#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g5u h TRP 2003N 0.00 0.56 -0.21 0.66 -0.00 -1.96 0.19 115.95 115.19 1g5u h TRP 2003Ca 0.00 0.01 -0.10 0.00 -0.00 0.00 0.00 58.89 58.81 1g5u h TRP 2003Cb 0.00 -0.18 -0.06 0.00 -0.00 0.00 0.00 29.16 28.92 1g5u h TRP 2003CO 0.00 0.30 0.12 0.94 -0.00 0.00 0.00 178.44 179.81 1g5u n GLN 2004N -4.47 1.39 0.00 0.49 -0.06 -1.26 -1.97 117.38 111.49 1g5u n GLN 2004Ca 0.08 -0.69 0.00 0.00 -2.00 0.00 0.00 57.00 54.39 1g5u n GLN 2004Cb 0.24 -1.34 0.00 0.00 -4.06 0.00 0.00 30.24 25.08 1g5u n GLN 2004CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 1g5u n THR 2005N 0.13 0.00 0.00 1.69 -2.24 -0.08 -4.08 114.28 109.69 1g5u n THR 2005Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1g5u n THR 2005Cb 0.72 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 1g5u n THR 2005CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1g5u n TYR 2006N -1.92 0.00 0.00 4.78 4.02 0.48 0.47 117.16 124.99 1g5u n TYR 2006Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1g5u n TYR 2006Cb 0.08 -0.31 0.00 0.00 -0.02 0.00 0.00 39.34 39.10 1g5u n TYR 2006CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1g5u n VAL 2007N -1.30 0.00 1.58 -0.72 0.31 -0.83 -3.96 118.33 113.41 1g5u n VAL 2007Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 1g5u n VAL 2007Cb 0.01 -1.23 0.61 0.00 -0.91 0.00 0.00 33.84 32.32 1g5u n VAL 2007CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1g5u n ASP 2008N -2.86 1.06 -0.00 4.52 8.00 -1.00 -1.45 116.55 124.82 1g5u n ASP 2008Ca 0.00 -1.27 0.00 0.00 0.71 0.00 0.00 54.79 54.24 1g5u n ASP 2008Cb 0.47 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.57 1g5u n ASP 2008CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1g5u n ASP 2009N -0.24 1.34 0.06 -2.24 9.92 0.18 -4.61 116.55 120.96 1g5u n ASP 2009Ca 0.19 -0.37 0.00 0.00 -0.53 0.00 0.00 54.79 54.08 1g5u n ASP 2009Cb 0.30 1.01 0.00 0.00 -0.64 0.00 0.00 41.12 41.78 1g5u n ASP 2009CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1g5u n HIS 2010N -1.15 -0.40 0.23 1.24 8.25 -1.16 -4.72 115.22 117.52 1g5u n HIS 2010Ca 0.00 0.07 0.04 0.00 -0.26 0.00 0.00 57.72 57.57 1g5u n HIS 2010Cb 0.01 0.10 0.19 0.00 1.12 0.00 0.00 29.99 31.41 1g5u n HIS 2010CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1g5u n LEU 2011N -3.43 0.08 -3.13 2.41 4.77 -0.53 -3.63 117.00 113.54 1g5u n LEU 2011Ca 0.00 0.53 -0.20 0.00 -0.03 0.00 0.00 56.01 56.31 1g5u n LEU 2011Cb 0.05 -0.53 -0.04 0.00 -2.33 0.00 0.00 43.42 40.57 1g5u n LEU 2011CO 0.00 -0.44 -0.20 0.23 -1.33 0.00 0.00 177.39 175.65 1g5u n MET 2012N -1.59 0.82 -3.28 3.23 2.81 -0.69 -4.71 117.12 113.70 1g5u n MET 2012Ca 0.01 -3.07 -0.21 0.00 -1.81 0.00 0.00 57.70 52.62 1g5u n MET 2012Cb 0.08 -1.39 0.03 0.00 -0.71 0.00 0.00 33.22 31.24 1g5u n MET 2012CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1g5u n ASP 2014N -2.05 6.71 -4.59 0.00 10.43 -1.26 -3.75 116.55 122.05 1g5u n ASP 2014Ca 0.10 -3.33 -0.52 0.00 2.57 0.00 0.00 54.79 53.62 1g5u n ASP 2014Cb 0.62 -1.17 -0.06 0.00 1.84 0.00 0.00 41.12 42.35 1g5u n ASP 2014CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 1g5u n ILE 2015N 0.48 0.12 0.00 0.53 -5.35 -1.26 -3.23 119.36 110.65 1g5u n ILE 2015Ca 0.48 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.93 1g5u n ILE 2015Cb 0.50 -0.83 0.00 0.00 -1.74 0.00 0.00 39.64 37.57 1g5u n ILE 2015CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1g5u n ASP 2016N 2.47 0.00 -0.40 7.28 2.03 -1.26 -1.65 116.55 125.02 1g5u n ASP 2016Ca 0.18 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.48 1g5u n ASP 2016Cb 0.20 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.59 1g5u n ASP 2016CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1g5u n GLY 2017N 0.00 0.40 3.31 0.27 0.00 -1.20 -5.13 105.19 102.84 1g5u n GLY 2017Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1g5u n GLY 2017CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1g5u s HIS 2018N 0.00 -0.81 1.06 1.61 -3.43 -0.66 -5.07 115.29 107.99 1g5u s HIS 2018Ca 0.00 1.56 -0.18 0.00 -0.80 0.00 0.00 55.06 55.65 1g5u s HIS 2018Cb 0.00 0.35 0.27 0.00 -1.43 0.00 0.00 32.58 31.77 1g5u s HIS 2018CO 0.00 -0.47 0.62 0.54 -2.00 0.00 0.00 174.74 173.42 1g5u n ARG 2019N 5.17 -4.00 0.00 -0.38 1.74 -1.25 -4.12 116.66 113.83 1g5u n ARG 2019Ca -0.12 -1.04 0.00 0.00 -0.77 0.00 0.00 57.85 55.93 1g5u n ARG 2019Cb 0.51 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.58 1g5u n ARG 2019CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1g5u n LEU 2020N 0.00 0.00 0.00 0.55 0.00 -1.26 -4.92 117.00 111.37 1g5u n LEU 2020Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.11 1g5u n LEU 2020Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.85 1g5u n LEU 2020CO 0.28 0.00 -0.09 0.41 0.00 0.00 0.00 177.39 177.99 1g5u n THR 2021N 0.00 0.00 -3.15 1.96 -1.04 -0.62 -4.93 114.28 106.50 1g5u n THR 2021Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 1g5u n THR 2021Cb 0.00 -0.37 -0.00 0.00 -1.82 0.00 0.00 70.33 68.14 1g5u n THR 2021CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1g5u s ALA 2022N -1.57 -2.75 0.50 2.41 0.00 -1.18 -4.76 121.76 114.42 1g5u s ALA 2022Ca 0.00 1.15 -0.00 0.00 0.00 0.00 0.00 51.96 53.10 1g5u s ALA 2022Cb 0.00 -2.59 0.01 0.00 0.00 0.00 0.00 23.12 20.54 1g5u s ALA 2022CO 0.00 -1.87 0.74 0.00 0.00 0.00 0.00 175.76 174.63 1g5u s ALA 2023N 2.86 3.72 -0.30 0.00 0.00 -1.26 -2.79 121.76 123.99 1g5u s ALA 2023Ca 0.14 -1.08 -0.20 0.00 0.00 0.00 0.00 51.96 50.82 1g5u s ALA 2023Cb -0.08 -2.20 0.20 0.00 0.00 0.00 0.00 23.12 21.04 1g5u s ALA 2023CO -0.25 -0.56 1.31 0.00 0.00 0.00 0.00 175.76 176.25 1g5u s ALA 2024N -2.69 -2.44 -0.13 0.00 0.00 -0.94 0.24 121.76 115.79 1g5u s ALA 2024Ca 0.52 1.87 -0.01 0.00 0.00 0.00 0.00 51.96 54.33 1g5u s ALA 2024Cb -0.10 -1.87 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 1g5u s ALA 2024CO 0.39 -0.23 -0.08 0.42 0.00 0.00 0.00 175.76 176.26 1g5u s ILE 2025N 0.62 3.49 0.12 0.00 1.01 0.23 -1.27 121.20 125.41 1g5u s ILE 2025Ca -0.02 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.14 1g5u s ILE 2025Cb -0.04 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 1g5u s ILE 2025CO -0.12 0.52 -0.04 -0.63 0.00 0.00 0.00 174.94 174.66 1g5u s ILE 2026N 0.18 0.71 0.61 2.92 1.09 -0.03 -2.53 121.20 124.15 1g5u s ILE 2026Ca -0.05 -1.96 -0.07 0.00 -1.10 0.00 0.00 60.65 57.48 1g5u s ILE 2026Cb -0.14 -1.83 0.01 0.00 -1.06 0.00 0.00 42.46 39.43 1g5u s ILE 2026CO 0.04 -0.74 0.94 -0.83 -0.10 0.00 0.00 174.94 174.25 1g5u s GLY 2027N -3.09 1.61 0.00 6.18 0.00 0.12 0.67 107.32 112.81 1g5u s GLY 2027Ca 0.16 -0.61 0.00 0.00 0.00 0.00 0.00 44.72 44.27 1g5u s GLY 2027CO -0.02 -0.31 0.20 1.42 0.00 0.00 0.00 173.10 174.39 1g5u n HIS 2028N -2.67 0.00 -0.65 1.90 8.25 -0.80 -1.26 115.22 119.99 1g5u n HIS 2028Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1g5u n HIS 2028Cb 0.57 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.68 1g5u n HIS 2028CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1g5u n ASP 2029N -0.38 0.38 0.00 0.41 5.75 -1.26 -5.02 116.55 116.43 1g5u n ASP 2029Ca 0.00 -1.03 0.00 0.00 -0.01 0.00 0.00 54.79 53.75 1g5u n ASP 2029Cb 0.01 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 1g5u n ASP 2029CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1g5u n GLY 2030N -0.01 2.81 3.62 6.12 0.00 -0.39 -4.99 105.19 112.34 1g5u n GLY 2030Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.44 1g5u n GLY 2030CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1g5u n SER 2031N 0.00 1.95 -4.56 1.61 3.41 -1.26 -4.56 113.62 110.21 1g5u n SER 2031Ca 0.00 0.94 -0.43 0.00 -0.26 0.00 0.00 58.87 59.12 1g5u n SER 2031Cb 0.00 -1.09 -0.00 0.00 -0.26 0.00 0.00 64.21 62.86 1g5u n SER 2031CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1g5u s VAL 2032N 4.40 4.26 0.21 -3.33 1.01 -1.26 -0.70 120.40 124.99 1g5u s VAL 2032Ca 1.04 -1.96 -0.15 0.00 0.00 0.00 0.00 61.98 60.92 1g5u s VAL 2032Cb -1.16 -5.14 0.23 0.00 0.00 0.00 0.00 36.38 30.30 1g5u s VAL 2032CO 0.66 -1.96 1.62 -0.50 0.00 0.00 0.00 175.10 174.92 1g5u h TRP 2033N 7.65 -0.45 -2.19 5.22 4.06 -1.80 -3.45 115.95 124.99 1g5u h TRP 2033Ca 0.41 0.06 0.12 0.00 2.06 0.00 0.00 58.89 61.54 1g5u h TRP 2033Cb 0.88 0.30 -0.16 0.00 -1.00 0.00 0.00 29.16 29.18 1g5u h TRP 2033CO 1.37 -0.30 0.52 0.00 -3.56 0.00 0.00 178.44 176.46 1g5u s ALA 2034N -6.19 -1.85 -0.12 1.49 0.00 -1.05 -4.87 121.76 109.17 1g5u s ALA 2034Ca -0.14 1.08 -0.31 0.00 0.00 0.00 0.00 51.96 52.59 1g5u s ALA 2034Cb 0.19 0.33 0.13 0.00 0.00 0.00 0.00 23.12 23.77 1g5u s ALA 2034CO 0.73 -0.67 1.04 1.14 0.00 0.00 0.00 175.76 178.01 1g5u s GLN 2035N -2.99 0.56 0.91 0.00 -2.07 -1.26 0.75 119.66 115.56 1g5u s GLN 2035Ca 0.05 -0.10 -0.12 0.00 -1.82 0.00 0.00 55.36 53.37 1g5u s GLN 2035Cb -0.01 0.26 0.08 0.00 -1.09 0.00 0.00 33.01 32.25 1g5u s GLN 2035CO -0.08 -0.22 0.81 -1.13 -1.32 0.00 0.00 175.29 173.34 1g5u n SER 2036N 0.12 -0.70 -0.05 12.60 3.41 0.14 -4.88 113.62 124.26 1g5u n SER 2036Ca -0.06 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 58.96 1g5u n SER 2036Cb 0.59 -1.35 0.30 0.00 -0.26 0.00 0.00 64.21 63.49 1g5u n SER 2036CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1g5u h SER 2037N -1.57 0.58 -0.64 4.04 4.64 -1.94 -2.49 113.55 116.17 1g5u h SER 2037Ca -0.44 -0.07 -0.13 0.00 -0.47 0.00 0.00 61.79 60.68 1g5u h SER 2037Cb 1.28 -0.15 -0.08 0.00 -0.31 0.00 0.00 62.40 63.14 1g5u h SER 2037CO 0.39 0.55 0.17 -1.20 -0.87 0.00 0.00 176.83 175.87 1g5u n SER 2038N -4.34 4.92 -4.77 4.97 7.64 -1.26 -4.95 113.62 115.82 1g5u n SER 2038Ca 0.03 -3.04 -0.38 0.00 1.01 0.00 0.00 58.87 56.49 1g5u n SER 2038Cb 0.17 -0.71 -0.06 0.00 -1.01 0.00 0.00 64.21 62.59 1g5u n SER 2038CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1g5u s PHE 2039N -2.75 3.83 0.13 1.43 5.36 -0.94 -4.80 117.98 120.24 1g5u s PHE 2039Ca 0.51 1.78 -0.30 0.00 -0.96 0.00 0.00 56.93 57.96 1g5u s PHE 2039Cb 0.40 -2.89 -0.06 0.00 -0.34 0.00 0.00 43.02 40.13 1g5u s PHE 2039CO 0.13 0.36 0.98 -1.25 -1.46 0.00 0.00 175.22 173.99 1g5u s PRO 2040N -1.58 4.69 -0.61 10.12 0.04 -1.26 -4.99 135.00 141.42 1g5u s PRO 2040Ca 0.44 1.49 -0.26 0.00 0.04 0.00 0.00 61.00 62.71 1g5u s PRO 2040Cb -0.22 -3.36 -0.08 0.00 0.04 0.00 0.00 34.50 30.89 1g5u s PRO 2040CO 0.27 0.21 2.30 -1.14 0.04 0.00 0.00 177.00 178.67 1g5u s GLN 2041N -0.11 2.08 0.00 4.56 -0.44 -1.26 -4.39 119.66 120.10 1g5u s GLN 2041Ca 0.47 0.95 0.00 0.00 -2.50 0.00 0.00 55.36 54.28 1g5u s GLN 2041Cb -0.24 -4.64 0.00 0.00 -1.64 0.00 0.00 33.01 26.49 1g5u s GLN 2041CO 0.31 -3.49 0.00 1.97 0.50 0.00 0.00 175.29 174.57 1g5u n PHE 2042N 16.00 0.00 -3.69 1.67 -1.74 -1.26 -4.06 117.46 124.38 1g5u n PHE 2042Ca 0.37 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 57.15 1g5u n PHE 2042Cb 0.51 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.41 1g5u n PHE 2042CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 1g5u s LYS 2043N 0.00 0.48 0.47 3.97 2.20 -1.26 -4.70 119.74 120.91 1g5u s LYS 2043Ca 0.00 0.83 0.35 0.00 -0.36 0.00 0.00 55.97 56.79 1g5u s LYS 2043Cb 0.00 0.07 1.49 0.00 -1.51 0.00 0.00 37.83 37.88 1g5u s LYS 2043CO 0.00 -0.14 1.64 0.66 -0.36 0.00 0.00 175.35 177.16 1g5u h SER 2044N 6.69 0.17 0.04 1.43 4.64 -1.96 0.13 113.55 124.70 1g5u h SER 2044Ca -0.33 0.09 -0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1g5u h SER 2044Cb 1.19 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1g5u h SER 2044CO 0.25 -0.11 -0.02 0.44 -0.87 0.00 0.00 176.83 176.53 1g5u h ASP 2045N 0.08 -0.04 -1.29 4.97 3.32 -1.98 -1.94 116.42 119.53 1g5u h ASP 2045Ca 0.81 -0.58 0.45 0.00 0.02 0.00 0.00 57.03 57.72 1g5u h ASP 2045Cb 2.74 0.01 -0.14 0.00 0.22 0.00 0.00 39.33 42.16 1g5u h ASP 2045CO -0.28 0.70 0.81 -0.33 -1.72 0.00 0.00 179.24 178.43 1g5u h GLU 2046N -0.94 0.04 -0.15 3.56 5.08 -1.07 2.58 114.58 123.68 1g5u h GLU 2046Ca -0.01 -0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 1g5u h GLU 2046Cb 0.63 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1g5u h GLU 2046CO 0.01 0.02 -0.41 0.28 -1.00 0.00 0.00 179.01 177.91 1g5u h VAL 2047N 0.04 1.35 -0.70 3.13 2.07 -1.23 -2.94 116.25 117.97 1g5u h VAL 2047Ca 0.86 -1.68 0.06 0.00 0.82 0.00 0.00 66.70 66.76 1g5u h VAL 2047Cb 2.63 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 34.37 1g5u h VAL 2047CO -0.51 0.51 0.46 0.00 0.02 0.00 0.00 177.57 178.05 1g5u h ALA 2048N 0.54 1.73 0.21 1.67 0.00 0.52 -1.20 119.26 122.74 1g5u h ALA 2048Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1g5u h ALA 2048Cb 1.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1g5u h ALA 2048CO 0.09 0.16 -0.10 0.00 0.00 0.00 0.00 179.25 179.40 1g5u h ALA 2049N 1.62 -0.28 -0.67 0.00 0.00 -0.97 -0.17 119.26 118.79 1g5u h ALA 2049Ca 0.30 -0.13 0.13 0.00 0.00 0.00 0.00 54.91 55.21 1g5u h ALA 2049Cb 0.26 0.11 -0.13 0.00 0.00 0.00 0.00 17.79 18.04 1g5u h ALA 2049CO -0.10 -0.57 -0.24 0.28 0.00 0.00 0.00 179.25 178.62 1g5u h VAL 2050N -0.47 0.24 -0.38 0.00 2.07 -1.12 0.50 116.25 117.09 1g5u h VAL 2050Ca -0.03 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1g5u h VAL 2050Cb 0.35 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1g5u h VAL 2050CO 0.05 0.00 0.13 0.24 0.02 0.00 0.00 177.57 178.00 1g5u h MET 2051N -0.07 0.54 0.21 1.57 2.86 -0.99 -2.30 114.93 116.75 1g5u h MET 2051Ca 0.30 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 1g5u h MET 2051Cb 0.53 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1g5u h MET 2051CO -0.72 0.47 -0.10 -0.22 1.06 0.00 0.00 176.91 177.41 1g5u h LYS 2052N 0.54 -0.27 -0.82 1.72 3.64 0.18 -2.78 116.57 118.77 1g5u h LYS 2052Ca 0.13 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1g5u h LYS 2052Cb 0.15 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 1g5u h LYS 2052CO -0.01 -0.17 0.37 0.22 -2.27 0.00 0.00 179.45 177.59 1g5u h ASP 2053N -0.29 1.10 -0.92 4.20 3.58 -0.85 -1.86 116.42 121.37 1g5u h ASP 2053Ca -0.03 -0.15 0.13 0.00 0.42 0.00 0.00 57.03 57.40 1g5u h ASP 2053Cb 0.22 -0.28 -0.07 0.00 1.72 0.00 0.00 39.33 40.92 1g5u h ASP 2053CO 0.05 0.95 0.59 -0.26 -2.88 0.00 0.00 179.24 177.68 1g5u h PHE 2054N 1.18 0.94 0.10 0.28 0.04 -1.19 0.48 116.94 118.78 1g5u h PHE 2054Ca 0.28 0.03 -0.27 0.00 2.80 0.00 0.00 57.97 60.81 1g5u h PHE 2054Cb 0.16 -0.30 0.01 0.00 2.20 0.00 0.00 35.95 38.02 1g5u h PHE 2054CO 0.02 0.38 -1.18 -0.44 -0.60 0.00 0.00 178.31 176.49 1g5u h ASP 2055N 0.82 0.55 -2.78 2.17 5.19 -1.23 -3.29 116.42 117.85 1g5u h ASP 2055Ca 0.45 -0.53 -0.59 0.00 -0.62 0.00 0.00 57.03 55.75 1g5u h ASP 2055Cb 0.58 -0.17 -0.39 0.00 0.18 0.00 0.00 39.33 39.52 1g5u h ASP 2055CO -0.22 1.38 -0.83 -1.61 -3.12 0.00 0.00 179.24 174.84 1g5u s GLU 2056N -2.87 0.75 0.81 3.56 2.02 -0.37 -4.99 118.70 117.62 1g5u s GLU 2056Ca -0.06 -1.55 -0.17 0.00 0.02 0.00 0.00 54.97 53.21 1g5u s GLU 2056Cb 0.07 -1.56 -0.12 0.00 0.10 0.00 0.00 34.13 32.63 1g5u s GLU 2056CO 0.89 -1.21 -0.30 -2.30 0.02 0.00 0.00 175.26 172.35 1g5u n PRO 2057N 3.83 0.02 0.00 0.39 -0.02 0.15 -3.66 135.00 135.71 1g5u n PRO 2057Ca 0.13 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1g5u n PRO 2057Cb 0.37 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 1g5u n PRO 2057CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1g5u n GLY 2058N 2.76 2.06 0.00 -1.23 0.00 -1.26 -4.83 105.19 102.69 1g5u n GLY 2058Ca 0.03 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1g5u n GLY 2058CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1g5u n SER 2059N 4.18 0.00 0.11 1.61 3.41 -1.24 0.25 113.62 121.94 1g5u n SER 2059Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1g5u n SER 2059Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1g5u n SER 2059CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1g5u h LEU 2060N 0.00 -0.32 -0.56 1.04 6.46 -1.87 -3.36 115.31 116.70 1g5u h LEU 2060Ca 0.00 0.01 0.15 0.00 -0.12 0.00 0.00 57.88 57.92 1g5u h LEU 2060Cb 0.00 0.08 -0.10 0.00 -0.73 0.00 0.00 40.66 39.91 1g5u h LEU 2060CO 0.00 0.14 0.01 0.00 -0.62 0.00 0.00 178.44 177.97 1g5u n ALA 2061N -2.75 0.29 0.07 1.25 0.00 0.69 -0.94 120.51 119.12 1g5u n ALA 2061Ca -0.05 0.60 -0.11 0.00 0.00 0.00 0.00 53.44 53.89 1g5u n ALA 2061Cb 0.15 -0.44 -0.06 0.00 0.00 0.00 0.00 19.45 19.10 1g5u n ALA 2061CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1g5u h PRO 2062N 0.00 -0.47 0.00 0.00 0.11 -1.70 -2.61 132.00 127.33 1g5u h PRO 2062Ca 0.34 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.48 1g5u h PRO 2062Cb 0.70 0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1g5u h PRO 2062CO -0.53 -0.31 0.00 1.79 -0.21 0.00 0.00 178.00 178.74 1g5u h THR 2063N -0.48 0.00 0.00 -1.15 1.35 -1.55 -3.50 112.91 107.58 1g5u h THR 2063Ca -0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1g5u h THR 2063Cb 0.49 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 1g5u h THR 2063CO -0.19 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.69 1g5u n GLY 2064N 0.92 -0.81 3.14 5.82 0.00 -0.11 -4.85 105.19 109.29 1g5u n GLY 2064Ca 0.04 -1.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.03 1g5u n GLY 2064CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g5u s LEU 2065N -1.79 3.69 -0.14 0.99 2.96 -0.93 -4.67 118.68 118.79 1g5u s LEU 2065Ca 0.00 -1.28 -0.06 0.00 -0.22 0.00 0.00 54.13 52.58 1g5u s LEU 2065Cb 0.00 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 1g5u s LEU 2065CO 0.00 -0.23 0.06 -1.00 -1.32 0.00 0.00 176.35 173.86 1g5u s HIS 2066N 1.21 3.30 -0.23 5.38 3.76 -1.26 0.10 115.29 127.55 1g5u s HIS 2066Ca -0.06 0.20 -0.31 0.00 -0.15 0.00 0.00 55.06 54.74 1g5u s HIS 2066Cb -0.20 -1.96 0.16 0.00 1.11 0.00 0.00 32.58 31.69 1g5u s HIS 2066CO -0.03 0.37 1.24 -1.17 -0.85 0.00 0.00 174.74 174.30 1g5u s LEU 2067N -0.30 -0.14 0.00 0.89 0.20 0.71 -4.71 118.68 115.33 1g5u s LEU 2067Ca 0.08 0.11 0.00 0.00 0.69 0.00 0.00 54.13 55.02 1g5u s LEU 2067Cb -0.12 1.34 0.00 0.00 -0.43 0.00 0.00 46.19 46.98 1g5u s LEU 2067CO 0.02 -0.16 0.00 0.61 -0.29 0.00 0.00 176.35 176.53 1g5u n GLY 2068N 0.39 0.10 0.00 7.98 0.00 -1.26 -2.61 105.19 109.80 1g5u n GLY 2068Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1g5u n GLY 2068CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g5u n GLY 2069N 0.07 2.61 3.76 -0.02 0.00 -1.26 -4.64 105.19 105.71 1g5u n GLY 2069Ca 0.00 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.98 1g5u n GLY 2069CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1g5u s THR 2070N 0.00 3.00 0.13 2.61 -4.23 -1.07 -4.91 115.64 111.17 1g5u s THR 2070Ca 0.00 0.54 -0.02 0.00 -1.18 0.00 0.00 61.69 61.03 1g5u s THR 2070Cb 0.00 -3.12 -0.05 0.00 1.34 0.00 0.00 72.50 70.68 1g5u s THR 2070CO 0.00 -0.22 0.33 -0.75 -0.54 0.00 0.00 174.62 173.44 1g5u s LYS 2071N -3.70 3.54 0.12 3.99 2.20 -1.26 -0.21 119.74 124.42 1g5u s LYS 2071Ca 0.71 -0.27 0.04 0.00 -0.36 0.00 0.00 55.97 56.09 1g5u s LYS 2071Cb -0.24 -2.91 -0.04 0.00 -1.51 0.00 0.00 37.83 33.13 1g5u s LYS 2071CO 0.36 0.50 -0.10 0.71 -0.36 0.00 0.00 175.35 176.46 1g5u s TYR 2072N -1.67 1.16 -0.40 4.03 1.51 0.28 -4.80 117.35 117.47 1g5u s TYR 2072Ca 0.38 -0.74 -0.14 0.00 -1.01 0.00 0.00 57.07 55.56 1g5u s TYR 2072Cb -0.12 -0.61 0.02 0.00 -0.11 0.00 0.00 41.96 41.14 1g5u s TYR 2072CO 0.27 0.03 0.28 -1.64 -1.11 0.00 0.00 175.55 173.38 1g5u s MET 2073N -3.43 2.95 1.11 -0.62 -1.94 -0.14 -2.19 119.30 115.05 1g5u s MET 2073Ca 0.12 -1.03 -0.19 0.00 -1.71 0.00 0.00 55.69 52.88 1g5u s MET 2073Cb 0.01 -3.94 0.08 0.00 2.01 0.00 0.00 34.83 32.99 1g5u s MET 2073CO -0.00 -0.74 -0.12 1.55 -0.01 0.00 0.00 175.02 175.70 1g5u n VAL 2074N 5.13 0.00 0.00 -6.03 3.14 -1.26 -1.24 118.33 118.07 1g5u n VAL 2074Ca -0.11 -0.27 0.00 0.00 -2.96 0.00 0.00 64.34 60.99 1g5u n VAL 2074Cb 0.47 -0.55 0.00 0.00 -1.06 0.00 0.00 33.84 32.69 1g5u n VAL 2074CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1g5u n ILE 2075N -4.33 0.00 -3.74 1.55 5.41 0.13 -4.72 119.36 113.65 1g5u n ILE 2075Ca 0.01 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.62 1g5u n ILE 2075Cb 0.63 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 39.47 1g5u n ILE 2075CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 1g5u s GLN 2076N 0.00 0.53 -0.24 0.38 0.74 -1.26 -4.99 119.66 114.82 1g5u s GLN 2076Ca 0.00 0.31 -0.31 0.00 0.05 0.00 0.00 55.36 55.41 1g5u s GLN 2076Cb 0.00 0.25 0.17 0.00 1.10 0.00 0.00 33.01 34.53 1g5u s GLN 2076CO 0.00 -0.10 1.26 0.20 -0.55 0.00 0.00 175.29 176.10 1g5u s GLY 2077N -0.29 -0.08 -0.45 2.59 0.00 -1.26 -3.57 107.32 104.26 1g5u s GLY 2077Ca -0.04 2.36 -0.30 0.00 0.00 0.00 0.00 44.72 46.73 1g5u s GLY 2077CO 0.02 0.93 2.34 -2.21 0.00 0.00 0.00 173.10 174.18 1g5u n GLU 2078N 0.39 1.10 -1.43 2.90 2.13 -1.23 -4.69 120.64 119.81 1g5u n GLU 2078Ca -0.01 0.20 -0.49 0.00 0.66 0.00 0.00 57.16 57.52 1g5u n GLU 2078Cb 0.58 -2.82 -0.09 0.00 0.27 0.00 0.00 31.44 29.39 1g5u n GLU 2078CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1g5u n PRO 2079N 8.62 0.71 0.00 5.31 -0.04 -1.26 0.21 135.00 148.54 1g5u n PRO 2079Ca 0.41 0.16 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1g5u n PRO 2079Cb 0.35 -2.25 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 1g5u n PRO 2079CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1g5u n GLY 2080N 6.64 0.25 0.65 0.55 0.00 -1.24 -4.88 105.19 107.16 1g5u n GLY 2080Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1g5u n GLY 2080CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g5u n ALA 2081N -1.70 2.49 -2.29 4.61 0.00 0.55 -4.92 120.51 119.25 1g5u n ALA 2081Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1g5u n ALA 2081Cb 0.00 0.34 -0.10 0.00 0.00 0.00 0.00 19.45 19.69 1g5u n ALA 2081CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1g5u s VAL 2082N -1.84 1.41 -0.18 0.00 1.01 0.76 -2.28 120.40 119.27 1g5u s VAL 2082Ca 0.00 -2.12 -0.08 0.00 0.00 0.00 0.00 61.98 59.77 1g5u s VAL 2082Cb 0.00 -1.94 0.07 0.00 0.00 0.00 0.00 36.38 34.51 1g5u s VAL 2082CO 0.00 -0.68 0.42 -0.63 0.00 0.00 0.00 175.10 174.21 1g5u s ILE 2083N -3.18 -0.31 -0.04 2.22 1.01 -1.15 -3.52 121.20 116.24 1g5u s ILE 2083Ca 0.19 0.13 0.04 0.00 0.00 0.00 0.00 60.65 61.01 1g5u s ILE 2083Cb 0.01 -0.64 -0.03 0.00 0.01 0.00 0.00 42.46 41.81 1g5u s ILE 2083CO 0.03 0.05 -0.13 -0.13 0.00 0.00 0.00 174.94 174.77 1g5u s ARG 2084N 1.96 2.50 0.07 2.79 0.52 -1.23 0.03 118.95 125.59 1g5u s ARG 2084Ca -0.06 -0.71 0.03 0.00 -0.52 0.00 0.00 55.73 54.47 1g5u s ARG 2084Cb -0.10 -2.40 -0.03 0.00 0.52 0.00 0.00 34.95 32.93 1g5u s ARG 2084CO -0.13 0.62 -0.08 0.20 0.02 0.00 0.00 175.30 175.93 1g5u s GLY 2085N -0.90 0.68 -0.03 -3.53 0.00 0.21 -0.70 107.32 103.06 1g5u s GLY 2085Ca 0.13 -1.05 -0.13 0.00 0.00 0.00 0.00 44.72 43.67 1g5u s GLY 2085CO 0.02 -1.12 0.28 1.25 0.00 0.00 0.00 173.10 173.53 1g5u s LYS 2086N -2.53 0.60 -0.30 2.90 2.20 -0.37 0.12 119.74 122.35 1g5u s LYS 2086Ca 0.00 -0.14 -0.02 0.00 -0.36 0.00 0.00 55.97 55.45 1g5u s LYS 2086Cb -0.04 0.26 0.12 0.00 -1.51 0.00 0.00 37.83 36.66 1g5u s LYS 2086CO -0.01 -0.15 0.19 0.21 -0.36 0.00 0.00 175.35 175.23 1g5u s LYS 2087N -1.13 0.28 5.33 4.03 2.20 -0.15 -0.96 119.74 129.34 1g5u s LYS 2087Ca -0.12 -0.54 0.00 0.00 -0.36 0.00 0.00 55.97 54.96 1g5u s LYS 2087Cb -0.05 -1.03 0.00 0.00 -1.51 0.00 0.00 37.83 35.24 1g5u s LYS 2087CO 0.03 -1.05 0.00 0.41 -0.36 0.00 0.00 175.35 174.38 1g5u n GLY 2088N 5.09 2.84 0.00 5.54 0.00 -1.26 -3.14 105.19 114.26 1g5u n GLY 2088Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1g5u n GLY 2088CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1g5u n SER 2089N 1.01 0.00 -3.21 1.61 7.64 -1.26 -4.70 113.62 114.71 1g5u n SER 2089Ca 0.00 0.74 -0.20 0.00 1.01 0.00 0.00 58.87 60.42 1g5u n SER 2089Cb 0.00 -0.24 0.17 0.00 -1.01 0.00 0.00 64.21 63.12 1g5u n SER 2089CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1g5u n GLY 2090N -0.96 -2.58 0.00 0.23 0.00 -1.19 -4.67 105.19 96.01 1g5u n GLY 2090Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1g5u n GLY 2090CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g5u n GLY 2091N -2.25 0.59 3.14 -0.02 0.00 -0.58 -0.98 105.19 105.09 1g5u n GLY 2091Ca 0.10 -0.73 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 1g5u n GLY 2091CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1g5u s ILE 2092N -2.04 0.20 -0.06 -0.61 2.07 0.33 -1.73 121.20 119.35 1g5u s ILE 2092Ca 0.00 -1.88 -0.05 0.00 -1.41 0.00 0.00 60.65 57.31 1g5u s ILE 2092Cb 0.00 -1.86 0.02 0.00 0.13 0.00 0.00 42.46 40.75 1g5u s ILE 2092CO 0.00 -0.66 0.16 -0.89 -1.91 0.00 0.00 174.94 171.64 1g5u s THR 2093N -3.97 -0.01 -0.39 4.00 2.01 -0.83 0.67 115.64 117.13 1g5u s THR 2093Ca 0.18 0.05 0.02 0.00 0.31 0.00 0.00 61.69 62.25 1g5u s THR 2093Cb 0.07 -0.24 0.11 0.00 0.01 0.00 0.00 72.50 72.46 1g5u s THR 2093CO -0.02 0.02 0.15 -0.69 -0.69 0.00 0.00 174.62 173.39 1g5u s VAL 2094N 0.39 1.65 -0.18 3.82 1.01 0.10 -2.35 120.40 124.85 1g5u s VAL 2094Ca -0.03 -2.27 -0.28 0.00 0.00 0.00 0.00 61.98 59.40 1g5u s VAL 2094Cb -0.04 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.14 1g5u s VAL 2094CO -0.02 -0.74 0.98 -0.75 0.00 0.00 0.00 175.10 174.58 1g5u s LYS 2095N 0.78 4.31 -0.39 2.72 2.47 -0.95 -2.93 119.74 125.74 1g5u s LYS 2095Ca 0.13 1.29 -0.14 0.00 -1.56 0.00 0.00 55.97 55.70 1g5u s LYS 2095Cb -0.21 -3.60 0.01 0.00 -1.46 0.00 0.00 37.83 32.57 1g5u s LYS 2095CO -0.09 -0.48 0.27 0.50 0.16 0.00 0.00 175.35 175.70 1g5u s ARG 2096N 2.66 3.03 0.27 4.03 3.00 -0.97 0.11 118.95 131.09 1g5u s ARG 2096Ca 0.44 -0.97 -0.03 0.00 -1.00 0.00 0.00 55.73 54.17 1g5u s ARG 2096Cb -0.16 -3.90 0.06 0.00 0.00 0.00 0.00 34.95 30.95 1g5u s ARG 2096CO 0.11 -0.69 0.37 0.25 0.00 0.00 0.00 175.30 175.34 1g5u n THR 2097N 5.12 0.00 0.67 4.11 -2.24 0.16 -4.92 114.28 117.18 1g5u n THR 2097Ca -0.11 -0.37 0.12 0.00 -2.27 0.00 0.00 64.05 61.42 1g5u n THR 2097Cb 0.47 -1.63 0.47 0.00 -2.10 0.00 0.00 70.33 67.54 1g5u n THR 2097CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1g5u n GLY 2098N 2.45 -1.42 0.00 3.38 0.00 0.53 -4.12 105.19 106.00 1g5u n GLY 2098Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1g5u n GLY 2098CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1g5u n GLN 2099N -1.87 4.42 -1.73 1.61 6.02 -0.12 -5.03 117.38 120.68 1g5u n GLN 2099Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 1g5u n GLN 2099Cb 0.31 -0.43 0.00 0.00 1.02 0.00 0.00 30.24 31.14 1g5u n GLN 2099CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1g5u n ALA 2100N -0.08 0.00 -3.67 -1.58 0.00 -1.26 -1.90 120.51 112.03 1g5u n ALA 2100Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1g5u n ALA 2100Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 1g5u n ALA 2100CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1g5u s LEU 2101N 0.00 -0.38 0.51 0.00 1.43 0.21 0.39 118.68 120.85 1g5u s LEU 2101Ca 0.00 0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 53.79 1g5u s LEU 2101Cb 0.00 1.00 -0.04 0.00 0.03 0.00 0.00 46.19 47.18 1g5u s LEU 2101CO 0.00 -0.23 0.85 -0.63 0.23 0.00 0.00 176.35 176.57 1g5u s ILE 2102N 2.36 4.84 -0.21 -0.59 -1.09 0.30 -0.85 121.20 125.96 1g5u s ILE 2102Ca -0.01 0.44 -0.18 0.00 -2.23 0.00 0.00 60.65 58.66 1g5u s ILE 2102Cb -0.12 -3.85 0.06 0.00 -1.58 0.00 0.00 42.46 36.97 1g5u s ILE 2102CO -0.10 -0.89 0.54 -0.51 -1.23 0.00 0.00 174.94 172.75 1g5u s ILE 2103N -2.81 -0.00 -0.00 2.92 2.07 -0.39 -2.25 121.20 120.73 1g5u s ILE 2103Ca 0.50 0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.77 1g5u s ILE 2103Cb -0.10 -0.76 -0.01 0.00 0.13 0.00 0.00 42.46 41.72 1g5u s ILE 2103CO 0.46 0.00 -0.07 -0.83 -1.91 0.00 0.00 174.94 172.58 1g5u s GLY 2104N 0.46 0.37 -0.06 1.50 0.00 -0.99 -2.21 107.32 106.39 1g5u s GLY 2104Ca -0.01 -0.35 0.05 0.00 0.00 0.00 0.00 44.72 44.41 1g5u s GLY 2104CO -0.02 -0.30 -0.22 -0.42 0.00 0.00 0.00 173.10 172.15 1g5u s ILE 2105N -0.24 1.81 0.14 0.90 1.09 -1.12 -1.96 121.20 121.82 1g5u s ILE 2105Ca 0.02 -0.92 -0.05 0.00 -1.10 0.00 0.00 60.65 58.61 1g5u s ILE 2105Cb -0.03 -1.55 -0.03 0.00 -1.06 0.00 0.00 42.46 39.79 1g5u s ILE 2105CO -0.00 0.51 0.15 -0.72 -0.10 0.00 0.00 174.94 174.78 1g5u s TYR 2106N 0.03 0.62 0.05 3.97 -0.85 -0.70 -1.60 117.35 118.87 1g5u s TYR 2106Ca -0.07 -1.00 -0.17 0.00 -0.52 0.00 0.00 57.07 55.31 1g5u s TYR 2106Cb -0.14 -0.28 0.03 0.00 0.38 0.00 0.00 41.96 41.95 1g5u s TYR 2106CO 0.04 -0.60 0.38 -0.51 -1.52 0.00 0.00 175.55 173.35 1g5u s ASP 2107N -3.00 -0.24 0.45 -0.18 1.01 -1.26 -1.52 116.67 111.93 1g5u s ASP 2107Ca 0.20 -0.08 -0.21 0.00 0.71 0.00 0.00 52.55 53.16 1g5u s ASP 2107Cb 0.06 0.41 -0.13 0.00 1.01 0.00 0.00 42.92 44.27 1g5u s ASP 2107CO -0.00 -0.67 0.33 -1.84 0.21 0.00 0.00 175.17 173.20 1g5u n GLU 2108N 0.45 0.33 -0.74 8.23 -0.00 -1.26 -2.75 120.64 124.89 1g5u n GLU 2108Ca -0.18 0.12 -0.15 0.00 -0.00 0.00 0.00 57.16 56.95 1g5u n GLU 2108Cb 0.60 -1.33 0.09 0.00 -0.00 0.00 0.00 31.44 30.80 1g5u n GLU 2108CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1g5u n PRO 2109N 0.81 1.75 -3.23 3.44 -0.04 -1.26 -5.02 135.00 131.45 1g5u n PRO 2109Ca 0.11 -1.72 -0.46 0.00 -0.04 0.00 0.00 63.50 61.39 1g5u n PRO 2109Cb 0.42 -1.67 -0.04 0.00 -0.04 0.00 0.00 33.50 32.17 1g5u n PRO 2109CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1g5u s LEU 2110N -1.91 6.01 0.54 1.53 2.96 -1.11 -5.05 118.68 121.65 1g5u s LEU 2110Ca 0.33 -1.94 -0.18 0.00 -0.22 0.00 0.00 54.13 52.12 1g5u s LEU 2110Cb 0.27 -2.25 -0.12 0.00 0.50 0.00 0.00 46.19 44.59 1g5u s LEU 2110CO 0.05 -0.88 0.13 0.35 -1.32 0.00 0.00 176.35 174.68 1g5u n THR 2111N 5.02 0.89 -0.29 3.68 -2.24 -1.26 -4.60 114.28 115.48 1g5u n THR 2111Ca -0.03 -0.50 -0.05 0.00 -2.27 0.00 0.00 64.05 61.20 1g5u n THR 2111Cb 0.43 -0.27 0.07 0.00 -2.10 0.00 0.00 70.33 68.46 1g5u n THR 2111CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1g5u h PRO 2112N 0.07 1.14 -0.38 -0.78 0.13 -1.97 -2.34 132.00 127.88 1g5u h PRO 2112Ca -0.43 -0.16 0.04 0.00 -0.87 0.00 0.00 66.00 64.59 1g5u h PRO 2112Cb 1.43 -0.21 -0.07 0.00 0.13 0.00 0.00 31.00 32.28 1g5u h PRO 2112CO 0.44 0.87 -0.42 0.78 -0.23 0.00 0.00 178.00 179.44 1g5u h GLY 2113N 1.13 -1.26 -0.55 1.56 0.00 -2.00 -0.05 103.07 101.90 1g5u h GLY 2113Ca 0.28 0.77 0.13 0.00 0.00 0.00 0.00 47.33 48.51 1g5u h GLY 2113CO -0.04 -0.27 -0.31 1.46 0.00 0.00 0.00 176.54 177.38 1g5u h GLN 2114N -0.25 -0.09 -0.06 4.80 4.20 -1.76 -0.73 115.11 121.21 1g5u h GLN 2114Ca 0.06 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.80 1g5u h GLN 2114Cb 0.42 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.19 1g5u h GLN 2114CO -0.49 -0.06 -0.35 0.00 -0.67 0.00 0.00 178.83 177.26 1g5u n ASN 2116N -4.39 -0.09 -0.17 0.00 3.02 -0.32 0.54 115.26 113.86 1g5u n ASN 2116Ca -0.04 0.80 0.01 0.00 -0.03 0.00 0.00 54.58 55.32 1g5u n ASN 2116Cb 0.25 -0.34 0.04 0.00 -0.61 0.00 0.00 39.78 39.11 1g5u n ASN 2116CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 1g5u n MET 2117N -2.98 -0.07 0.09 3.52 1.56 -0.68 -0.74 117.12 117.82 1g5u n MET 2117Ca 0.00 0.69 -0.09 0.00 -0.27 0.00 0.00 57.70 58.04 1g5u n MET 2117Cb 0.02 -1.03 -0.05 0.00 2.15 0.00 0.00 33.22 34.31 1g5u n MET 2117CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 1g5u h ILE 2118N 0.00 0.43 0.33 1.12 2.04 0.38 -1.20 117.51 120.62 1g5u h ILE 2118Ca 0.18 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 1g5u h ILE 2118Cb 0.30 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1g5u h ILE 2118CO -0.45 0.11 -0.33 0.58 0.00 0.00 0.00 178.15 178.06 1g5u h VAL 2119N -1.00 0.31 -0.30 1.67 2.07 -0.27 -1.91 116.25 116.82 1g5u h VAL 2119Ca -0.03 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.57 1g5u h VAL 2119Cb 0.44 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1g5u h VAL 2119CO 0.05 0.00 0.26 -0.33 0.02 0.00 0.00 177.57 177.57 1g5u h GLU 2120N -0.69 0.00 0.00 1.57 5.08 -1.07 -2.86 114.58 116.61 1g5u h GLU 2120Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1g5u h GLU 2120Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1g5u h GLU 2120CO -0.06 0.00 0.00 -2.13 -1.00 0.00 0.00 179.01 175.82 1g5u n ARG 2121N -4.09 0.00 -0.15 2.33 0.63 -0.45 -2.78 116.66 112.15 1g5u n ARG 2121Ca 0.04 0.37 -0.13 0.00 -0.92 0.00 0.00 57.85 57.22 1g5u n ARG 2121Cb 0.42 -1.25 -0.08 0.00 0.45 0.00 0.00 32.46 31.99 1g5u n ARG 2121CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1g5u h LEU 2122N 0.00 -1.77 -0.49 6.15 4.07 -1.48 -1.36 115.31 120.42 1g5u h LEU 2122Ca 0.00 0.24 0.11 0.00 0.08 0.00 0.00 57.88 58.31 1g5u h LEU 2122Cb 0.00 0.74 -0.09 0.00 1.08 0.00 0.00 40.66 42.39 1g5u h LEU 2122CO 0.00 -0.39 -0.09 0.61 -1.08 0.00 0.00 178.44 177.49 1g5u n GLY 2123N -1.38 -0.79 0.47 0.83 0.00 -1.09 0.14 105.19 103.37 1g5u n GLY 2123Ca -0.02 0.52 -0.16 0.00 0.00 0.00 0.00 46.02 46.35 1g5u n GLY 2123CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1g5u h ASP 2124N 0.00 -1.49 0.00 1.61 3.32 -1.06 -2.30 116.42 116.50 1g5u h ASP 2124Ca 0.25 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.45 1g5u h ASP 2124Cb 0.43 0.54 0.00 0.00 0.22 0.00 0.00 39.33 40.52 1g5u h ASP 2124CO -0.50 -0.57 0.00 0.00 -1.72 0.00 0.00 179.24 176.45 1g5u n TYR 2125N -5.50 0.00 -0.32 4.55 9.36 0.38 -1.91 117.16 123.72 1g5u n TYR 2125Ca -0.09 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.18 1g5u n TYR 2125Cb 0.42 0.00 0.12 0.00 -0.63 0.00 0.00 39.34 39.24 1g5u n TYR 2125CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1g5u n LEU 2126N -0.53 -0.34 -0.15 2.98 4.32 -1.09 0.67 117.00 122.87 1g5u n LEU 2126Ca 0.00 1.51 -0.11 0.00 -0.02 0.00 0.00 56.01 57.39 1g5u n LEU 2126Cb 0.00 -0.45 -0.07 0.00 -1.62 0.00 0.00 43.42 41.28 1g5u n LEU 2126CO 0.00 -1.44 0.54 -0.07 -1.22 0.00 0.00 177.39 175.20 1g5u h LEU 2127N 0.00 -1.63 -7.70 2.23 3.38 -1.16 -0.57 115.31 109.87 1g5u h LEU 2127Ca 0.41 0.24 -0.77 0.00 0.09 0.00 0.00 57.88 57.85 1g5u h LEU 2127Cb 0.63 0.70 -0.24 0.00 0.09 0.00 0.00 40.66 41.84 1g5u h LEU 2127CO -0.90 -0.38 0.69 -1.81 0.09 0.00 0.00 178.44 176.13 1g5u s ASP 2128N -5.08 7.09 0.00 -0.43 1.11 0.21 -2.89 116.67 116.69 1g5u s ASP 2128Ca -0.14 -3.12 0.00 0.00 0.18 0.00 0.00 52.55 49.47 1g5u s ASP 2128Cb 0.11 -2.28 0.00 0.00 1.07 0.00 0.00 42.92 41.81 1g5u s ASP 2128CO 0.64 -0.54 0.00 1.67 1.18 0.00 0.00 175.17 178.11 1g5u n GLN 2129N 4.14 0.00 0.00 8.23 7.27 -0.95 -4.75 117.38 131.32 1g5u n GLN 2129Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.33 1g5u n GLN 2129Cb 0.43 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.08 1g5u n GLN 2129CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1g5u n GLY 2130N 0.00 1.11 0.22 1.69 0.00 -1.03 -5.05 105.19 102.14 1g5u n GLY 2130Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1g5u n GLY 2130CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36