.00 0.00 1.72 5.75 -1.25 -1.93 115.11 119.40 3fq8 h GLN 2292Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3fq8 h GLN 2292Cb 0.14 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.69 3fq8 h GLN 2292CO 0.00 0.01 0.00 -0.07 -2.65 0.00 0.00 178.83 176.12 3fq8 h LEU 2293N 0.00 0.00 -9.64 -2.39 4.07 -1.57 -2.84 115.31 102.95 3fq8 h LEU 2293Ca -0.00 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.44 3fq8 h LEU 2293Cb 0.04 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.80 3fq8 h LEU 2293CO 0.00 0.00 0.56 -0.69 -1.08 0.00 0.00 178.44 177.23 3fq8 s VAL 2294N -3.17 3.62 0.57 1.22 1.01 -0.73 -1.09 120.40 121.82 3fq8 s VAL 2294Ca 0.09 1.33 -0.19 0.00 0.00 0.00 0.00 61.98 63.21 3fq8 s VAL 2294Cb 0.11 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 3fq8 s VAL 2294CO 0.56 0.20 1.18 0.00 0.00 0.00 0.00 175.10 177.03 3fq8 s ALA 2295N 0.09 2.63 -2.06 5.51 0.00 -0.30 -0.47 121.76 127.15 3fq8 s ALA 2295Ca 0.54 0.94 0.13 0.00 0.00 0.00 0.00 51.96 53.56 3fq8 s ALA 2295Cb -0.32 -3.41 0.58 0.00 0.00 0.00 0.00 23.12 19.97 3fq8 s ALA 2295CO 0.36 -0.99 1.40 -0.35 0.00 0.00 0.00 175.76 176.18 3fq8 n PRO 2296N -1.42 1.32 0.08 0.00 -0.04 -1.26 -4.78 135.00 128.91 3fq8 n PRO 2296Ca 0.13 -0.49 -0.06 0.00 -0.04 0.00 0.00 63.50 63.04 3fq8 n PRO 2296Cb 0.50 -1.23 -0.03 0.00 -0.04 0.00 0.00 33.50 32.69 3fq8 n PRO 2296CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fq8 h ALA 2297N 3.55 0.52 -4.77 0.55 0.00 -1.38 -3.47 119.26 114.25 3fq8 h ALA 2297Ca 0.00 -0.80 -0.48 0.00 0.00 0.00 0.00 54.91 53.64 3fq8 h ALA 2297Cb 0.20 -0.13 -0.11 0.00 0.00 0.00 0.00 17.79 17.74 3fq8 h ALA 2297CO 0.00 1.08 -0.43 0.41 0.00 0.00 0.00 179.25 180.31 3fq8 n GLY 2298N 1.02 3.16 0.24 0.00 0.00 0.38 -4.83 105.19 105.16 3fq8 n GLY 2298Ca -0.01 -1.99 0.15 0.00 0.00 0.00 0.00 46.02 44.17 3fq8 n GLY 2298CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fq8 h PRO 2299N 0.00 0.00 -6.38 1.61 0.13 -1.77 -3.03 132.00 122.56 3fq8 h PRO 2299Ca -0.25 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.31 3fq8 h PRO 2299Cb 1.11 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 3fq8 h PRO 2299CO 0.39 0.00 1.06 1.41 -0.23 0.00 0.00 178.00 180.63 3fq8 s MET 2300N -3.44 3.75 0.10 0.86 1.75 -0.25 -4.84 119.30 117.23 3fq8 s MET 2300Ca 0.04 1.26 -0.26 0.00 -1.25 0.00 0.00 55.69 55.48 3fq8 s MET 2300Cb 0.07 -3.98 -0.06 0.00 2.84 0.00 0.00 34.83 33.70 3fq8 s MET 2300CO 0.59 -1.34 0.82 -0.47 -0.65 0.00 0.00 175.02 173.98 3fq8 s TYR 2301N 5.03 3.81 -0.29 4.11 5.04 -1.26 -1.15 117.35 132.64 3fq8 s TYR 2301Ca 0.63 1.61 -0.15 0.00 -2.44 0.00 0.00 57.07 56.71 3fq8 s TYR 2301Cb -0.18 -2.87 0.11 0.00 0.35 0.00 0.00 41.96 39.37 3fq8 s TYR 2301CO 0.28 0.32 0.79 -1.14 -1.34 0.00 0.00 175.55 174.47 3fq8 s GLN 2302N -0.35 0.57 0.22 4.97 -0.44 -1.26 -4.98 119.66 118.39 3fq8 s GLN 2302Ca 0.40 1.04 -0.04 0.00 -2.50 0.00 0.00 55.36 54.26 3fq8 s GLN 2302Cb -0.22 0.22 -0.03 0.00 -1.64 0.00 0.00 33.01 31.34 3fq8 s GLN 2302CO 0.26 -0.13 0.24 0.00 0.50 0.00 0.00 175.29 176.16 3fq8 s ALA 2303N 1.73 0.82 -0.30 1.58 0.00 -1.26 -4.83 121.76 119.50 3fq8 s ALA 2303Ca -0.09 -1.50 -0.14 0.00 0.00 0.00 0.00 51.96 50.23 3fq8 s ALA 2303Cb -0.05 1.30 0.17 0.00 0.00 0.00 0.00 23.12 24.54 3fq8 s ALA 2303CO -0.18 -0.67 1.01 0.20 0.00 0.00 0.00 175.76 176.12 3fq8 s GLY 2304N -3.14 -0.21 0.16 0.00 0.00 -1.26 -5.04 107.32 97.84 3fq8 s GLY 2304Ca 0.34 3.01 -0.16 0.00 0.00 0.00 0.00 44.72 47.91 3fq8 s GLY 2304CO 0.12 3.37 1.71 -0.84 0.00 0.00 0.00 173.10 177.46 3fq8 h THR 2305N 5.44 0.73 -0.01 0.90 2.02 -2.01 -2.52 112.91 117.47 3fq8 h THR 2305Ca -0.15 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.99 3fq8 h THR 2305Cb 1.13 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 3fq8 h THR 2305CO 0.05 0.02 -0.13 0.18 0.37 0.00 0.00 175.52 176.01 3fq8 n LEU 2306N -5.17 0.97 -4.69 2.58 7.99 -1.26 -4.69 117.00 112.73 3fq8 n LEU 2306Ca 0.02 -0.25 -0.44 0.00 -0.01 0.00 0.00 56.01 55.33 3fq8 n LEU 2306Cb 0.19 -0.10 -0.03 0.00 -0.11 0.00 0.00 43.42 43.38 3fq8 n LEU 2306CO 0.21 0.17 1.14 -1.20 -1.51 0.00 0.00 177.39 176.20 3fq8 n SER 2307N -0.51 3.17 -0.90 -1.43 7.64 -0.95 -1.82 113.62 118.82 3fq8 n SER 2307Ca 0.15 1.12 -0.11 0.00 1.01 0.00 0.00 58.87 61.04 3fq8 n SER 2307Cb 0.32 -1.47 -0.04 0.00 -1.01 0.00 0.00 64.21 62.01 3fq8 n SER 2307CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fq8 n GLY 2308N 2.72 1.02 3.75 0.23 0.00 -1.26 -4.96 105.19 106.69 3fq8 n GLY 2308Ca 0.13 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 3fq8 n GLY 2308CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fq8 s ASN 2309N -2.83 5.25 0.24 1.61 4.22 -0.76 -4.77 114.94 117.91 3fq8 s ASN 2309Ca 0.00 2.45 -0.05 0.00 -2.14 0.00 0.00 52.86 53.12 3fq8 s ASN 2309Cb 0.00 -2.61 0.45 0.00 1.28 0.00 0.00 41.25 40.37 3fq8 s ASN 2309CO 0.00 -1.56 1.71 -0.65 -2.04 0.00 0.00 177.10 174.56 3fq8 h PRO 2310N 1.05 0.33 -0.28 3.55 0.11 -1.90 -1.67 132.00 133.19 3fq8 h PRO 2310Ca -0.50 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 3fq8 h PRO 2310Cb 1.30 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3fq8 h PRO 2310CO 0.56 0.22 0.08 -0.07 -0.21 0.00 0.00 178.00 178.58 3fq8 h LEU 2311N 0.34 0.41 -0.13 2.35 3.38 -1.86 0.93 115.31 120.72 3fq8 h LEU 2311Ca 0.41 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 3fq8 h LEU 2311Cb 0.66 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3fq8 h LEU 2311CO -0.45 0.51 0.07 0.00 0.09 0.00 0.00 178.44 178.66 3fq8 h ALA 2312N 0.92 0.16 -0.21 1.53 0.00 -1.82 -1.35 119.26 118.48 3fq8 h ALA 2312Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fq8 h ALA 2312Cb 0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3fq8 h ALA 2312CO -0.00 -0.31 0.14 0.52 0.00 0.00 0.00 179.25 179.59 3fq8 h MET 2313N 0.13 0.27 -0.33 0.00 2.86 -1.21 -1.11 114.93 115.53 3fq8 h MET 2313Ca 0.05 -0.02 0.07 0.00 -2.06 0.00 0.00 59.70 57.74 3fq8 h MET 2313Cb 0.05 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.59 3fq8 h MET 2313CO -0.01 0.18 -0.09 1.15 1.06 0.00 0.00 176.91 179.21 3fq8 h THR 2314N 0.28 0.66 -0.79 2.22 2.02 -0.62 0.10 112.91 116.79 3fq8 h THR 2314Ca 0.08 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.22 3fq8 h THR 2314Cb -0.03 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.01 3fq8 h THR 2314CO -0.02 0.00 0.34 0.00 0.37 0.00 0.00 175.52 176.21 3fq8 h ALA 2315N 1.32 1.02 -0.39 6.16 0.00 -0.96 -1.94 119.26 124.47 3fq8 h ALA 2315Ca 0.16 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3fq8 h ALA 2315Cb 0.25 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3fq8 h ALA 2315CO -0.34 0.62 -0.05 0.78 0.00 0.00 0.00 179.25 180.26 3fq8 h GLY 2316N 1.13 0.77 0.98 0.00 0.00 -0.60 -1.75 103.07 103.60 3fq8 h GLY 2316Ca 0.27 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3fq8 h GLY 2316CO -0.03 0.55 0.10 -2.22 0.00 0.00 0.00 176.54 174.94 3fq8 h ILE 2317N 0.53 1.02 -0.52 2.60 2.04 -0.62 -1.59 117.51 120.97 3fq8 h ILE 2317Ca 0.10 -0.07 -0.08 0.00 1.00 0.00 0.00 64.86 65.82 3fq8 h ILE 2317Cb 0.54 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 3fq8 h ILE 2317CO 0.03 0.04 0.00 0.50 0.00 0.00 0.00 178.15 178.72 3fq8 h LYS 2318N 0.20 0.87 -0.30 2.37 1.63 -1.32 -0.81 116.57 119.22 3fq8 h LYS 2318Ca 0.06 -0.25 -0.03 0.00 -0.85 0.00 0.00 60.65 59.59 3fq8 h LYS 2318Cb -0.01 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.51 3fq8 h LYS 2318CO -0.02 0.87 0.08 1.15 -3.45 0.00 0.00 179.45 178.07 3fq8 h THR 2319N 0.81 1.21 -0.19 1.00 2.02 -1.11 -0.90 112.91 115.76 3fq8 h THR 2319Ca 0.15 -0.71 -0.09 0.00 0.77 0.00 0.00 66.41 66.54 3fq8 h THR 2319Cb 0.48 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3fq8 h THR 2319CO 0.02 0.24 -0.26 -0.07 0.37 0.00 0.00 175.52 175.82 3fq8 h LEU 2320N 0.32 0.35 -0.56 2.58 4.07 -1.14 -1.69 115.31 119.24 3fq8 h LEU 2320Ca 0.09 -0.11 -0.08 0.00 0.08 0.00 0.00 57.88 57.87 3fq8 h LEU 2320Cb 0.28 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.91 3fq8 h LEU 2320CO 0.00 0.61 0.06 -0.33 -1.08 0.00 0.00 178.44 177.70 3fq8 h GLU 2321N 0.31 0.96 -0.48 1.13 5.08 -0.82 -2.35 114.58 118.40 3fq8 h GLU 2321Ca 0.05 -0.27 -0.06 0.00 -1.00 0.00 0.00 59.36 58.07 3fq8 h GLU 2321Cb 0.63 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 3fq8 h GLU 2321CO 0.05 0.93 0.04 -0.07 -1.00 0.00 0.00 179.01 178.96 3fq8 h LEU 2322N 0.84 0.72 -1.46 1.33 3.38 -0.82 -2.37 115.31 116.95 3fq8 h LEU 2322Ca 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3fq8 h LEU 2322Cb 0.46 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3fq8 h LEU 2322CO 0.02 0.77 0.00 -0.07 0.09 0.00 0.00 178.44 179.24 3fq8 h LEU 2323N 0.73 0.00 -0.51 1.67 3.38 -0.95 -2.81 115.31 116.82 3fq8 h LEU 2323Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3fq8 h LEU 2323Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3fq8 h LEU 2323CO 0.01 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.08 3fq8 n ARG 2324N -2.97 1.35 -1.81 1.13 1.74 -0.89 -4.73 116.66 110.49 3fq8 n ARG 2324Ca 0.01 -0.51 -0.32 0.00 -0.77 0.00 0.00 57.85 56.25 3fq8 n ARG 2324Cb 0.28 -1.47 0.03 0.00 -1.02 0.00 0.00 32.46 30.28 3fq8 n ARG 2324CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3fq8 s GLN 2325N -1.99 3.10 0.23 5.56 -1.52 -1.06 -4.97 119.66 119.02 3fq8 s GLN 2325Ca 0.41 1.10 -0.31 0.00 -1.95 0.00 0.00 55.36 54.61 3fq8 s GLN 2325Cb 0.21 -2.01 -0.14 0.00 -0.22 0.00 0.00 33.01 30.86 3fq8 s GLN 2325CO 0.34 -0.98 1.40 -2.30 -0.25 0.00 0.00 175.29 173.50 3fq8 n PRO 2326N -2.56 1.98 -0.88 2.91 -0.02 -1.26 -3.27 135.00 131.90 3fq8 n PRO 2326Ca 0.08 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3fq8 n PRO 2326Cb 0.53 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 3fq8 n PRO 2326CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fq8 n GLY 2327N 2.18 0.48 0.24 -1.23 0.00 -1.26 -4.96 105.19 100.65 3fq8 n GLY 2327Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.06 3fq8 n GLY 2327CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3fq8 h THR 2328N 0.00 0.00 0.00 2.61 2.02 -1.84 -0.02 112.91 115.68 3fq8 h THR 2328Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 3fq8 h THR 2328Cb 0.16 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.56 3fq8 h THR 2328CO 0.00 0.00 -0.31 1.88 0.37 0.00 0.00 175.52 177.46 3fq8 h TYR 2329N -0.30 0.00 -0.46 3.16 -1.99 -1.89 -2.37 116.97 113.12 3fq8 h TYR 2329Ca 0.02 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.65 3fq8 h TYR 2329Cb 0.35 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.07 3fq8 h TYR 2329CO -0.51 0.31 -0.09 0.93 -0.00 0.00 0.00 178.16 178.80 3fq8 h GLU 2330N 0.00 0.87 -0.19 4.88 3.07 -1.93 -1.75 114.58 119.54 3fq8 h GLU 2330Ca -0.00 -0.32 -0.01 0.00 -0.50 0.00 0.00 59.36 58.53 3fq8 h GLU 2330Cb 0.69 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 3fq8 h GLU 2330CO 0.04 0.96 0.09 -0.92 -1.40 0.00 0.00 179.01 177.78 3fq8 h TYR 2331N 0.71 0.27 -0.52 4.33 3.20 -0.67 -0.54 116.97 123.74 3fq8 h TYR 2331Ca 0.12 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.04 3fq8 h TYR 2331Cb 0.63 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.77 3fq8 h TYR 2331CO 0.05 0.28 0.23 -0.07 -1.64 0.00 0.00 178.16 177.01 3fq8 h LEU 2332N 0.18 0.29 -1.10 2.82 3.38 -1.32 -1.50 115.31 118.06 3fq8 h LEU 2332Ca 0.06 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3fq8 h LEU 2332Cb 0.11 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3fq8 h LEU 2332CO -0.01 0.20 -0.08 -0.78 0.09 0.00 0.00 178.44 177.86 3fq8 h ASP 2333N 0.44 0.52 0.24 -0.43 1.82 -1.07 -1.39 116.42 116.55 3fq8 h ASP 2333Ca 0.24 -0.12 -0.01 0.00 -0.39 0.00 0.00 57.03 56.75 3fq8 h ASP 2333Cb 0.21 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.08 3fq8 h ASP 2333CO -0.20 0.65 -0.11 -0.61 -1.61 0.00 0.00 179.24 177.35 3fq8 h GLN 2334N 0.51 -0.31 -0.08 0.28 4.15 -0.14 -0.97 115.11 118.55 3fq8 h GLN 2334Ca 0.10 0.02 -0.17 0.00 0.77 0.00 0.00 58.65 59.37 3fq8 h GLN 2334Cb 0.45 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 3fq8 h GLN 2334CO 0.02 -0.05 -0.69 -0.84 -1.93 0.00 0.00 178.83 175.35 3fq8 h ILE 2335N -0.54 1.38 -0.02 2.39 3.07 -1.31 -2.92 117.51 119.56 3fq8 h ILE 2335Ca -0.03 -2.10 -0.16 0.00 1.55 0.00 0.00 64.86 64.12 3fq8 h ILE 2335Cb 0.40 2.07 -0.02 0.00 -0.27 0.00 0.00 36.82 39.01 3fq8 h ILE 2335CO 0.05 0.63 -0.72 0.74 -1.05 0.00 0.00 178.15 177.80 3fq8 h THR 2336N 0.25 1.47 -0.41 0.16 2.02 -1.28 -1.08 112.91 114.05 3fq8 h THR 2336Ca -0.02 -2.35 -0.12 0.00 0.77 0.00 0.00 66.41 64.69 3fq8 h THR 2336Cb 1.24 2.26 -0.01 0.00 -1.74 0.00 0.00 68.15 69.91 3fq8 h THR 2336CO 0.11 0.68 -0.22 0.50 0.37 0.00 0.00 175.52 176.97 3fq8 h LYS 2337N 0.07 0.87 -0.57 6.66 3.64 -1.19 0.06 116.57 126.10 3fq8 h LYS 2337Ca -0.02 -0.39 -0.09 0.00 -1.27 0.00 0.00 60.65 58.89 3fq8 h LYS 2337Cb 1.27 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 3fq8 h LYS 2337CO 0.10 1.03 0.00 -0.09 -2.27 0.00 0.00 179.45 178.23 3fq8 h ARG 2338N 0.68 1.01 0.39 1.90 2.43 -1.38 0.20 114.38 119.61 3fq8 h ARG 2338Ca 0.09 -0.32 -0.02 0.00 -0.81 0.00 0.00 59.98 58.92 3fq8 h ARG 2338Cb 0.78 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3fq8 h ARG 2338CO 0.06 1.00 -0.19 1.25 -1.51 0.00 0.00 179.97 180.59 3fq8 h LEU 2339N 0.90 -0.44 -0.15 3.80 6.46 -1.07 0.12 115.31 124.92 3fq8 h LEU 2339Ca 0.16 -0.06 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 3fq8 h LEU 2339Cb 0.54 0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.57 3fq8 h LEU 2339CO 0.03 -0.20 0.04 -1.28 -0.62 0.00 0.00 178.44 176.40 3fq8 h SER 2340N -0.67 0.02 -0.59 1.25 0.87 -0.92 -0.09 113.55 113.43 3fq8 h SER 2340Ca -0.05 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 3fq8 h SER 2340Cb 0.48 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.44 3fq8 h SER 2340CO 0.09 0.04 0.35 0.44 -0.53 0.00 0.00 176.83 177.22 3fq8 h ASP 2341N 0.10 0.71 -0.86 6.23 3.32 -0.95 -2.12 116.42 122.86 3fq8 h ASP 2341Ca 0.07 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3fq8 h ASP 2341Cb 0.06 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 3fq8 h ASP 2341CO -0.09 0.56 0.56 1.23 -1.72 0.00 0.00 179.24 179.78 3fq8 h GLY 2342N 0.79 1.22 0.99 2.75 0.00 -0.37 -0.17 103.07 108.28 3fq8 h GLY 2342Ca 0.21 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.07 3fq8 h GLY 2342CO -0.04 0.46 0.23 1.41 0.00 0.00 0.00 176.54 178.60 3fq8 h LEU 2343N 1.17 0.44 -0.42 3.11 4.07 -0.61 -0.92 115.31 122.14 3fq8 h LEU 2343Ca 0.31 -0.04 -0.10 0.00 0.08 0.00 0.00 57.88 58.13 3fq8 h LEU 2343Cb -0.11 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.50 3fq8 h LEU 2343CO -0.07 0.35 -0.12 -0.07 -1.08 0.00 0.00 178.44 177.46 3fq8 h LEU 2344N 0.49 0.83 -0.53 1.67 3.38 -1.07 -1.52 115.31 118.56 3fq8 h LEU 2344Ca 0.13 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.75 3fq8 h LEU 2344Cb -0.01 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 3fq8 h LEU 2344CO -0.03 1.01 0.33 0.00 0.09 0.00 0.00 178.44 179.84 3fq8 h ALA 2345N 0.85 0.67 -0.57 1.53 0.00 -0.82 -1.44 119.26 119.48 3fq8 h ALA 2345Ca 0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3fq8 h ALA 2345Cb 0.65 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3fq8 h ALA 2345CO 0.04 0.05 0.20 0.82 0.00 0.00 0.00 179.25 180.37 3fq8 h ILE 2346N 0.66 1.23 -0.38 0.00 2.04 -1.06 -0.67 117.51 119.33 3fq8 h ILE 2346Ca 0.20 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.33 3fq8 h ILE 2346Cb -0.01 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 3fq8 h ILE 2346CO -0.08 0.29 0.21 0.00 0.00 0.00 0.00 178.15 178.57 3fq8 h ALA 2347N 1.06 0.47 -0.39 1.87 0.00 -0.85 0.06 119.26 121.47 3fq8 h ALA 2347Ca 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3fq8 h ALA 2347Cb 0.24 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3fq8 h ALA 2347CO -0.01 -0.14 0.16 0.37 0.00 0.00 0.00 179.25 179.63 3fq8 h GLN 2348N 0.42 0.58 0.00 0.00 4.15 -1.09 0.14 115.11 119.32 3fq8 h GLN 2348Ca 0.15 -0.10 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 3fq8 h GLN 2348Cb 0.03 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 3fq8 h GLN 2348CO -0.08 0.55 -0.11 1.49 -1.93 0.00 0.00 178.83 178.74 3fq8 h GLU 2349N 0.49 0.00 -0.14 1.69 4.81 -0.72 -2.53 114.58 118.19 3fq8 h GLU 2349Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3fq8 h GLU 2349Cb 0.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.56 3fq8 h GLU 2349CO -0.01 0.11 0.00 0.25 -0.73 0.00 0.00 179.01 178.63 3fq8 n THR 2350N -3.60 0.15 -0.90 0.32 -2.24 -0.03 -4.97 114.28 103.01 3fq8 n THR 2350Ca -0.02 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 3fq8 n THR 2350Cb 0.24 1.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 3fq8 n THR 2350CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fq8 n GLY 2351N 1.37 0.53 3.38 3.38 0.00 -0.77 -4.94 105.19 108.13 3fq8 n GLY 2351Ca 0.16 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.99 3fq8 n GLY 2351CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fq8 s HIS 2352N -2.00 2.87 0.11 1.61 3.76 -0.03 -5.02 115.29 116.58 3fq8 s HIS 2352Ca 0.00 -0.66 -0.31 0.00 -0.15 0.00 0.00 55.06 53.94 3fq8 s HIS 2352Cb 0.00 -1.90 -0.09 0.00 1.11 0.00 0.00 32.58 31.70 3fq8 s HIS 2352CO 0.00 -0.25 1.59 0.00 -0.85 0.00 0.00 174.74 175.24 3fq8 s ALA 2353N 0.54 3.71 0.22 -1.40 0.00 -1.26 -4.10 121.76 119.47 3fq8 s ALA 2353Ca -0.07 1.26 -0.17 0.00 0.00 0.00 0.00 51.96 52.97 3fq8 s ALA 2353Cb -0.15 -3.65 0.02 0.00 0.00 0.00 0.00 23.12 19.34 3fq8 s ALA 2353CO 0.03 -0.94 0.56 0.00 0.00 0.00 0.00 175.76 175.41 3fq8 s ALA 2354N 1.93 -0.88 0.14 0.00 0.00 -1.23 -2.49 121.76 119.23 3fq8 s ALA 2354Ca 0.71 -0.34 -0.24 0.00 0.00 0.00 0.00 51.96 52.09 3fq8 s ALA 2354Cb -0.41 0.89 0.07 0.00 0.00 0.00 0.00 23.12 23.68 3fq8 s ALA 2354CO 0.32 -0.86 0.62 0.00 0.00 0.00 0.00 175.76 175.83 3fq8 n GLY 2356N -0.33 1.05 0.00 0.00 0.00 -1.26 -0.06 105.19 104.58 3fq8 n GLY 2356Ca -0.17 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3fq8 n GLY 2356CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fq8 n GLY 2357N 0.00 3.19 3.43 -0.02 0.00 -1.05 -4.94 105.19 105.80 3fq8 n GLY 2357Ca 0.00 -1.76 -0.10 0.00 0.00 0.00 0.00 46.02 44.16 3fq8 n GLY 2357CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3fq8 s GLN 2358N -2.03 1.25 -0.21 1.61 1.03 -1.26 -1.71 119.66 118.34 3fq8 s GLN 2358Ca 0.00 -0.95 -0.05 0.00 0.04 0.00 0.00 55.36 54.40 3fq8 s GLN 2358Cb 0.00 0.46 0.10 0.00 0.03 0.00 0.00 33.01 33.61 3fq8 s GLN 2358CO 0.00 -0.50 0.39 0.08 -2.54 0.00 0.00 175.29 172.72 3fq8 s VAL 2359N -3.90 -0.62 0.00 3.63 1.01 -0.86 -5.02 120.40 114.65 3fq8 s VAL 2359Ca 0.11 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.18 3fq8 s VAL 2359Cb 0.01 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.69 3fq8 s VAL 2359CO -0.03 0.01 0.00 -0.24 0.00 0.00 0.00 175.10 174.84 3fq8 n SER 2360N 5.38 0.00 -2.26 3.32 2.88 -1.26 -2.71 113.62 118.96 3fq8 n SER 2360Ca -0.07 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.23 3fq8 n SER 2360Cb 0.50 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.95 3fq8 n SER 2360CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fq8 n GLY 2361N 0.00 4.44 2.75 0.46 0.00 -1.26 -4.30 105.19 107.28 3fq8 n GLY 2361Ca 0.00 -1.64 -0.18 0.00 0.00 0.00 0.00 46.02 44.20 3fq8 n GLY 2361CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3fq8 s MET 2362N -2.04 0.08 0.29 1.61 -2.45 -1.10 -2.35 119.30 113.35 3fq8 s MET 2362Ca 0.48 0.21 0.04 0.00 -1.25 0.00 0.00 55.69 55.18 3fq8 s MET 2362Cb 0.34 -0.44 -0.03 0.00 1.25 0.00 0.00 34.83 35.95 3fq8 s MET 2362CO -0.13 -0.22 0.20 -0.59 1.05 0.00 0.00 175.02 175.34 3fq8 s PHE 2363N 1.46 1.56 0.00 4.11 -0.12 -0.40 -2.02 117.98 122.58 3fq8 s PHE 2363Ca -0.04 -1.50 -0.17 0.00 -0.05 0.00 0.00 56.93 55.17 3fq8 s PHE 2363Cb -0.13 -0.73 0.03 0.00 -0.63 0.00 0.00 43.02 41.56 3fq8 s PHE 2363CO -0.03 -0.70 0.38 0.20 -0.05 0.00 0.00 175.22 175.02 3fq8 s GLY 2364N -3.33 -0.22 -0.24 1.99 0.00 -0.69 -0.27 107.32 104.55 3fq8 s GLY 2364Ca 0.38 0.39 -0.02 0.00 0.00 0.00 0.00 44.72 45.47 3fq8 s GLY 2364CO 0.21 0.15 0.35 -0.12 0.00 0.00 0.00 173.10 173.68 3fq8 s PHE 2365N -1.75 -0.71 -0.09 1.90 5.36 -1.26 -2.53 117.98 118.89 3fq8 s PHE 2365Ca -0.10 0.60 -0.02 0.00 -0.96 0.00 0.00 56.93 56.45 3fq8 s PHE 2365Cb -0.03 -0.10 -0.03 0.00 -0.34 0.00 0.00 43.02 42.51 3fq8 s PHE 2365CO 0.02 -0.74 -0.01 -0.06 -1.46 0.00 0.00 175.22 172.97 3fq8 s PHE 2366N 2.49 3.12 -1.32 10.12 0.40 0.91 -4.98 117.98 128.72 3fq8 s PHE 2366Ca 0.11 0.13 -0.11 0.00 -0.60 0.00 0.00 56.93 56.46 3fq8 s PHE 2366Cb -0.15 -1.80 0.14 0.00 0.51 0.00 0.00 43.02 41.72 3fq8 s PHE 2366CO -0.18 0.40 1.95 1.19 0.70 0.00 0.00 175.22 179.28 3fq8 n PHE 2367N 2.29 3.14 -3.59 0.36 3.01 -1.26 -1.85 117.46 119.56 3fq8 n PHE 2367Ca -0.18 -2.85 -0.13 0.00 1.01 0.00 0.00 57.45 55.30 3fq8 n PHE 2367Cb 0.53 -2.10 -0.06 0.00 -0.01 0.00 0.00 39.48 37.84 3fq8 n PHE 2367CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 3fq8 s THR 2368N 1.11 0.00 0.39 4.37 -1.32 -1.04 -0.78 115.64 118.37 3fq8 s THR 2368Ca 0.42 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.97 3fq8 s THR 2368Cb 0.10 -1.00 0.21 0.00 -1.51 0.00 0.00 72.50 70.31 3fq8 s THR 2368CO -0.02 0.00 1.98 1.05 -2.21 0.00 0.00 174.62 175.43 3fq8 h GLU 2369N 3.66 0.43 0.00 7.08 4.11 -1.81 -2.96 114.58 125.09 3fq8 h GLU 2369Ca -0.26 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.12 3fq8 h GLU 2369Cb 1.16 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.33 3fq8 h GLU 2369CO 0.22 0.39 0.00 0.41 0.07 0.00 0.00 179.01 180.10 3fq8 n GLY 2370N -1.18 0.99 3.72 1.06 0.00 -1.26 -4.56 105.19 103.94 3fq8 n GLY 2370Ca 0.01 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.09 3fq8 n GLY 2370CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fq8 s PRO 2371N 0.00 1.54 -0.37 1.61 0.04 -1.26 -5.12 135.00 131.44 3fq8 s PRO 2371Ca 0.00 1.23 -0.12 0.00 0.04 0.00 0.00 61.00 62.15 3fq8 s PRO 2371Cb 0.00 -1.81 0.01 0.00 0.04 0.00 0.00 34.50 32.74 3fq8 s PRO 2371CO 0.00 -2.17 0.22 0.08 0.04 0.00 0.00 177.00 175.18 3fq8 s VAL 2372N -2.80 4.84 -0.47 -0.36 1.01 -1.26 -4.91 120.40 116.45 3fq8 s VAL 2372Ca 0.64 -0.63 0.11 0.00 0.00 0.00 0.00 61.98 62.10 3fq8 s VAL 2372Cb -0.20 -3.63 -0.13 0.00 0.00 0.00 0.00 36.38 32.43 3fq8 s VAL 2372CO 0.57 -0.16 0.45 1.41 0.00 0.00 0.00 175.10 177.37 3fq8 n HIS 2373N 5.05 0.00 -3.82 5.22 8.25 -1.26 -4.78 115.22 123.87 3fq8 n HIS 2373Ca -0.12 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.26 3fq8 n HIS 2373Cb 0.47 -0.04 0.02 0.00 1.12 0.00 0.00 29.99 31.57 3fq8 n HIS 2373CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3fq8 s ASN 2374N -2.25 -0.02 0.33 0.41 6.03 -1.26 -4.47 114.94 113.71 3fq8 s ASN 2374Ca 0.03 -1.03 0.01 0.00 -1.03 0.00 0.00 52.86 50.84 3fq8 s ASN 2374Cb 0.08 0.80 0.58 0.00 -3.03 0.00 0.00 41.25 39.68 3fq8 s ASN 2374CO 0.47 -1.57 1.98 0.22 -2.03 0.00 0.00 177.10 176.18 3fq8 h TYR 2375N 2.00 0.89 -0.16 1.54 3.20 -1.89 -2.32 116.97 120.23 3fq8 h TYR 2375Ca -0.30 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.60 3fq8 h TYR 2375Cb 1.25 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 3fq8 h TYR 2375CO 1.26 0.54 0.09 1.49 -1.64 0.00 0.00 178.16 179.90 3fq8 h GLU 2376N 0.94 0.18 -0.43 1.82 4.81 -1.96 -1.23 114.58 118.71 3fq8 h GLU 2376Ca 0.28 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.52 3fq8 h GLU 2376Cb -0.04 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 3fq8 h GLU 2376CO -0.07 0.12 0.25 -0.44 -0.73 0.00 0.00 179.01 178.14 3fq8 h ASP 2377N 0.19 0.41 -0.61 1.04 3.32 -1.84 -2.08 116.42 116.85 3fq8 h ASP 2377Ca 0.06 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.15 3fq8 h ASP 2377Cb -0.00 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 3fq8 h ASP 2377CO -0.03 0.29 0.40 0.00 -1.72 0.00 0.00 179.24 178.18 3fq8 h ALA 2378N 1.19 1.70 0.00 3.45 0.00 -1.10 -1.10 119.26 123.40 3fq8 h ALA 2378Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3fq8 h ALA 2378Cb 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3fq8 h ALA 2378CO -0.08 0.23 0.00 1.63 0.00 0.00 0.00 179.25 181.03 3fq8 n LYS 2379N -4.47 0.39 0.00 0.00 5.02 -0.49 -1.49 118.16 117.12 3fq8 n LYS 2379Ca 0.07 0.04 0.13 0.00 -2.02 0.00 0.00 58.31 56.54 3fq8 n LYS 2379Cb 0.15 -1.50 0.44 0.00 -0.02 0.00 0.00 35.03 34.09 3fq8 n LYS 2379CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3fq8 n LYS 2380N -1.08 0.25 -1.76 1.97 5.02 -0.42 -4.90 118.16 117.24 3fq8 n LYS 2380Ca 0.10 -0.11 -0.41 0.00 -2.02 0.00 0.00 58.31 55.87 3fq8 n LYS 2380Cb 0.07 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.59 3fq8 n LYS 2380CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3fq8 n SER 2381N -1.28 3.42 -4.56 4.39 7.64 -0.56 -4.80 113.62 117.88 3fq8 n SER 2381Ca 0.09 1.18 -0.38 0.00 1.01 0.00 0.00 58.87 60.77 3fq8 n SER 2381Cb 0.32 -1.59 -0.03 0.00 -1.01 0.00 0.00 64.21 61.90 3fq8 n SER 2381CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3fq8 s ASP 2382N -0.28 6.04 0.43 6.43 3.68 0.04 -4.85 116.67 128.16 3fq8 s ASP 2382Ca 0.56 -0.82 0.11 0.00 2.13 0.00 0.00 52.55 54.54 3fq8 s ASP 2382Cb -0.48 -2.56 0.96 0.00 -1.45 0.00 0.00 42.92 39.38 3fq8 s ASP 2382CO 0.61 -1.91 2.03 -0.07 0.13 0.00 0.00 175.17 175.96 3fq8 h LEU 2383N 14.10 0.22 -0.57 -1.34 4.07 -1.90 -1.62 115.31 128.27 3fq8 h LEU 2383Ca -0.01 -0.02 -0.14 0.00 0.08 0.00 0.00 57.88 57.79 3fq8 h LEU 2383Cb 1.04 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.71 3fq8 h LEU 2383CO 1.32 0.25 -0.33 1.56 -1.08 0.00 0.00 178.44 180.16 3fq8 h GLN 2384N 0.24 0.78 -0.41 1.13 4.20 -1.94 -0.78 115.11 118.34 3fq8 h GLN 2384Ca 0.06 -0.37 -0.16 0.00 0.06 0.00 0.00 58.65 58.24 3fq8 h GLN 2384Cb 0.14 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3fq8 h GLN 2384CO 0.00 1.00 -0.36 -0.22 -0.67 0.00 0.00 178.83 178.58 3fq8 h LYS 2385N 0.66 0.96 -0.67 1.46 3.64 -1.86 -2.65 116.57 118.10 3fq8 h LYS 2385Ca 0.07 -0.49 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 3fq8 h LYS 2385Cb 0.87 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 3fq8 h LYS 2385CO 0.08 1.15 0.43 0.35 -2.27 0.00 0.00 179.45 179.18 3fq8 h PHE 2386N 0.79 0.86 -0.99 1.91 3.57 -1.07 0.13 116.94 122.14 3fq8 h PHE 2386Ca 0.07 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.60 3fq8 h PHE 2386Cb 0.95 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 39.35 3fq8 h PHE 2386CO 0.06 0.56 0.65 1.03 -2.23 0.00 0.00 178.31 178.39 3fq8 h SER 2387N 0.91 1.12 -0.26 0.41 0.87 -1.01 0.80 113.55 116.39 3fq8 h SER 2387Ca 0.24 -0.02 -0.18 0.00 -1.23 0.00 0.00 61.79 60.60 3fq8 h SER 2387Cb -0.07 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.62 3fq8 h SER 2387CO -0.05 0.80 -0.54 0.03 -0.53 0.00 0.00 176.83 176.54 3fq8 h ARG 2388N 1.32 0.85 -0.34 2.24 3.08 -1.07 -2.70 114.38 117.76 3fq8 h ARG 2388Ca 0.37 -0.53 -0.00 0.00 0.07 0.00 0.00 59.98 59.89 3fq8 h ARG 2388Cb -0.11 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3fq8 h ARG 2388CO -0.09 1.17 0.20 0.35 -1.07 0.00 0.00 179.97 180.52 3fq8 h PHE 2389N 0.65 0.45 -0.12 3.04 3.57 -0.30 -1.02 116.94 123.21 3fq8 h PHE 2389Ca 0.02 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3fq8 h PHE 2389Cb 1.14 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 3fq8 h PHE 2389CO 0.07 0.33 0.07 1.25 -2.23 0.00 0.00 178.31 177.80 3fq8 h HIS 2390N 0.43 0.14 -0.51 0.41 2.76 -0.87 -0.08 115.15 117.43 3fq8 h HIS 2390Ca 0.12 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.26 3fq8 h HIS 2390Cb 0.02 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 28.91 3fq8 h HIS 2390CO -0.04 0.08 0.18 -0.09 -1.30 0.00 0.00 177.93 176.77 3fq8 h ARG 2391N 0.15 0.78 -0.93 5.26 9.65 -1.38 -0.74 114.38 127.17 3fq8 h ARG 2391Ca 0.05 -0.15 0.02 0.00 -1.10 0.00 0.00 59.98 58.79 3fq8 h ARG 2391Cb -0.01 -0.12 -0.05 0.00 -1.39 0.00 0.00 29.97 28.40 3fq8 h ARG 2391CO -0.02 0.71 0.61 0.78 2.80 0.00 0.00 179.97 184.85 3fq8 h GLY 2392N 0.69 1.32 1.06 2.80 0.00 -0.95 -0.99 103.07 107.00 3fq8 h GLY 2392Ca 0.17 -0.48 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 3fq8 h GLY 2392CO -0.01 0.45 -0.05 -0.33 0.00 0.00 0.00 176.54 176.61 3fq8 h MET 2393N 1.23 0.98 -0.46 4.80 2.86 -0.56 -1.95 114.93 121.83 3fq8 h MET 2393Ca 0.35 -0.34 0.07 0.00 -2.06 0.00 0.00 59.70 57.72 3fq8 h MET 2393Cb -0.10 -0.08 -0.06 0.00 0.06 0.00 0.00 31.60 31.43 3fq8 h MET 2393CO -0.09 1.01 0.14 1.25 1.06 0.00 0.00 176.91 180.29 3fq8 h LEU 2394N 0.86 0.12 -2.01 1.22 5.85 -0.46 0.94 115.31 121.82 3fq8 h LEU 2394Ca 0.15 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 3fq8 h LEU 2394Cb 0.60 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 3fq8 h LEU 2394CO 0.04 0.10 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.81 3fq8 h GLU 2395N 0.30 0.00 -0.26 1.25 5.08 -0.81 -1.05 114.58 119.09 3fq8 h GLU 2395Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3fq8 h GLU 2395Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3fq8 h GLU 2395CO -0.25 0.09 0.00 1.04 -1.00 0.00 0.00 179.01 178.89 3fq8 n GLN 2396N -3.57 1.93 -0.84 2.33 1.13 -0.17 -4.92 117.38 113.26 3fq8 n GLN 2396Ca -0.02 -1.41 0.00 0.00 -1.94 0.00 0.00 57.00 53.63 3fq8 n GLN 2396Cb 0.22 -1.41 0.00 0.00 0.11 0.00 0.00 30.24 29.16 3fq8 n GLN 2396CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3fq8 n GLY 2397N 1.21 0.68 3.18 1.08 0.00 -0.40 -4.94 105.19 106.01 3fq8 n GLY 2397Ca 0.16 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 3fq8 n GLY 2397CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fq8 s ILE 2398N -2.00 2.19 -0.39 -0.61 -1.09 0.15 -0.98 121.20 118.47 3fq8 s ILE 2398Ca 0.00 -0.93 -0.12 0.00 -2.23 0.00 0.00 60.65 57.37 3fq8 s ILE 2398Cb 0.00 -1.89 0.03 0.00 -1.58 0.00 0.00 42.46 39.01 3fq8 s ILE 2398CO 0.00 0.54 0.24 -0.47 -1.23 0.00 0.00 174.94 174.02 3fq8 s TYR 2399N 0.91 3.24 0.28 3.97 5.04 -0.52 -2.63 117.35 127.64 3fq8 s TYR 2399Ca -0.04 -0.84 0.08 0.00 -2.44 0.00 0.00 57.07 53.83 3fq8 s TYR 2399Cb -0.15 -2.50 -0.04 0.00 0.35 0.00 0.00 41.96 39.62 3fq8 s TYR 2399CO -0.04 -0.63 0.10 -0.51 -1.34 0.00 0.00 175.55 173.14 3fq8 s LEU 2400N 1.60 3.43 0.18 6.97 1.43 -1.26 -1.19 118.68 129.84 3fq8 s LEU 2400Ca 0.03 -0.53 -0.33 0.00 -1.03 0.00 0.00 54.13 52.27 3fq8 s LEU 2400Cb -0.19 -1.95 -0.13 0.00 0.03 0.00 0.00 46.19 43.94 3fq8 s LEU 2400CO 0.08 -0.08 1.63 0.00 0.23 0.00 0.00 176.35 178.21 3fq8 n ALA 2401N -1.06 1.96 -0.98 4.21 0.00 -1.26 -4.81 120.51 118.56 3fq8 n ALA 2401Ca -0.06 0.43 -0.23 0.00 0.00 0.00 0.00 53.44 53.57 3fq8 n ALA 2401Cb 0.59 -2.42 -0.07 0.00 0.00 0.00 0.00 19.45 17.55 3fq8 n ALA 2401CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3fq8 n PRO 2402N 3.59 2.50 -3.64 0.00 -0.04 -1.26 -4.72 135.00 131.42 3fq8 n PRO 2402Ca 0.16 -1.48 -0.06 0.00 -0.04 0.00 0.00 63.50 62.09 3fq8 n PRO 2402Cb 0.31 -2.37 -0.07 0.00 -0.04 0.00 0.00 33.50 31.34 3fq8 n PRO 2402CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3fq8 s SER 2403N 2.47 -0.22 0.46 3.54 0.15 -1.26 -4.66 113.70 114.18 3fq8 s SER 2403Ca 0.57 0.42 0.26 0.00 0.70 0.00 0.00 55.95 57.90 3fq8 s SER 2403Cb 0.19 0.42 0.92 0.00 -1.71 0.00 0.00 66.02 65.85 3fq8 s SER 2403CO -0.03 -0.08 1.82 -0.61 1.20 0.00 0.00 173.24 175.54 3fq8 h GLN 2404N 3.53 0.00 -1.00 5.44 5.75 -1.94 -3.25 115.11 123.64 3fq8 h GLN 2404Ca -0.27 0.00 -0.65 0.00 -0.15 0.00 0.00 58.65 57.59 3fq8 h GLN 2404Cb 1.19 0.00 -0.29 0.00 1.07 0.00 0.00 27.48 29.44 3fq8 h GLN 2404CO 0.15 0.15 0.82 1.19 -2.65 0.00 0.00 178.83 178.49 3fq8 n PHE 2405N -3.25 3.20 -4.09 3.99 3.01 -1.26 -4.38 117.46 114.67 3fq8 n PHE 2405Ca 0.01 -2.79 -0.18 0.00 1.01 0.00 0.00 57.45 55.50 3fq8 n PHE 2405Cb 0.43 -1.35 -0.16 0.00 -0.01 0.00 0.00 39.48 38.39 3fq8 n PHE 2405CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3fq8 s GLU 2406N -3.72 0.61 0.65 -1.08 0.41 -1.23 -2.17 118.70 112.17 3fq8 s GLU 2406Ca 0.63 -0.06 -0.15 0.00 -0.41 0.00 0.00 54.97 54.98 3fq8 s GLU 2406Cb 0.50 -0.66 -0.01 0.00 -1.78 0.00 0.00 34.13 32.18 3fq8 s GLU 2406CO 0.02 -0.07 1.10 0.00 -0.49 0.00 0.00 175.26 175.81 3fq8 s ALA 2407N 0.80 2.53 0.24 5.21 0.00 -0.40 -4.69 121.76 125.45 3fq8 s ALA 2407Ca -0.10 0.51 0.04 0.00 0.00 0.00 0.00 51.96 52.41 3fq8 s ALA 2407Cb -0.13 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 3fq8 s ALA 2407CO -0.00 -1.18 0.38 0.20 0.00 0.00 0.00 175.76 175.16 3fq8 s GLY 2408N -2.64 1.32 0.03 0.00 0.00 0.63 -4.90 107.32 101.76 3fq8 s GLY 2408Ca 0.66 -1.14 0.03 0.00 0.00 0.00 0.00 44.72 44.27 3fq8 s GLY 2408CO 0.41 -1.14 -0.09 -1.36 0.00 0.00 0.00 173.10 170.92 3fq8 s PHE 2409N -2.00 0.78 0.41 1.90 0.40 -0.08 -1.27 117.98 118.12 3fq8 s PHE 2409Ca 0.35 -0.38 0.07 0.00 -0.60 0.00 0.00 56.93 56.38 3fq8 s PHE 2409Cb -0.09 -0.47 -0.07 0.00 0.51 0.00 0.00 43.02 42.90 3fq8 s PHE 2409CO 0.30 -0.03 0.09 0.95 0.70 0.00 0.00 175.22 177.22 3fq8 s THR 2410N -0.98 2.12 0.19 0.64 -4.23 -0.99 -4.25 115.64 108.13 3fq8 s THR 2410Ca -0.04 -1.86 -0.02 0.00 -1.18 0.00 0.00 61.69 58.58 3fq8 s THR 2410Cb -0.08 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 3fq8 s THR 2410CO 0.01 0.00 0.14 -0.94 -0.54 0.00 0.00 174.62 173.28 3fq8 s SER 2411N -3.80 0.17 0.51 3.99 1.04 -1.26 -4.77 113.70 109.58 3fq8 s SER 2411Ca 0.37 -1.31 0.34 0.00 0.48 0.00 0.00 55.95 55.83 3fq8 s SER 2411Cb 0.07 0.37 1.62 0.00 0.10 0.00 0.00 66.02 68.18 3fq8 s SER 2411CO 0.20 -0.83 2.02 -0.07 0.98 0.00 0.00 173.24 175.54 3fq8 h LEU 2412N 2.65 0.00 0.00 2.42 3.38 -1.27 -2.21 115.31 120.29 3fq8 h LEU 2412Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3fq8 h LEU 2412Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3fq8 h LEU 2412CO 0.53 0.00 -0.29 0.00 0.09 0.00 0.00 178.44 178.77 3fq8 n ALA 2413N -1.99 2.73 -2.31 1.53 0.00 -1.26 -4.80 120.51 114.41 3fq8 n ALA 2413Ca -0.01 -0.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 3fq8 n ALA 2413Cb 0.18 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 3fq8 n ALA 2413CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3fq8 s HIS 2414N -3.08 2.87 0.54 0.00 3.76 -0.83 -4.35 115.29 114.20 3fq8 s HIS 2414Ca 0.10 0.91 0.02 0.00 -0.15 0.00 0.00 55.06 55.94 3fq8 s HIS 2414Cb 0.15 -3.59 0.03 0.00 1.11 0.00 0.00 32.58 30.28 3fq8 s HIS 2414CO 0.64 -2.10 0.76 0.95 -0.85 0.00 0.00 174.74 174.14 3fq8 s THR 2415N 2.68 2.73 0.36 1.30 -4.23 -1.26 -4.94 115.64 112.28 3fq8 s THR 2415Ca 0.61 -0.68 0.04 0.00 -1.18 0.00 0.00 61.69 60.48 3fq8 s THR 2415Cb -0.28 -3.02 0.23 0.00 1.34 0.00 0.00 72.50 70.77 3fq8 s THR 2415CO 0.23 -0.01 1.98 -0.08 -0.54 0.00 0.00 174.62 176.20 3fq8 h GLU 2416N 0.11 0.68 -0.73 3.99 4.57 -2.00 -1.52 114.58 119.69 3fq8 h GLU 2416Ca -0.42 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 57.62 3fq8 h GLU 2416Cb 1.29 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.72 3fq8 h GLU 2416CO 0.52 0.51 0.20 0.93 -1.18 0.00 0.00 179.01 179.99 3fq8 h GLU 2417N 0.69 1.15 -0.78 1.92 3.07 -1.99 -1.07 114.58 117.56 3fq8 h GLU 2417Ca 0.18 -0.26 -0.02 0.00 -0.50 0.00 0.00 59.36 58.75 3fq8 h GLU 2417Cb 0.04 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 27.76 3fq8 h GLU 2417CO -0.03 1.00 0.41 -0.44 -1.40 0.00 0.00 179.01 178.55 3fq8 h ASP 2418N 1.10 0.99 -0.55 1.42 3.32 -1.67 -0.94 116.42 120.10 3fq8 h ASP 2418Ca 0.23 -0.11 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 3fq8 h ASP 2418Cb 0.34 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 3fq8 h ASP 2418CO -0.00 0.82 0.03 0.40 -1.72 0.00 0.00 179.24 178.77 3fq8 h ILE 2419N 1.09 1.26 -0.06 0.35 1.08 -1.05 -1.29 117.51 118.89 3fq8 h ILE 2419Ca 0.27 -1.07 0.01 0.00 -0.39 0.00 0.00 64.86 63.69 3fq8 h ILE 2419Cb 0.07 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 34.67 3fq8 h ILE 2419CO -0.04 0.38 -0.03 0.44 -0.69 0.00 0.00 178.15 178.22 3fq8 h ASP 2420N 0.84 -0.09 -0.18 1.72 3.32 -0.70 -1.57 116.42 119.76 3fq8 h ASP 2420Ca 0.16 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3fq8 h ASP 2420Cb 0.50 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 3fq8 h ASP 2420CO 0.02 -0.04 0.07 0.00 -1.72 0.00 0.00 179.24 177.57 3fq8 h ALA 2421N 1.05 1.66 -0.35 3.45 0.00 -1.05 -0.87 119.26 123.15 3fq8 h ALA 2421Ca 0.04 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3fq8 h ALA 2421Cb 0.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3fq8 h ALA 2421CO -0.08 0.27 -0.28 1.15 0.00 0.00 0.00 179.25 180.30 3fq8 h THR 2422N 0.35 1.29 -0.26 0.00 2.02 -0.72 -1.49 112.91 114.09 3fq8 h THR 2422Ca 0.09 -1.44 -0.15 0.00 0.77 0.00 0.00 66.41 65.67 3fq8 h THR 2422Cb 0.13 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 3fq8 h THR 2422CO -0.00 0.48 -0.44 -0.07 0.37 0.00 0.00 175.52 175.85 3fq8 h LEU 2423N 0.60 0.71 -0.67 2.58 3.38 -0.87 -0.68 115.31 120.36 3fq8 h LEU 2423Ca 0.06 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3fq8 h LEU 2423Cb 0.86 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 3fq8 h LEU 2423CO 0.07 1.05 0.44 0.00 0.09 0.00 0.00 178.44 180.09 3fq8 h ALA 2424N 0.97 0.85 -0.45 1.53 0.00 -1.07 -0.50 119.26 120.60 3fq8 h ALA 2424Ca 0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3fq8 h ALA 2424Cb 0.98 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3fq8 h ALA 2424CO 0.09 0.29 0.16 0.00 0.00 0.00 0.00 179.25 179.80 3fq8 h ALA 2425N 1.24 0.58 -0.85 0.00 0.00 -0.97 -2.16 119.26 117.10 3fq8 h ALA 2425Ca 0.25 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3fq8 h ALA 2425Cb -0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 3fq8 h ALA 2425CO -0.05 0.21 0.55 0.00 0.00 0.00 0.00 179.25 179.96 3fq8 h ALA 2426N 1.01 1.37 0.01 0.00 0.00 -0.51 -0.45 119.26 120.70 3fq8 h ALA 2426Ca 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3fq8 h ALA 2426Cb 0.22 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3fq8 h ALA 2426CO -0.01 0.57 -0.01 -0.09 0.00 0.00 0.00 179.25 179.72 3fq8 h ARG 2427N 1.16 -0.02 -0.18 0.00 9.65 -0.86 0.48 114.38 124.62 3fq8 h ARG 2427Ca 0.31 0.00 0.02 0.00 -1.10 0.00 0.00 59.98 59.21 3fq8 h ARG 2427Cb -0.11 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.45 3fq8 h ARG 2427CO -0.06 0.16 0.04 1.15 2.80 0.00 0.00 179.97 184.06 3fq8 h THR 2428N -0.20 0.92 0.20 0.20 2.02 -0.99 -0.14 112.91 114.93 3fq8 h THR 2428Ca -0.00 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 3fq8 h THR 2428Cb 0.19 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 3fq8 h THR 2428CO 0.00 0.02 -0.10 0.58 0.37 0.00 0.00 175.52 176.40 3fq8 h VAL 2429N 0.11 0.89 0.00 3.16 2.07 -1.02 -3.00 116.25 118.46 3fq8 h VAL 2429Ca 0.08 -0.47 -0.04 0.00 0.82 0.00 0.00 66.70 67.09 3fq8 h VAL 2429Cb 0.07 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3fq8 h VAL 2429CO -0.11 0.11 -0.18 0.24 0.02 0.00 0.00 177.57 177.65 3fq8 h MET 2430N -0.50 0.00 0.00 1.57 2.07 -0.85 -1.26 114.93 115.95 3fq8 h MET 2430Ca -0.03 0.00 -0.06 0.00 -2.07 0.00 0.00 59.70 57.54 3fq8 h MET 2430Cb 0.38 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.10 3fq8 h MET 2430CO 0.04 0.18 -0.29 0.77 1.07 0.00 0.00 176.91 178.68 3fq8 h SER 2431N 0.00 0.00 0.05 1.22 0.02 -0.97 -2.94 113.55 110.93 3fq8 h SER 2431Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3fq8 h SER 2431Cb 0.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3fq8 h SER 2431CO 0.02 0.29 -0.76 0.00 -1.14 0.00 0.00 176.83 175.24 3fq8 n ALA 2432N -2.32 4.22 0.00 3.77 0.00 -0.62 -5.10 120.51 120.46 3fq8 n ALA 2432Ca -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.85 3fq8 n ALA 2432Cb 0.41 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.04 3fq8 n ALA 2432CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78