#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1skg h LEU 2002N 0.00 0.86 -0.63 1.04 5.85 -1.00 0.05 115.31 121.48 1skg h LEU 2002Ca 0.00 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 1skg h LEU 2002Cb 0.00 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 1skg h LEU 2002CO 0.00 0.60 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.61 1skg h LEU 2003N 1.01 1.03 -0.53 2.25 3.38 -1.94 -0.71 115.31 119.80 1skg h LEU 2003Ca 0.31 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1skg h LEU 2003Cb -0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1skg h LEU 2003CO -0.08 1.09 -0.16 -0.33 0.09 0.00 0.00 178.44 179.05 1skg h GLU 2004N 0.95 1.02 -0.73 1.13 5.08 -1.75 -1.36 114.58 118.92 1skg h GLU 2004Ca 0.16 -0.41 0.03 0.00 -1.00 0.00 0.00 59.36 58.15 1skg h GLU 2004Cb 0.58 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 1skg h GLU 2004CO 0.03 1.09 0.46 0.35 -1.00 0.00 0.00 179.01 179.95 1skg h PHE 2005N 0.90 0.86 -0.39 4.33 3.57 -0.72 -0.31 116.94 125.17 1skg h PHE 2005Ca 0.13 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 1skg h PHE 2005Cb 0.73 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1skg h PHE 2005CO 0.05 0.49 -0.10 0.78 -2.23 0.00 0.00 178.31 177.30 1skg h GLY 2006N 0.90 0.74 1.04 2.40 0.00 -0.66 0.12 103.07 107.60 1skg h GLY 2006Ca 0.30 -0.54 -0.10 0.00 0.00 0.00 0.00 47.33 46.99 1skg h GLY 2006CO -0.11 0.49 -0.08 1.70 0.00 0.00 0.00 176.54 178.53 1skg h LYS 2007N 0.63 0.92 -0.69 4.80 3.64 -0.70 -1.23 116.57 123.94 1skg h LYS 2007Ca 0.11 -0.34 0.03 0.00 -1.27 0.00 0.00 60.65 59.18 1skg h LYS 2007Cb 0.54 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.26 1skg h LYS 2007CO 0.03 0.99 0.43 1.98 -2.27 0.00 0.00 179.45 180.61 1skg h MET 2008N 0.77 0.82 -0.41 1.90 4.05 -0.57 0.09 114.93 121.59 1skg h MET 2008Ca 0.13 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.50 1skg h MET 2008Cb 0.63 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.22 1skg h MET 2008CO 0.04 0.54 0.27 0.82 0.23 0.00 0.00 176.91 178.82 1skg h ILE 2009N 0.85 1.11 -0.39 1.77 2.04 -0.54 -0.36 117.51 121.99 1skg h ILE 2009Ca 0.27 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 1skg h ILE 2009Cb 0.01 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1skg h ILE 2009CO -0.10 0.10 0.12 0.25 0.00 0.00 0.00 178.15 178.52 1skg h LEU 2010N 0.56 0.57 -0.90 1.44 5.85 -0.90 0.49 115.31 122.42 1skg h LEU 2010Ca 0.15 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1skg h LEU 2010Cb -0.06 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 40.76 1skg h LEU 2010CO -0.03 0.63 0.57 -0.33 -0.34 0.00 0.00 178.44 178.94 1skg h GLU 2011N 0.48 1.06 -0.01 1.25 5.08 -0.81 0.22 114.58 121.86 1skg h GLU 2011Ca 0.13 -0.06 -0.20 0.00 -1.00 0.00 0.00 59.36 58.22 1skg h GLU 2011Cb 0.27 -0.24 0.02 0.00 0.50 0.00 0.00 28.75 29.29 1skg h GLU 2011CO -0.00 0.70 -0.78 1.49 -1.00 0.00 0.00 179.01 179.42 1skg h GLU 2012N 1.09 0.54 0.00 2.33 4.57 -0.64 -3.40 114.58 119.08 1skg h GLU 2012Ca 0.37 -0.57 0.00 0.00 -1.18 0.00 0.00 59.36 57.98 1skg h GLU 2012Cb 0.06 0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 1skg h GLU 2012CO -0.14 1.20 -1.37 0.25 -1.18 0.00 0.00 179.01 177.77 1skg n THR 2013N -4.07 0.00 -0.83 0.32 -2.24 0.13 -4.87 114.28 102.71 1skg n THR 2013Ca -0.11 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1skg n THR 2013Cb 0.76 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 1skg n THR 2013CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1skg n GLY 2014N 1.70 0.78 3.88 3.38 0.00 0.76 -5.02 105.19 110.67 1skg n GLY 2014Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1skg n GLY 2014CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1skg s LYS 2016N -0.26 3.58 0.13 1.61 1.02 -1.26 -5.01 119.74 119.55 1skg s LYS 2016Ca 0.00 -0.07 -0.30 0.00 0.02 0.00 0.00 55.97 55.62 1skg s LYS 2016Cb 0.00 -3.09 -0.07 0.00 -0.52 0.00 0.00 37.83 34.15 1skg s LYS 2016CO 0.00 0.65 1.24 -0.51 -0.92 0.00 0.00 175.35 175.82 1skg s LEU 2017N -1.71 4.40 0.20 3.17 1.43 -1.26 -3.57 118.68 121.34 1skg s LEU 2017Ca 0.27 2.19 -0.11 0.00 -1.03 0.00 0.00 54.13 55.45 1skg s LEU 2017Cb -0.13 -3.59 0.17 0.00 0.03 0.00 0.00 46.19 42.67 1skg s LEU 2017CO 0.16 -0.47 1.81 0.00 0.23 0.00 0.00 176.35 178.08 1skg h ALA 2018N 6.08 0.79 -2.74 4.21 0.00 -1.93 -0.01 119.26 125.66 1skg h ALA 2018Ca -0.43 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 53.80 1skg h ALA 2018Cb 1.21 -0.14 -0.21 0.00 0.00 0.00 0.00 17.79 18.65 1skg h ALA 2018CO 0.79 0.05 -0.50 0.42 0.00 0.00 0.00 179.25 180.01 1skg s ILE 2019N -6.12 5.02 -2.03 0.00 1.01 -1.26 -0.05 121.20 117.78 1skg s ILE 2019Ca -0.13 -0.39 0.18 0.00 0.00 0.00 0.00 60.65 60.32 1skg s ILE 2019Cb 0.15 -3.62 0.29 0.00 0.01 0.00 0.00 42.46 39.29 1skg s ILE 2019CO 0.75 -0.04 1.22 -0.81 0.00 0.00 0.00 174.94 176.06 1skg n PRO 2020N 5.07 2.06 0.17 2.79 -0.04 -1.23 -4.98 135.00 138.84 1skg n PRO 2020Ca -0.13 -1.93 0.05 0.00 -0.04 0.00 0.00 63.50 61.45 1skg n PRO 2020Cb 0.49 -1.39 0.26 0.00 -0.04 0.00 0.00 33.50 32.81 1skg n PRO 2020CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1skg h SER 2021N 3.55 0.00 0.00 3.54 0.02 -0.79 -3.35 113.55 116.52 1skg h SER 2021Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1skg h SER 2021Cb 0.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1skg h SER 2021CO 0.00 0.42 0.00 -1.22 -1.14 0.00 0.00 176.83 174.89 1skg n TYR 2022N -3.47 0.00 0.34 3.45 4.01 0.93 -4.71 117.16 117.73 1skg n TYR 2022Ca 0.00 -0.24 0.12 0.00 -0.16 0.00 0.00 57.90 57.62 1skg n TYR 2022Cb 0.57 -0.02 0.07 0.00 -0.31 0.00 0.00 39.34 39.64 1skg n TYR 2022CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1skg h SER 2023N 0.00 0.00 0.00 7.72 4.64 -1.47 -3.27 113.55 121.17 1skg h SER 2023Ca 0.00 -0.13 -0.15 0.00 -0.47 0.00 0.00 61.79 61.03 1skg h SER 2023Cb 0.71 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.50 1skg h SER 2023CO 0.00 0.07 -0.81 -1.54 -0.87 0.00 0.00 176.83 173.67 1skg n SER 2024N -2.37 0.46 -4.72 4.97 3.41 -1.22 -4.04 113.62 110.11 1skg n SER 2024Ca 0.01 -1.98 -0.37 0.00 -0.26 0.00 0.00 58.87 56.27 1skg n SER 2024Cb 0.49 -0.15 -0.07 0.00 -0.26 0.00 0.00 64.21 64.23 1skg n SER 2024CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1skg s TYR 2025N 0.00 3.46 0.00 7.33 6.14 -1.14 -1.36 117.35 131.79 1skg s TYR 2025Ca 0.23 0.71 0.00 0.00 0.64 0.00 0.00 57.07 58.65 1skg s TYR 2025Cb 0.27 -2.45 0.00 0.00 0.42 0.00 0.00 41.96 40.20 1skg s TYR 2025CO -0.12 0.17 0.00 0.41 0.64 0.00 0.00 175.55 176.65 1skg n GLY 2026N 3.43 1.49 0.09 8.97 0.00 0.17 -1.97 105.19 117.38 1skg n GLY 2026Ca -0.09 -0.53 0.08 0.00 0.00 0.00 0.00 46.02 45.47 1skg n GLY 2026CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1skg n TYR 2028N -2.67 0.00 -2.90 0.00 4.02 -1.24 -3.69 117.16 110.67 1skg n TYR 2028Ca -0.04 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.43 1skg n TYR 2028Cb 0.65 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.92 1skg n TYR 2028CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1skg n GLY 2030N 3.55 2.84 2.20 0.00 0.00 -1.23 -2.87 105.19 109.67 1skg n GLY 2030Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 1skg n GLY 2030CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1skg n TRP 2031N -2.00 -0.90 -0.89 1.61 -0.00 -1.25 -4.88 117.44 109.13 1skg n TRP 2031Ca 0.00 -0.82 -0.29 0.00 -0.00 0.00 0.00 57.50 56.38 1skg n TRP 2031Cb 0.00 1.08 0.19 0.00 -0.00 0.00 0.00 31.31 32.58 1skg n TRP 2031CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 177.69 177.89 1skg s GLY 2032N -0.47 1.59 0.00 5.87 0.00 -1.06 -4.77 107.32 108.47 1skg s GLY 2032Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.71 1skg s GLY 2032CO -0.05 0.53 0.00 0.61 0.00 0.00 0.00 173.10 174.19 1skg n GLY 2033N -0.23 0.05 3.23 0.20 0.00 -1.24 -4.97 105.19 102.24 1skg n GLY 2033Ca 0.06 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 1skg n GLY 2033CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1skg s LYS 2034N 0.00 1.03 0.00 1.61 -2.85 -1.26 -4.84 119.74 113.42 1skg s LYS 2034Ca 0.00 -1.32 0.00 0.00 -1.00 0.00 0.00 55.97 53.65 1skg s LYS 2034Cb 0.00 0.30 0.00 0.00 -2.06 0.00 0.00 37.83 36.07 1skg s LYS 2034CO 0.00 -0.33 0.00 0.41 0.10 0.00 0.00 175.35 175.53 1skg n GLY 2035N -0.15 2.41 3.68 0.59 0.00 0.57 -4.42 105.19 107.86 1skg n GLY 2035Ca -0.06 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 1skg n GLY 2035CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1skg s THR 2036N -2.99 4.81 0.36 2.61 2.01 -1.25 -4.65 115.64 116.54 1skg s THR 2036Ca 0.00 1.86 -0.26 0.00 0.31 0.00 0.00 61.69 63.60 1skg s THR 2036Cb 0.00 -4.24 -0.12 0.00 0.01 0.00 0.00 72.50 68.15 1skg s THR 2036CO 0.00 -0.01 1.06 -2.65 -0.69 0.00 0.00 174.62 172.33 1skg n PRO 2037N 5.31 1.51 0.17 4.92 -0.02 -1.26 -4.85 135.00 140.78 1skg n PRO 2037Ca 0.07 0.53 0.05 0.00 -2.02 0.00 0.00 63.50 62.14 1skg n PRO 2037Cb 0.48 -2.03 0.17 0.00 -0.02 0.00 0.00 33.50 32.10 1skg n PRO 2037CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1skg h LYS 2038N 1.89 0.00 0.00 -0.52 1.79 -1.95 -3.47 116.57 114.31 1skg h LYS 2038Ca -0.43 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.14 1skg h LYS 2038Cb 1.33 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.96 1skg h LYS 2038CO 0.59 0.38 0.38 -0.40 -1.08 0.00 0.00 179.45 179.32 1skg n ASP 2039N -3.28 -1.10 -0.11 0.86 5.75 -1.26 -5.00 116.55 112.41 1skg n ASP 2039Ca 0.01 -1.58 -0.04 0.00 -0.01 0.00 0.00 54.79 53.18 1skg n ASP 2039Cb 0.62 1.79 0.17 0.00 -1.03 0.00 0.00 41.12 42.67 1skg n ASP 2039CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1skg h ALA 2040N 2.00 1.13 -0.56 2.12 0.00 -1.93 -0.44 119.26 121.58 1skg h ALA 2040Ca -0.17 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 1skg h ALA 2040Cb 0.76 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1skg h ALA 2040CO 0.23 0.56 0.28 1.15 0.00 0.00 0.00 179.25 181.48 1skg h THR 2041N 0.73 1.20 -0.21 0.00 2.02 -1.92 -0.42 112.91 114.32 1skg h THR 2041Ca 0.15 -0.54 -0.07 0.00 0.77 0.00 0.00 66.41 66.72 1skg h THR 2041Cb 0.43 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1skg h THR 2041CO 0.02 0.22 -0.16 -0.78 0.37 0.00 0.00 175.52 175.19 1skg h ASP 2042N 0.76 0.34 0.19 4.18 3.58 -1.79 -1.05 116.42 122.63 1skg h ASP 2042Ca 0.20 -0.08 -0.06 0.00 0.42 0.00 0.00 57.03 57.50 1skg h ASP 2042Cb 0.09 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1skg h ASP 2042CO -0.03 0.52 -0.25 0.03 -2.88 0.00 0.00 179.24 176.63 1skg h ARG 2043N 0.33 0.11 -0.71 0.28 3.08 -0.30 0.44 114.38 117.61 1skg h ARG 2043Ca 0.06 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.14 1skg h ARG 2043Cb 0.47 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.45 1skg h ARG 2043CO 0.03 0.36 0.40 0.00 -1.07 0.00 0.00 179.97 179.69 1skg h PHE 2046N 0.40 -0.17 -0.74 0.00 3.57 -0.44 0.68 116.94 120.24 1skg h PHE 2046Ca 0.02 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 1skg h PHE 2046Cb 1.00 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.79 1skg h PHE 2046CO 0.04 -0.11 0.26 0.28 -2.23 0.00 0.00 178.31 176.54 1skg h VAL 2047N -0.10 1.26 -0.79 1.41 2.07 -0.95 -0.57 116.25 118.57 1skg h VAL 2047Ca 0.05 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 1skg h VAL 2047Cb 0.16 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1skg h VAL 2047CO -0.11 0.34 0.31 -0.74 0.02 0.00 0.00 177.57 177.40 1skg h HIS 2048N 1.08 1.21 -0.54 1.57 -0.00 -0.57 0.17 115.15 118.07 1skg h HIS 2048Ca 0.24 -0.09 -0.02 0.00 -0.00 0.00 0.00 60.37 60.49 1skg h HIS 2048Cb 0.27 -0.36 -0.02 0.00 -0.00 0.00 0.00 27.41 27.29 1skg h HIS 2048CO 0.02 0.92 0.24 -0.44 -0.00 0.00 0.00 177.93 178.67 1skg h ASP 2049N 1.16 0.73 -0.88 3.26 3.32 -0.47 -0.55 116.42 122.98 1skg h ASP 2049Ca 0.26 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1skg h ASP 2049Cb 0.22 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 1skg h ASP 2049CO -0.02 0.67 0.53 0.00 -1.72 0.00 0.00 179.24 178.70 1skg h TYR 2052N 0.24 0.55 0.00 0.00 -1.99 -0.87 -2.47 116.97 112.44 1skg h TYR 2052Ca 0.08 -0.06 -0.02 0.00 2.00 0.00 0.00 58.73 60.73 1skg h TYR 2052Cb 0.12 -0.16 -0.00 0.00 2.00 0.00 0.00 36.73 38.69 1skg h TYR 2052CO -0.02 0.54 -0.10 0.78 -0.00 0.00 0.00 178.16 179.36 1skg h GLY 2053N 0.84 0.00 2.00 3.88 0.00 0.13 -0.28 103.07 109.64 1skg h GLY 2053Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1skg h GLY 2053CO 0.01 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.25 1skg n ASN 2054N -3.76 0.46 -2.93 0.19 3.02 -0.41 -4.05 115.26 107.78 1skg n ASN 2054Ca -0.02 0.62 -0.25 0.00 -0.03 0.00 0.00 54.58 54.89 1skg n ASN 2054Cb 0.20 -0.71 -0.03 0.00 -0.61 0.00 0.00 39.78 38.63 1skg n ASN 2054CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1skg n LEU 2055N -2.01 3.97 0.30 3.41 4.77 -0.12 -4.92 117.00 122.41 1skg n LEU 2055Ca 0.02 -5.53 0.18 0.00 -0.03 0.00 0.00 56.01 50.66 1skg n LEU 2055Cb 0.20 -0.36 0.97 0.00 -2.33 0.00 0.00 43.42 41.89 1skg n LEU 2055CO 0.17 2.33 1.09 1.55 -1.33 0.00 0.00 177.39 181.20 1skg h PRO 2056N 2.95 0.00 -0.49 3.23 0.13 -1.74 -1.09 132.00 134.98 1skg h PRO 2056Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1skg h PRO 2056Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1skg h PRO 2056CO 0.77 0.03 0.00 -0.25 -0.23 0.00 0.00 178.00 178.32 1skg n ASP 2059N -3.32 4.47 -4.83 1.44 10.43 -1.26 -4.92 116.55 118.56 1skg n ASP 2059Ca -0.02 -2.63 -0.22 0.00 2.57 0.00 0.00 54.79 54.50 1skg n ASP 2059Cb 0.16 -0.54 -0.04 0.00 1.84 0.00 0.00 41.12 42.53 1skg n ASP 2059CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1skg n ASN 2067N -1.38 1.35 0.28 0.00 3.02 -1.26 -4.97 115.26 112.30 1skg n ASN 2067Ca -0.00 -2.85 0.17 0.00 -0.03 0.00 0.00 54.58 51.87 1skg n ASN 2067Cb 0.61 -0.65 0.78 0.00 -0.61 0.00 0.00 39.78 39.92 1skg n ASN 2067CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1skg h PRO 2068N 5.00 0.00 -0.51 3.52 0.13 -1.92 -0.24 132.00 137.98 1skg h PRO 2068Ca 0.18 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.25 1skg h PRO 2068Cb 0.82 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.92 1skg h PRO 2068CO 0.56 0.05 0.05 0.87 -0.23 0.00 0.00 178.00 179.30 1skg h LYS 2069N 0.00 0.83 0.00 0.86 1.79 -1.93 -3.25 116.57 114.87 1skg h LYS 2069Ca -0.00 -0.21 -0.02 0.00 -2.18 0.00 0.00 60.65 58.25 1skg h LYS 2069Cb 0.40 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.94 1skg h LYS 2069CO 0.01 0.80 -1.19 -1.13 -1.08 0.00 0.00 179.45 176.86 1skg n SER 2070N -4.23 4.12 -4.71 0.86 3.41 -0.92 -0.80 113.62 111.34 1skg n SER 2070Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.22 1skg n SER 2070Cb 0.28 1.04 -0.03 0.00 -0.26 0.00 0.00 64.21 65.24 1skg n SER 2070CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1skg s ASP 2071N -2.68 7.05 -0.00 4.04 -1.08 -0.15 -4.62 116.67 119.23 1skg s ASP 2071Ca -0.01 2.02 -0.13 0.00 -0.52 0.00 0.00 52.55 53.91 1skg s ASP 2071Cb 0.02 -2.58 -0.05 0.00 -1.46 0.00 0.00 42.92 38.85 1skg s ASP 2071CO 0.16 -0.50 0.36 -0.13 0.52 0.00 0.00 175.17 175.58 1skg s ARG 2072N 1.21 3.81 0.37 4.34 0.52 -1.26 -0.00 118.95 127.93 1skg s ARG 2072Ca 0.59 0.28 0.06 0.00 -0.52 0.00 0.00 55.73 56.14 1skg s ARG 2072Cb -0.30 -3.17 -0.07 0.00 0.52 0.00 0.00 34.95 31.93 1skg s ARG 2072CO 0.29 0.68 0.02 1.52 0.02 0.00 0.00 175.30 177.82 1skg s TYR 2073N -1.13 2.29 0.04 -0.53 -0.85 -1.26 -4.88 117.35 111.02 1skg s TYR 2073Ca 0.24 -0.76 0.07 0.00 -0.52 0.00 0.00 57.07 56.10 1skg s TYR 2073Cb -0.15 -1.54 -0.03 0.00 0.38 0.00 0.00 41.96 40.61 1skg s TYR 2073CO 0.13 0.29 -0.17 0.15 -1.52 0.00 0.00 175.55 174.44 1skg s LYS 2074N -3.77 2.12 0.13 -3.49 -0.14 -1.26 -4.94 119.74 108.39 1skg s LYS 2074Ca 0.35 -0.96 -0.08 0.00 -1.36 0.00 0.00 55.97 53.92 1skg s LYS 2074Cb 0.09 -2.22 -0.01 0.00 -1.68 0.00 0.00 37.83 34.01 1skg s LYS 2074CO 0.17 0.54 0.22 1.52 -0.76 0.00 0.00 175.35 177.05 1skg s TYR 2075N -0.94 0.31 0.37 3.18 -0.85 -1.26 -0.86 117.35 117.30 1skg s TYR 2075Ca 0.15 -0.71 0.05 0.00 -0.52 0.00 0.00 57.07 56.04 1skg s TYR 2075Cb -0.11 -0.09 -0.03 0.00 0.38 0.00 0.00 41.96 42.12 1skg s TYR 2075CO 0.06 -0.62 0.19 -1.59 -1.52 0.00 0.00 175.55 172.06 1skg s LYS 2076N -3.92 1.85 -0.09 -3.49 -2.85 -0.29 -4.91 119.74 106.03 1skg s LYS 2076Ca 0.12 -2.11 0.02 0.00 -1.00 0.00 0.00 55.97 53.01 1skg s LYS 2076Cb 0.04 -0.22 -0.02 0.00 -2.06 0.00 0.00 37.83 35.58 1skg s LYS 2076CO -0.05 -0.55 -0.16 1.03 0.10 0.00 0.00 175.35 175.72 1skg s ARG 2077N -3.62 2.97 -0.28 1.78 1.81 -1.26 -0.85 118.95 119.50 1skg s ARG 2077Ca 0.30 -0.74 0.03 0.00 -1.72 0.00 0.00 55.73 53.60 1skg s ARG 2077Cb 0.02 -2.45 0.08 0.00 -0.45 0.00 0.00 34.95 32.15 1skg s ARG 2077CO 0.19 0.35 -0.04 0.08 -0.68 0.00 0.00 175.30 175.21 1skg s VAL 2078N -0.04 2.03 0.00 3.52 1.01 0.15 -4.81 120.40 122.27 1skg s VAL 2078Ca -0.04 -1.79 0.00 0.00 0.00 0.00 0.00 61.98 60.14 1skg s VAL 2078Cb -0.14 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.93 1skg s VAL 2078CO 0.04 -0.26 0.00 0.59 0.00 0.00 0.00 175.10 175.47 1skg n ASN 2079N 4.43 0.00 0.00 3.32 4.13 -1.26 -1.39 115.26 124.49 1skg n ASN 2079Ca -0.07 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.19 1skg n ASN 2079Cb 0.42 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.66 1skg n ASN 2079CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1skg n GLY 2080N 0.39 1.17 3.76 7.41 0.00 -1.26 -4.99 105.19 111.66 1skg n GLY 2080Ca 0.00 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1skg n GLY 2080CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1skg s ALA 2081N -0.03 3.35 -0.01 4.61 0.00 -0.49 -4.97 121.76 124.22 1skg s ALA 2081Ca 0.00 0.54 -0.29 0.00 0.00 0.00 0.00 51.96 52.21 1skg s ALA 2081Cb 0.00 -3.14 -0.03 0.00 0.00 0.00 0.00 23.12 19.95 1skg s ALA 2081CO 0.00 0.23 0.93 0.42 0.00 0.00 0.00 175.76 177.34 1skg s ILE 2082N -1.23 4.90 -0.22 0.00 1.01 -1.26 -0.67 121.20 123.72 1skg s ILE 2082Ca 0.41 1.96 0.01 0.00 0.00 0.00 0.00 60.65 63.03 1skg s ILE 2082Cb -0.24 -4.27 0.05 0.00 0.01 0.00 0.00 42.46 38.00 1skg s ILE 2082CO 0.29 0.17 -0.10 -0.69 0.00 0.00 0.00 174.94 174.62 1skg s VAL 2083N 0.98 1.80 0.14 2.92 1.01 -0.03 -4.93 120.40 122.29 1skg s VAL 2083Ca 0.50 -1.24 -0.31 0.00 0.00 0.00 0.00 61.98 60.93 1skg s VAL 2083Cb -0.20 -1.91 -0.08 0.00 0.00 0.00 0.00 36.38 34.19 1skg s VAL 2083CO 0.26 0.07 1.29 0.00 0.00 0.00 0.00 175.10 176.73 1skg s GLU 2085N 0.55 3.54 -0.02 0.00 2.02 -0.04 -4.94 118.70 119.81 1skg s GLU 2085Ca 0.59 -0.05 -0.30 0.00 0.02 0.00 0.00 54.97 55.24 1skg s GLU 2085Cb -0.34 -2.54 -0.03 0.00 0.10 0.00 0.00 34.13 31.32 1skg s GLU 2085CO 0.33 0.01 0.99 0.21 0.02 0.00 0.00 175.26 176.82 1skg s LYS 2086N -4.37 4.53 0.00 1.61 2.20 -1.26 -4.65 119.74 117.80 1skg s LYS 2086Ca 0.44 1.43 0.00 0.00 -0.36 0.00 0.00 55.97 57.48 1skg s LYS 2086Cb -0.10 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 1skg s LYS 2086CO 0.39 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.68 1skg n GLY 2088N 2.95 5.37 3.74 5.54 0.00 -1.26 -4.97 105.19 116.55 1skg n GLY 2088Ca 0.07 -1.36 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 1skg n GLY 2088CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1skg s THR 2089N 2.66 2.68 0.18 2.61 -4.23 -1.26 -4.79 115.64 113.50 1skg s THR 2089Ca 0.00 0.22 -0.13 0.00 -1.18 0.00 0.00 61.69 60.60 1skg s THR 2089Cb 0.00 -2.78 0.08 0.00 1.34 0.00 0.00 72.50 71.14 1skg s THR 2089CO 0.00 -0.29 1.77 0.28 -0.54 0.00 0.00 174.62 175.84 1skg h SER 2090N -1.46 0.31 -0.65 3.99 0.02 -2.00 -0.27 113.55 113.49 1skg h SER 2090Ca -0.49 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1skg h SER 2090Cb 1.29 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.78 1skg h SER 2090CO 0.56 0.21 0.41 0.00 -1.14 0.00 0.00 176.83 176.88 1skg h GLU 2092N 0.88 1.22 -0.48 0.00 5.08 -1.70 0.64 114.58 120.21 1skg h GLU 2092Ca 0.23 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1skg h GLU 2092Cb -0.07 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 28.92 1skg h GLU 2092CO -0.05 0.90 0.27 -0.91 -1.00 0.00 0.00 179.01 178.22 1skg h ASN 2093N 1.22 0.59 -0.20 1.42 2.35 -0.74 -0.01 115.58 120.21 1skg h ASN 2093Ca 0.31 -0.09 -0.20 0.00 -0.55 0.00 0.00 56.30 55.77 1skg h ASN 2093Cb 0.05 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.27 1skg h ASN 2093CO -0.05 0.51 -0.62 0.03 -1.65 0.00 0.00 177.43 175.65 1skg h ARG 2094N 0.63 0.82 -0.30 0.81 3.08 -0.90 -1.63 114.38 116.89 1skg h ARG 2094Ca 0.17 -0.56 0.00 0.00 0.07 0.00 0.00 59.98 59.66 1skg h ARG 2094Cb 0.04 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1skg h ARG 2094CO -0.03 1.19 0.19 0.82 -1.07 0.00 0.00 179.97 181.07 1skg h ILE 2095N 0.61 1.09 -0.81 2.04 2.04 -0.76 -1.97 117.51 119.74 1skg h ILE 2095Ca -0.01 -0.19 0.05 0.00 1.00 0.00 0.00 64.86 65.72 1skg h ILE 2095Cb 1.23 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 37.93 1skg h ILE 2095CO 0.13 0.09 0.51 0.00 0.00 0.00 0.00 178.15 178.87 1skg h GLU 2097N 0.95 0.73 -0.29 0.00 4.39 -1.01 0.14 114.58 119.49 1skg h GLU 2097Ca 0.34 -0.22 0.02 0.00 0.34 0.00 0.00 59.36 59.84 1skg h GLU 2097Cb 0.10 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 1skg h GLU 2097CO -0.15 0.79 0.14 0.00 -1.16 0.00 0.00 179.01 178.64 1skg h ASP 2099N 0.30 0.51 -0.40 0.00 5.19 -0.71 -2.09 116.42 119.22 1skg h ASP 2099Ca 0.12 -0.39 0.08 0.00 -0.62 0.00 0.00 57.03 56.21 1skg h ASP 2099Cb 0.04 -0.14 -0.07 0.00 0.18 0.00 0.00 39.33 39.34 1skg h ASP 2099CO -0.08 0.78 -0.03 0.50 -3.12 0.00 0.00 179.24 177.29 1skg h LYS 2100N 0.22 0.07 -0.56 3.56 3.64 -0.74 0.30 116.57 123.07 1skg h LYS 2100Ca 0.06 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1skg h LYS 2100Cb 0.58 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 1skg h LYS 2100CO 0.03 0.05 0.32 0.00 -2.27 0.00 0.00 179.45 177.58 1skg h ALA 2101N 1.37 0.72 -0.59 5.00 0.00 -1.26 -1.23 119.26 123.27 1skg h ALA 2101Ca 0.20 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1skg h ALA 2101Cb 0.29 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1skg h ALA 2101CO -0.35 0.22 -0.02 0.00 0.00 0.00 0.00 179.25 179.10 1skg h ALA 2102N 1.15 0.85 -0.56 0.00 0.00 -0.85 0.97 119.26 120.82 1skg h ALA 2102Ca 0.20 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1skg h ALA 2102Cb 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1skg h ALA 2102CO -0.03 0.66 0.18 0.00 0.00 0.00 0.00 179.25 180.06 1skg h ALA 2103N 1.01 0.73 -0.53 0.00 0.00 -0.61 0.11 119.26 119.98 1skg h ALA 2103Ca 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1skg h ALA 2103Cb 0.58 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1skg h ALA 2103CO 0.03 0.40 0.35 0.82 0.00 0.00 0.00 179.25 180.85 1skg h ILE 2104N 0.78 1.14 -0.67 0.00 2.04 -1.08 -1.66 117.51 118.06 1skg h ILE 2104Ca 0.18 -0.27 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1skg h ILE 2104Cb 0.28 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 1skg h ILE 2104CO -0.01 0.14 0.43 0.00 0.00 0.00 0.00 178.15 178.71 1skg h PHE 2106N 0.86 1.09 -0.75 0.00 0.04 -0.48 -1.81 116.94 115.88 1skg h PHE 2106Ca 0.26 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.91 1skg h PHE 2106Cb -0.03 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 37.77 1skg h PHE 2106CO -0.04 0.86 0.37 -0.09 -0.60 0.00 0.00 178.31 178.82 1skg h ARG 2107N 1.01 1.08 0.00 1.51 9.65 -0.72 -1.21 114.38 125.69 1skg h ARG 2107Ca 0.23 -0.15 -0.00 0.00 -1.10 0.00 0.00 59.98 58.95 1skg h ARG 2107Cb 0.26 -0.20 -0.00 0.00 -1.39 0.00 0.00 29.97 28.64 1skg h ARG 2107CO -0.01 0.83 -0.01 0.37 2.80 0.00 0.00 179.97 183.95 1skg h GLN 2108N 1.06 0.00 -0.05 0.20 4.15 -0.41 -3.02 115.11 117.04 1skg h GLN 2108Ca 0.26 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.68 1skg h GLN 2108Cb 0.10 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.79 1skg h GLN 2108CO -0.03 0.01 0.00 0.09 -1.93 0.00 0.00 178.83 176.97 1skg n ASN 2109N -3.12 2.39 0.02 -0.69 3.02 -0.72 -4.62 115.26 111.54 1skg n ASN 2109Ca -0.01 -2.54 0.14 0.00 -0.03 0.00 0.00 54.58 52.15 1skg n ASN 2109Cb 0.22 -0.24 0.60 0.00 -0.61 0.00 0.00 39.78 39.75 1skg n ASN 2109CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1skg h LEU 2110N 0.33 0.15 -1.95 3.41 3.38 -1.11 -1.42 115.31 118.11 1skg h LEU 2110Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1skg h LEU 2110Cb 0.81 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1skg h LEU 2110CO 0.02 0.09 0.00 -0.55 0.09 0.00 0.00 178.44 178.09 1skg h ASN 2111N 0.17 0.00 -0.01 -0.43 -0.00 -1.84 -2.30 115.58 111.18 1skg h ASN 2111Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.51 1skg h ASN 2111Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.91 1skg h ASN 2111CO -0.03 0.00 0.00 0.35 -0.00 0.00 0.00 177.43 177.75 1skg n THR 2112N -2.76 0.31 -1.62 6.14 -2.24 -0.56 -5.03 114.28 108.52 1skg n THR 2112Ca -0.01 -0.66 -0.47 0.00 -2.27 0.00 0.00 64.05 60.65 1skg n THR 2112Cb 0.14 0.85 -0.03 0.00 -2.10 0.00 0.00 70.33 69.19 1skg n THR 2112CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1skg n TYR 2113N -0.11 1.67 -3.98 4.78 4.19 -0.87 -4.94 117.16 117.90 1skg n TYR 2113Ca 0.00 0.58 -0.26 0.00 3.31 0.00 0.00 57.90 61.53 1skg n TYR 2113Cb 0.09 -2.35 -0.17 0.00 0.49 0.00 0.00 39.34 37.40 1skg n TYR 2113CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 1skg s SER 2114N 0.05 2.11 0.62 2.98 0.01 -1.26 -5.01 113.70 113.20 1skg s SER 2114Ca 0.69 -0.30 0.37 0.00 1.31 0.00 0.00 55.95 58.03 1skg s SER 2114Cb -0.75 -0.83 2.05 0.00 0.21 0.00 0.00 66.02 66.70 1skg s SER 2114CO 0.52 -0.10 2.27 0.11 0.41 0.00 0.00 173.24 176.45 1skg h LYS 2115N 8.03 0.00 0.00 12.44 1.57 -1.99 -1.35 116.57 135.27 1skg h LYS 2115Ca -0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1skg h LYS 2115Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1skg h LYS 2115CO 0.41 0.02 0.00 0.36 -0.57 0.00 0.00 179.45 179.67 1skg n LYS 2116N -3.37 0.12 0.00 3.15 2.85 -1.26 -1.69 118.16 117.96 1skg n LYS 2116Ca -0.03 0.50 0.13 0.00 -1.05 0.00 0.00 58.31 57.86 1skg n LYS 2116Cb 0.12 -1.81 0.37 0.00 -0.65 0.00 0.00 35.03 33.06 1skg n LYS 2116CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1skg n TYR 2117N -2.06 0.00 -2.31 5.58 4.01 -0.51 -4.82 117.16 117.05 1skg n TYR 2117Ca 0.01 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.35 1skg n TYR 2117Cb 0.12 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.10 1skg n TYR 2117CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1skg s MET 2118N -2.11 4.37 -1.42 -0.72 -1.94 -0.68 -0.65 119.30 116.14 1skg s MET 2118Ca 0.32 1.94 -0.09 0.00 -1.71 0.00 0.00 55.69 56.15 1skg s MET 2118Cb 0.20 -2.98 0.02 0.00 2.01 0.00 0.00 34.83 34.08 1skg s MET 2118CO 0.37 -0.08 1.04 1.28 -0.01 0.00 0.00 175.02 177.63 1skg n LEU 2119N 0.71 -3.13 -4.72 -0.03 4.77 -0.46 -4.90 117.00 109.23 1skg n LEU 2119Ca 0.01 -0.52 -0.42 0.00 -0.03 0.00 0.00 56.01 55.05 1skg n LEU 2119Cb 0.44 -2.95 -0.03 0.00 -2.33 0.00 0.00 43.42 38.55 1skg n LEU 2119CO 0.54 0.54 1.03 -0.47 -1.33 0.00 0.00 177.39 177.71 1skg s TYR 2120N -3.28 3.24 0.28 -1.77 5.04 -1.01 -4.91 117.35 114.95 1skg s TYR 2120Ca 0.54 1.06 -0.29 0.00 -2.44 0.00 0.00 57.07 55.93 1skg s TYR 2120Cb -0.24 -3.66 -0.10 0.00 0.35 0.00 0.00 41.96 38.31 1skg s TYR 2120CO 0.67 -2.20 1.29 -2.14 -1.34 0.00 0.00 175.55 171.83 1skg s PRO 2121N 0.61 4.39 0.28 4.97 0.02 -1.26 -4.87 135.00 139.14 1skg s PRO 2121Ca 0.61 2.13 0.01 0.00 0.02 0.00 0.00 61.00 63.77 1skg s PRO 2121Cb -0.37 -3.12 0.56 0.00 0.02 0.00 0.00 34.50 31.59 1skg s PRO 2121CO 0.34 -0.17 1.81 0.22 -0.33 0.00 0.00 177.00 178.87 1skg h ASP 2122N 4.11 0.83 0.61 2.53 1.82 -1.94 -2.30 116.42 122.08 1skg h ASP 2122Ca -0.47 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.23 1skg h ASP 2122Cb 1.22 -0.10 0.00 0.00 0.68 0.00 0.00 39.33 41.13 1skg h ASP 2122CO 0.70 0.42 0.00 2.22 -1.61 0.00 0.00 179.24 180.96 1skg n PHE 2124N -4.69 0.64 1.67 0.28 -1.74 -1.26 -0.58 117.46 111.78 1skg n PHE 2124Ca 0.19 0.26 0.09 0.00 -0.56 0.00 0.00 57.45 57.43 1skg n PHE 2124Cb 0.39 -0.92 0.45 0.00 1.52 0.00 0.00 39.48 40.92 1skg n PHE 2124CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1skg n LEU 2125N -2.10 0.70 -4.05 5.98 4.77 -0.87 -4.62 117.00 116.82 1skg n LEU 2125Ca 0.02 -0.30 -0.33 0.00 -0.03 0.00 0.00 56.01 55.38 1skg n LEU 2125Cb 0.20 -0.05 -0.14 0.00 -2.33 0.00 0.00 43.42 41.10 1skg n LEU 2125CO 0.17 0.15 -0.28 0.00 -1.33 0.00 0.00 177.39 176.10 1skg s LYS 2127N 0.99 1.15 0.00 0.00 1.02 -1.26 -4.27 119.74 117.36 1skg s LYS 2127Ca 0.09 -0.48 0.00 0.00 0.02 0.00 0.00 55.97 55.60 1skg s LYS 2127Cb -0.20 -1.09 0.00 0.00 -0.52 0.00 0.00 37.83 36.01 1skg s LYS 2127CO -0.07 0.27 0.00 0.41 -0.92 0.00 0.00 175.35 175.05 1skg n GLY 2128N 2.82 2.47 3.85 -3.33 0.00 -1.26 -3.08 105.19 106.66 1skg n GLY 2128Ca -0.15 -1.67 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 1skg n GLY 2128CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1skg s GLU 2129N -4.38 3.31 -0.13 1.61 2.02 -1.26 0.21 118.70 120.09 1skg s GLU 2129Ca 0.00 -0.32 0.01 0.00 0.02 0.00 0.00 54.97 54.68 1skg s GLU 2129Cb 0.00 -3.04 0.02 0.00 0.10 0.00 0.00 34.13 31.21 1skg s GLU 2129CO 0.00 0.70 -0.15 -1.17 0.02 0.00 0.00 175.26 174.65 1skg s LEU 2130N -1.58 1.73 0.36 1.80 0.20 -1.26 -4.91 118.68 115.03 1skg s LEU 2130Ca 0.22 -0.47 -0.25 0.00 0.69 0.00 0.00 54.13 54.32 1skg s LEU 2130Cb -0.12 -1.16 -0.09 0.00 -0.43 0.00 0.00 46.19 44.39 1skg s LEU 2130CO 0.13 -0.01 1.05 -0.54 -0.29 0.00 0.00 176.35 176.68 1skg s LYS 2131N 1.21 4.32 0.00 1.98 1.02 -1.26 -5.05 119.74 121.96 1skg s LYS 2131Ca -0.01 1.55 0.13 0.00 0.02 0.00 0.00 55.97 57.67 1skg s LYS 2131Cb -0.14 -2.71 0.80 0.00 -0.52 0.00 0.00 37.83 35.26 1skg s LYS 2131CO -0.06 -0.01 1.22 0.00 -0.92 0.00 0.00 175.35 175.58