#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2z47 s PRO 2002N 0.00 4.33 -0.05 0.00 0.02 -1.26 -5.03 135.00 133.01 2z47 s PRO 2002Ca 0.00 2.12 0.04 0.00 0.02 0.00 0.00 61.00 63.19 2z47 s PRO 2002Cb 0.00 -3.20 -0.00 0.00 0.02 0.00 0.00 34.50 31.31 2z47 s PRO 2002CO 0.00 -0.39 -0.18 0.21 -0.33 0.00 0.00 177.00 176.31 2z47 s LYS 2003N 0.49 1.96 0.24 5.54 2.20 -1.26 -5.11 119.74 123.80 2z47 s LYS 2003Ca 0.62 -0.66 -0.31 0.00 -0.36 0.00 0.00 55.97 55.26 2z47 s LYS 2003Cb -0.38 -1.67 -0.11 0.00 -1.51 0.00 0.00 37.83 34.15 2z47 s LYS 2003CO 0.35 0.25 1.61 0.00 -0.36 0.00 0.00 175.35 177.20 2z47 s ALA 2004N 0.05 3.80 0.83 3.13 0.00 -1.26 -4.99 121.76 123.32 2z47 s ALA 2004Ca -0.05 1.51 -0.12 0.00 0.00 0.00 0.00 51.96 53.30 2z47 s ALA 2004Cb -0.12 -3.65 0.09 0.00 0.00 0.00 0.00 23.12 19.44 2z47 s ALA 2004CO 0.03 -0.90 1.14 -1.25 0.00 0.00 0.00 175.76 174.78 2z47 s PRO 2005N 0.33 1.79 0.86 0.00 0.04 -1.26 -5.03 135.00 131.73 2z47 s PRO 2005Ca 0.68 0.32 -0.10 0.00 0.04 0.00 0.00 61.00 61.93 2z47 s PRO 2005Cb -0.47 -1.91 0.11 0.00 0.04 0.00 0.00 34.50 32.27 2z47 s PRO 2005CO 0.39 -1.75 1.12 0.00 0.04 0.00 0.00 177.00 176.80 2z47 s ALA 2006N -3.36 1.74 1.02 8.56 0.00 -1.26 -4.67 121.76 123.78 2z47 s ALA 2006Ca 0.62 0.44 -0.12 0.00 0.00 0.00 0.00 51.96 52.90 2z47 s ALA 2006Cb -0.13 -3.38 0.20 0.00 0.00 0.00 0.00 23.12 19.82 2z47 s ALA 2006CO 0.52 -2.40 1.08 -0.51 0.00 0.00 0.00 175.76 174.45 2z47 s ASP 2007N -2.96 2.40 0.00 0.00 1.01 -1.26 -4.08 116.67 111.77 2z47 s ASP 2007Ca 0.65 1.26 0.00 0.00 0.71 0.00 0.00 52.55 55.17 2z47 s ASP 2007Cb -0.21 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 41.78 2z47 s ASP 2007CO 0.57 -3.28 0.00 0.61 0.21 0.00 0.00 175.17 173.28 2z47 n GLY 2008N -0.79 0.52 3.70 0.21 0.00 -1.23 -5.01 105.19 102.59 2z47 n GLY 2008Ca 0.05 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 2z47 n GLY 2008CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2z47 s LEU 2009N 0.00 4.35 -0.25 0.99 0.20 -0.99 -4.81 118.68 118.17 2z47 s LEU 2009Ca 0.00 2.37 -0.10 0.00 0.69 0.00 0.00 54.13 57.09 2z47 s LEU 2009Cb 0.00 -3.57 -0.05 0.00 -0.43 0.00 0.00 46.19 42.14 2z47 s LEU 2009CO 0.00 -0.78 0.15 -0.75 -0.29 0.00 0.00 176.35 174.68 2z47 s LYS 2010N 1.96 3.98 -0.43 1.98 2.20 -1.26 0.12 119.74 128.30 2z47 s LYS 2010Ca 0.68 -0.31 -0.19 0.00 -0.36 0.00 0.00 55.97 55.79 2z47 s LYS 2010Cb -0.37 -3.52 0.02 0.00 -1.51 0.00 0.00 37.83 32.45 2z47 s LYS 2010CO 0.30 -0.01 0.54 -1.64 -0.36 0.00 0.00 175.35 174.17 2z47 s MET 2011N 1.25 3.18 -0.38 4.03 -1.94 0.71 -4.95 119.30 121.20 2z47 s MET 2011Ca 0.07 -0.58 0.11 0.00 -1.71 0.00 0.00 55.69 53.58 2z47 s MET 2011Cb -0.14 -3.96 0.44 0.00 2.01 0.00 0.00 34.83 33.18 2z47 s MET 2011CO 0.06 -0.93 1.06 -0.40 -0.01 0.00 0.00 175.02 174.79 2z47 n ASP 2012N 5.92 3.42 0.16 3.03 5.68 -1.26 -1.29 116.55 132.21 2z47 n ASP 2012Ca -0.05 -3.28 0.12 0.00 -0.50 0.00 0.00 54.79 51.08 2z47 n ASP 2012Cb 0.48 -0.48 0.16 0.00 -1.14 0.00 0.00 41.12 40.14 2z47 n ASP 2012CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2z47 h LYS 2013N 2.70 0.00 0.00 0.11 6.56 -1.95 -3.48 116.57 120.51 2z47 h LYS 2013Ca 0.14 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.52 2z47 h LYS 2013Cb 1.08 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.70 2z47 h LYS 2013CO 0.69 0.00 -0.15 0.25 -2.06 0.00 0.00 179.45 178.17 2z47 n THR 2014N -2.80 0.00 1.74 -0.16 -2.24 -1.26 -5.02 114.28 104.54 2z47 n THR 2014Ca 0.03 -0.77 0.15 0.00 -2.27 0.00 0.00 64.05 61.19 2z47 n THR 2014Cb 0.51 0.16 0.77 0.00 -2.10 0.00 0.00 70.33 69.67 2z47 n THR 2014CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2z47 n LYS 2015N -0.40 1.11 -3.27 -0.78 5.02 -1.26 -4.06 118.16 114.52 2z47 n LYS 2015Ca -0.07 -0.31 -0.25 0.00 -2.02 0.00 0.00 58.31 55.66 2z47 n LYS 2015Cb 0.21 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 33.66 2z47 n LYS 2015CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2z47 n GLN 2016N -0.67 1.78 -1.67 1.97 6.02 -1.26 -5.11 117.38 118.44 2z47 n GLN 2016Ca 0.21 -4.03 -0.38 0.00 -0.01 0.00 0.00 57.00 52.78 2z47 n GLN 2016Cb 0.21 -1.81 0.05 0.00 1.02 0.00 0.00 30.24 29.71 2z47 n GLN 2016CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2z47 n PRO 2017N 0.90 1.23 -4.46 -1.09 -0.04 -1.26 -5.00 135.00 125.28 2z47 n PRO 2017Ca 0.26 0.46 -0.20 0.00 -0.04 0.00 0.00 63.50 63.99 2z47 n PRO 2017Cb 0.48 -2.31 -0.15 0.00 -0.04 0.00 0.00 33.50 31.48 2z47 n PRO 2017CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2z47 s VAL 2018N -1.40 0.84 -0.12 0.52 1.01 -0.41 -4.89 120.40 115.95 2z47 s VAL 2018Ca 0.73 -0.45 -0.17 0.00 0.00 0.00 0.00 61.98 62.09 2z47 s VAL 2018Cb -0.43 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 2z47 s VAL 2018CO 0.48 0.24 0.42 -0.69 0.00 0.00 0.00 175.10 175.55 2z47 s VAL 2019N -0.24 5.21 -0.12 2.92 1.01 -1.26 -0.21 120.40 127.71 2z47 s VAL 2019Ca 0.04 0.84 0.01 0.00 0.00 0.00 0.00 61.98 62.87 2z47 s VAL 2019Cb -0.04 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 2z47 s VAL 2019CO -0.00 0.36 -0.16 0.12 0.00 0.00 0.00 175.10 175.41 2z47 s PHE 2020N 0.49 2.75 -0.27 5.22 5.36 0.12 -4.95 117.98 126.70 2z47 s PHE 2020Ca 0.23 -0.76 -0.02 0.00 -0.96 0.00 0.00 56.93 55.42 2z47 s PHE 2020Cb -0.15 -1.81 0.03 0.00 -0.34 0.00 0.00 43.02 40.75 2z47 s PHE 2020CO 0.09 -0.28 -0.03 -0.80 -1.46 0.00 0.00 175.22 172.74 2z47 s ASN 2021N 0.37 4.53 0.39 6.13 0.01 -1.26 -2.36 114.94 122.75 2z47 s ASN 2021Ca -0.13 -0.97 0.08 0.00 -0.71 0.00 0.00 52.86 51.14 2z47 s ASN 2021Cb -0.16 -1.69 0.79 0.00 0.41 0.00 0.00 41.25 40.60 2z47 s ASN 2021CO 0.06 -0.17 1.95 0.45 -1.51 0.00 0.00 177.10 177.89 2z47 h HIS 2022N 8.02 0.35 -0.20 2.20 3.86 -1.84 -2.98 115.15 124.56 2z47 h HIS 2022Ca -0.29 -0.02 0.03 0.00 -1.16 0.00 0.00 60.37 58.92 2z47 h HIS 2022Cb 1.10 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.45 2z47 h HIS 2022CO 0.59 0.37 0.14 0.66 0.86 0.00 0.00 177.93 180.55 2z47 h SER 2023N 0.34 0.13 -0.01 2.45 4.64 -1.94 -0.82 113.55 118.34 2z47 h SER 2023Ca 0.08 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2z47 h SER 2023Cb 0.25 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2z47 h SER 2023CO 0.01 0.09 0.00 0.35 -0.87 0.00 0.00 176.83 176.41 2z47 n THR 2024N -4.50 0.00 -1.26 2.95 -2.24 -1.13 -3.65 114.28 104.46 2z47 n THR 2024Ca 0.01 -0.15 0.08 0.00 -2.27 0.00 0.00 64.05 61.72 2z47 n THR 2024Cb 0.17 0.11 0.14 0.00 -2.10 0.00 0.00 70.33 68.65 2z47 n THR 2024CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2z47 n HIS 2025N -0.28 0.00 0.31 4.78 8.25 -0.32 -4.77 115.22 123.19 2z47 n HIS 2025Ca 0.21 -1.00 0.20 0.00 -0.26 0.00 0.00 57.72 56.87 2z47 n HIS 2025Cb 0.26 -0.16 1.00 0.00 1.12 0.00 0.00 29.99 32.21 2z47 n HIS 2025CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2z47 h LYS 2026N 0.20 0.00 -0.00 -0.41 1.57 -1.60 -1.33 116.57 115.00 2z47 h LYS 2026Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2z47 h LYS 2026Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2z47 h LYS 2026CO 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 179.45 178.86 2z47 n ALA 2027N -2.07 2.47 -2.74 3.86 0.00 -1.26 -4.74 120.51 116.02 2z47 n ALA 2027Ca -0.02 -0.14 -0.35 0.00 0.00 0.00 0.00 53.44 52.94 2z47 n ALA 2027Cb 0.16 -1.46 -0.08 0.00 0.00 0.00 0.00 19.45 18.06 2z47 n ALA 2027CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2z47 s VAL 2028N -2.76 5.32 0.35 0.00 1.01 -0.50 -5.06 120.40 118.76 2z47 s VAL 2028Ca 0.22 0.16 -0.29 0.00 0.00 0.00 0.00 61.98 62.07 2z47 s VAL 2028Cb 0.20 -3.42 -0.11 0.00 0.00 0.00 0.00 36.38 33.04 2z47 s VAL 2028CO 0.50 0.45 1.49 -0.75 0.00 0.00 0.00 175.10 176.78 2z47 s LYS 2029N 0.34 4.14 0.20 2.72 2.20 -1.26 -4.90 119.74 123.19 2z47 s LYS 2029Ca 0.07 2.53 -0.13 0.00 -0.36 0.00 0.00 55.97 58.09 2z47 s LYS 2029Cb -0.11 -2.99 0.23 0.00 -1.51 0.00 0.00 37.83 33.45 2z47 s LYS 2029CO -0.02 -0.52 1.65 0.00 -0.36 0.00 0.00 175.35 176.11 2z47 n GLY 2031N -1.37 -0.73 0.18 0.00 0.00 -1.26 -1.14 105.19 100.87 2z47 n GLY 2031Ca 0.07 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.12 2z47 n GLY 2031CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2z47 h ASP 2032N 0.00 0.00 0.00 1.61 5.19 -1.55 -3.11 116.42 118.56 2z47 h ASP 2032Ca 0.00 0.00 -0.29 0.00 -0.62 0.00 0.00 57.03 56.12 2z47 h ASP 2032Cb 0.12 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.59 2z47 h ASP 2032CO 0.00 0.37 -1.97 0.00 -3.12 0.00 0.00 179.24 174.52 2z47 n HIS 2034N -3.77 3.03 -0.97 0.00 8.25 -0.30 -4.96 115.22 116.50 2z47 n HIS 2034Ca -0.34 -2.83 -0.30 0.00 -0.26 0.00 0.00 57.72 53.99 2z47 n HIS 2034Cb 0.74 -2.07 0.15 0.00 1.12 0.00 0.00 29.99 29.93 2z47 n HIS 2034CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2z47 s HIS 2035N 0.93 2.03 0.34 4.41 -3.43 -1.18 -3.47 115.29 114.93 2z47 s HIS 2035Ca 0.42 1.46 -0.28 0.00 -0.80 0.00 0.00 55.06 55.85 2z47 s HIS 2035Cb 0.11 -3.18 -0.10 0.00 -1.43 0.00 0.00 32.58 27.98 2z47 s HIS 2035CO -0.02 -2.61 1.31 -2.14 -2.00 0.00 0.00 174.74 169.28 2z47 s PRO 2036N -4.78 4.31 -0.07 -0.38 0.02 -1.26 -0.90 135.00 131.94 2z47 s PRO 2036Ca 0.65 2.21 -0.03 0.00 0.02 0.00 0.00 61.00 63.84 2z47 s PRO 2036Cb -0.20 -3.03 0.04 0.00 0.02 0.00 0.00 34.50 31.33 2z47 s PRO 2036CO 0.58 -0.22 0.13 0.08 -0.33 0.00 0.00 177.00 177.24 2z47 s VAL 2037N -1.16 -0.18 -1.53 3.83 1.01 0.06 -4.79 120.40 117.64 2z47 s VAL 2037Ca 0.50 0.32 -0.05 0.00 0.00 0.00 0.00 61.98 62.75 2z47 s VAL 2037Cb -0.39 -0.25 0.01 0.00 0.00 0.00 0.00 36.38 35.75 2z47 s VAL 2037CO 0.52 0.13 0.69 0.59 0.00 0.00 0.00 175.10 177.03 2z47 n ASN 2038N 5.02 -6.10 -0.04 3.32 3.02 -1.26 -1.97 115.26 117.25 2z47 n ASN 2038Ca -0.10 -0.33 -0.01 0.00 -0.03 0.00 0.00 54.58 54.11 2z47 n ASN 2038Cb 0.50 -4.91 -0.00 0.00 -0.61 0.00 0.00 39.78 34.76 2z47 n ASN 2038CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2z47 n GLY 2039N -1.58 0.44 2.87 7.41 0.00 -1.26 -5.02 105.19 108.04 2z47 n GLY 2039Ca -0.09 -0.11 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 2z47 n GLY 2039CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2z47 s LYS 2040N -0.64 0.44 0.18 1.61 1.02 -0.83 -5.04 119.74 116.48 2z47 s LYS 2040Ca 0.00 -0.03 -0.33 0.00 0.02 0.00 0.00 55.97 55.63 2z47 s LYS 2040Cb 0.00 -0.53 -0.14 0.00 -0.52 0.00 0.00 37.83 36.64 2z47 s LYS 2040CO 0.00 -0.06 1.54 0.39 -0.92 0.00 0.00 175.35 176.29 2z47 n GLU 2041N 3.81 2.12 -3.87 1.68 1.02 -1.26 -0.76 120.64 123.38 2z47 n GLU 2041Ca -0.23 0.76 -0.36 0.00 -0.02 0.00 0.00 57.16 57.31 2z47 n GLU 2041Cb 0.52 -2.50 -0.11 0.00 -0.02 0.00 0.00 31.44 29.33 2z47 n GLU 2041CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2z47 s ASP 2042N 0.75 5.46 -0.16 1.62 -1.08 -0.08 -4.86 116.67 118.32 2z47 s ASP 2042Ca 0.76 -0.05 0.16 0.00 -0.52 0.00 0.00 52.55 52.90 2z47 s ASP 2042Cb -0.67 -1.96 0.58 0.00 -1.46 0.00 0.00 42.92 39.40 2z47 s ASP 2042CO 0.41 0.06 1.49 -1.22 0.52 0.00 0.00 175.17 176.43 2z47 n TYR 2043N 4.27 1.16 -1.79 -5.34 4.01 -1.26 -4.25 117.16 113.96 2z47 n TYR 2043Ca -0.16 -0.78 -0.30 0.00 -0.16 0.00 0.00 57.90 56.50 2z47 n TYR 2043Cb 0.52 -0.31 0.06 0.00 -0.31 0.00 0.00 39.34 39.30 2z47 n TYR 2043CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2z47 s GLN 2044N -2.51 2.52 0.44 -0.72 -0.21 -1.26 -4.98 119.66 112.94 2z47 s GLN 2044Ca 0.43 0.47 -0.26 0.00 0.02 0.00 0.00 55.36 56.02 2z47 s GLN 2044Cb 0.33 -1.98 -0.09 0.00 1.00 0.00 0.00 33.01 32.27 2z47 s GLN 2044CO 0.12 -1.28 1.40 1.63 -2.12 0.00 0.00 175.29 175.05 2z47 n LYS 2045N -3.17 2.21 -0.14 2.91 5.02 -1.26 -4.86 118.16 118.86 2z47 n LYS 2045Ca 0.07 0.79 0.15 0.00 -2.02 0.00 0.00 58.31 57.30 2z47 n LYS 2045Cb 0.57 -2.57 0.52 0.00 -0.02 0.00 0.00 35.03 33.53 2z47 n LYS 2045CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2z47 n ALA 2047N -2.53 3.66 -1.52 0.00 0.00 -1.26 -1.38 120.51 117.48 2z47 n ALA 2047Ca 0.14 -1.59 -0.35 0.00 0.00 0.00 0.00 53.44 51.63 2z47 n ALA 2047Cb 0.52 -1.11 0.08 0.00 0.00 0.00 0.00 19.45 18.94 2z47 n ALA 2047CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2z47 s THR 2048N -2.46 2.21 0.24 0.00 2.01 -0.73 -4.30 115.64 112.61 2z47 s THR 2048Ca 0.45 0.12 -0.31 0.00 0.31 0.00 0.00 61.69 62.26 2z47 s THR 2048Cb 0.35 -2.85 -0.14 0.00 0.01 0.00 0.00 72.50 69.87 2z47 s THR 2048CO 0.13 -0.04 1.36 0.00 -0.69 0.00 0.00 174.62 175.38 2z47 n ALA 2049N -2.33 0.88 -0.15 7.40 0.00 -1.26 -0.29 120.51 124.76 2z47 n ALA 2049Ca 0.14 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.00 2z47 n ALA 2049Cb 0.49 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.71 2z47 n ALA 2049CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2z47 n GLY 2050N 2.01 1.29 0.00 0.00 0.00 -1.26 -4.99 105.19 102.25 2z47 n GLY 2050Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2z47 n GLY 2050CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2z47 n HIS 2052N 0.00 2.89 0.13 0.00 8.25 -0.48 -4.41 115.22 121.60 2z47 n HIS 2052Ca 0.00 -2.91 0.12 0.00 -0.26 0.00 0.00 57.72 54.66 2z47 n HIS 2052Cb 0.00 -2.20 0.26 0.00 1.12 0.00 0.00 29.99 29.17 2z47 n HIS 2052CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2z47 n ASP 2053N 3.88 3.55 -4.66 0.41 5.75 -1.10 -4.00 116.55 120.39 2z47 n ASP 2053Ca 0.57 -1.99 -0.38 0.00 -0.01 0.00 0.00 54.79 52.98 2z47 n ASP 2053Cb 0.31 -0.33 -0.08 0.00 -1.03 0.00 0.00 41.12 40.00 2z47 n ASP 2053CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 2z47 s ASN 2054N -1.32 6.39 0.00 -1.12 3.84 -0.09 -4.95 114.94 117.69 2z47 s ASN 2054Ca 0.42 0.46 0.25 0.00 0.21 0.00 0.00 52.86 54.20 2z47 s ASN 2054Cb 0.23 -2.22 0.75 0.00 -0.55 0.00 0.00 41.25 39.46 2z47 s ASN 2054CO 0.32 -0.10 1.57 0.23 -2.79 0.00 0.00 177.10 176.33 2z47 n MET 2055N 4.65 1.88 -1.72 0.43 2.81 -1.26 -1.51 117.12 122.39 2z47 n MET 2055Ca -0.08 -1.30 -0.42 0.00 -1.81 0.00 0.00 57.70 54.08 2z47 n MET 2055Cb 0.51 -1.46 -0.02 0.00 -0.71 0.00 0.00 33.22 31.54 2z47 n MET 2055CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2z47 n ASP 2056N 0.55 3.79 0.29 7.83 4.64 -1.26 -4.87 116.55 127.52 2z47 n ASP 2056Ca 0.17 1.11 0.17 0.00 -1.38 0.00 0.00 54.79 54.86 2z47 n ASP 2056Cb 0.42 -1.56 0.90 0.00 -1.04 0.00 0.00 41.12 39.83 2z47 n ASP 2056CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 2z47 h LYS 2057N 5.63 0.00 -0.29 -0.67 1.57 -2.03 -3.08 116.57 117.70 2z47 h LYS 2057Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2z47 h LYS 2057Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2z47 h LYS 2057CO 0.86 0.05 0.00 1.63 -0.57 0.00 0.00 179.45 181.42 2z47 n LYS 2058N -3.41 2.96 -2.85 3.15 5.02 -1.26 -4.90 118.16 116.86 2z47 n LYS 2058Ca -0.02 -2.64 -0.43 0.00 -2.02 0.00 0.00 58.31 53.20 2z47 n LYS 2058Cb 0.17 -1.70 -0.04 0.00 -0.02 0.00 0.00 35.03 33.44 2z47 n LYS 2058CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2z47 s ASP 2059N -1.66 6.55 -0.07 4.39 -1.08 -1.16 -4.88 116.67 118.75 2z47 s ASP 2059Ca 0.37 0.26 0.17 0.00 -0.52 0.00 0.00 52.55 52.84 2z47 s ASP 2059Cb 0.28 -2.44 0.60 0.00 -1.46 0.00 0.00 42.92 39.90 2z47 s ASP 2059CO 0.11 -0.94 1.51 0.29 0.52 0.00 0.00 175.17 176.66 2z47 n LYS 2060N 6.91 3.26 -1.90 4.34 4.76 -1.26 -4.21 118.16 130.06 2z47 n LYS 2060Ca 0.06 -2.66 -0.23 0.00 -2.87 0.00 0.00 58.31 52.60 2z47 n LYS 2060Cb 0.48 -1.69 0.15 0.00 -1.84 0.00 0.00 35.03 32.14 2z47 n LYS 2060CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2z47 n SER 2061N 0.92 0.50 0.10 4.39 3.41 -1.26 -4.89 113.62 116.80 2z47 n SER 2061Ca 0.22 -1.63 0.09 0.00 -0.26 0.00 0.00 58.87 57.28 2z47 n SER 2061Cb 0.74 -0.76 0.41 0.00 -0.26 0.00 0.00 64.21 64.34 2z47 n SER 2061CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2z47 n ALA 2062N -3.43 1.26 0.49 7.33 0.00 -1.26 -1.39 120.51 123.50 2z47 n ALA 2062Ca -0.17 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.49 2z47 n ALA 2062Cb 0.51 -1.26 0.18 0.00 0.00 0.00 0.00 19.45 18.87 2z47 n ALA 2062CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2z47 h LYS 2063N 0.00 0.00 -6.27 0.00 1.79 -1.92 -3.35 116.57 106.82 2z47 h LYS 2063Ca 0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 2z47 h LYS 2063Cb 0.12 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.73 2z47 h LYS 2063CO 0.00 0.00 1.25 0.20 -1.08 0.00 0.00 179.45 179.82 2z47 s GLY 2064N -3.78 0.73 0.03 3.86 0.00 -0.49 -0.91 107.32 106.77 2z47 s GLY 2064Ca 0.06 -0.03 -0.26 0.00 0.00 0.00 0.00 44.72 44.49 2z47 s GLY 2064CO 0.71 3.19 1.45 -1.82 0.00 0.00 0.00 173.10 176.63 2z47 h TYR 2065N 12.83 -0.22 -0.56 1.90 5.03 -1.40 -2.59 116.97 131.96 2z47 h TYR 2065Ca -0.31 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 60.96 2z47 h TYR 2065Cb 1.15 0.07 -0.03 0.00 1.55 0.00 0.00 36.73 39.48 2z47 h TYR 2065CO 0.98 0.03 0.19 -0.07 -1.32 0.00 0.00 178.16 177.97 2z47 h LEU 2066N -0.47 0.76 -0.73 2.82 3.38 -1.86 -2.43 115.31 116.79 2z47 h LEU 2066Ca -0.02 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 57.87 2z47 h LEU 2066Cb 0.36 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2z47 h LEU 2066CO 0.04 0.71 0.45 -0.74 0.09 0.00 0.00 178.44 178.99 2z47 h HIS 2067N 0.81 0.84 0.00 1.13 2.76 -1.76 -1.13 115.15 117.80 2z47 h HIS 2067Ca 0.19 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.37 2z47 h HIS 2067Cb 0.22 -0.27 -0.00 0.00 1.55 0.00 0.00 27.41 28.90 2z47 h HIS 2067CO 0.01 0.47 -0.06 0.00 -1.30 0.00 0.00 177.93 177.05 2z47 h ALA 2068N 1.32 1.12 0.00 5.26 0.00 -1.02 -2.42 119.26 123.52 2z47 h ALA 2068Ca 0.30 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 2z47 h ALA 2068Cb 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2z47 h ALA 2068CO -0.12 0.08 -2.03 -1.33 0.00 0.00 0.00 179.25 175.85 2z47 n MET 2069N -3.34 0.68 -0.01 0.00 2.81 -0.80 -4.35 117.12 112.10 2z47 n MET 2069Ca -0.01 -0.15 0.00 0.00 -1.81 0.00 0.00 57.70 55.73 2z47 n MET 2069Cb 0.23 -1.49 -0.02 0.00 -0.71 0.00 0.00 33.22 31.22 2z47 n MET 2069CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2z47 n HIS 2070N -2.33 0.00 -2.33 2.03 -0.00 -0.49 -2.28 115.22 109.82 2z47 n HIS 2070Ca -0.10 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.32 2z47 n HIS 2070Cb 0.67 -0.10 -0.01 0.00 -0.00 0.00 0.00 29.99 30.55 2z47 n HIS 2070CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2z47 s ASP 2071N -2.84 6.34 0.36 0.41 1.01 -0.92 -4.23 116.67 116.80 2z47 s ASP 2071Ca -0.01 1.25 0.07 0.00 0.71 0.00 0.00 52.55 54.57 2z47 s ASP 2071Cb 0.01 -2.39 -0.00 0.00 1.01 0.00 0.00 42.92 41.56 2z47 s ASP 2071CO 0.12 -0.67 0.50 -0.54 0.21 0.00 0.00 175.17 174.79 2z47 s LYS 2072N -4.69 3.03 -0.92 8.23 1.02 -1.26 -4.34 119.74 120.82 2z47 s LYS 2072Ca 0.53 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 55.43 2z47 s LYS 2072Cb -0.11 -2.80 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 2z47 s LYS 2072CO 0.45 -0.04 0.00 0.41 -0.92 0.00 0.00 175.35 175.25 2z47 n GLY 2073N -1.70 1.04 3.88 -3.33 0.00 -1.26 -5.01 105.19 98.81 2z47 n GLY 2073Ca 0.02 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 2z47 n GLY 2073CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2z47 s THR 2074N -2.32 4.89 0.41 2.61 -4.23 -1.26 -4.98 115.64 110.76 2z47 s THR 2074Ca 0.00 0.42 0.13 0.00 -1.18 0.00 0.00 61.69 61.06 2z47 s THR 2074Cb 0.00 -3.69 0.33 0.00 1.34 0.00 0.00 72.50 70.48 2z47 s THR 2074CO 0.00 -0.31 1.93 0.50 -0.54 0.00 0.00 174.62 176.20 2z47 h LYS 2075N 1.81 0.50 -6.23 3.99 3.64 -1.98 -3.39 116.57 114.91 2z47 h LYS 2075Ca -0.47 -0.03 -0.64 0.00 -1.27 0.00 0.00 60.65 58.24 2z47 h LYS 2075Cb 1.18 -0.11 -0.30 0.00 -0.41 0.00 0.00 32.23 32.59 2z47 h LYS 2075CO 0.66 0.33 -0.87 -0.06 -2.27 0.00 0.00 179.45 177.24 2z47 s PHE 2076N -5.49 2.02 0.23 1.91 0.08 -1.26 -5.10 117.98 110.37 2z47 s PHE 2076Ca -0.08 -0.38 -0.32 0.00 0.12 0.00 0.00 56.93 56.27 2z47 s PHE 2076Cb 0.21 -1.30 -0.12 0.00 -0.57 0.00 0.00 43.02 41.23 2z47 s PHE 2076CO 0.77 -0.03 1.63 1.63 -0.10 0.00 0.00 175.22 179.11 2z47 n LYS 2077N 2.53 2.57 -2.31 0.44 4.76 -1.26 -4.99 118.16 119.89 2z47 n LYS 2077Ca -0.15 0.92 -0.25 0.00 -2.87 0.00 0.00 58.31 55.96 2z47 n LYS 2077Cb 0.52 -2.72 0.08 0.00 -1.84 0.00 0.00 35.03 31.07 2z47 n LYS 2077CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2z47 s SER 2078N 0.84 4.70 0.12 4.39 1.04 -1.26 -4.81 113.70 118.72 2z47 s SER 2078Ca 0.72 0.25 -0.29 0.00 0.48 0.00 0.00 55.95 57.10 2z47 s SER 2078Cb -0.55 -0.85 -0.08 0.00 0.10 0.00 0.00 66.02 64.64 2z47 s SER 2078CO 0.40 -1.64 1.60 0.00 0.98 0.00 0.00 173.24 174.57 2z47 h VAL 2080N -0.56 1.29 -0.33 0.00 2.07 -1.70 -1.99 116.25 115.03 2z47 h VAL 2080Ca 0.04 -1.62 0.03 0.00 0.82 0.00 0.00 66.70 65.98 2z47 h VAL 2080Cb 0.63 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 2z47 h VAL 2080CO -0.28 0.52 0.14 1.23 0.02 0.00 0.00 177.57 179.20 2z47 h GLY 2081N 0.94 0.43 1.07 2.17 0.00 -1.65 -0.09 103.07 105.93 2z47 h GLY 2081Ca 0.04 -0.10 -0.14 0.00 0.00 0.00 0.00 47.33 47.14 2z47 h GLY 2081CO 0.09 0.06 -0.30 0.00 0.00 0.00 0.00 176.54 176.39 2z47 h HIS 2083N 0.68 0.68 -0.94 0.00 3.86 -1.08 -1.49 115.15 116.85 2z47 h HIS 2083Ca 0.07 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2z47 h HIS 2083Cb 0.89 -0.21 -0.05 0.00 1.06 0.00 0.00 27.41 29.10 2z47 h HIS 2083CO 0.06 0.56 0.58 -0.07 0.86 0.00 0.00 177.93 179.92 2z47 h LEU 2084N 0.66 1.12 -0.70 2.43 3.38 -0.94 0.16 115.31 121.43 2z47 h LEU 2084Ca 0.16 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 2z47 h LEU 2084Cb 0.20 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2z47 h LEU 2084CO -0.01 0.86 -0.53 -0.33 0.09 0.00 0.00 178.44 178.52 2z47 h GLU 2085N 1.30 0.33 -0.29 1.13 5.08 -1.36 -2.56 114.58 118.21 2z47 h GLU 2085Ca 0.34 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 2z47 h GLU 2085Cb -0.07 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2z47 h GLU 2085CO -0.07 0.78 -0.20 1.15 -1.00 0.00 0.00 179.01 179.68 2z47 h THR 2086N 0.26 1.30 -0.01 1.13 2.02 -0.50 -3.24 112.91 113.87 2z47 h THR 2086Ca 0.01 -1.33 -0.11 0.00 0.77 0.00 0.00 66.41 65.74 2z47 h THR 2086Cb 1.02 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.94 2z47 h THR 2086CO 0.09 0.42 -0.53 0.00 0.37 0.00 0.00 175.52 175.87 2z47 h ALA 2087N 0.73 1.10 -0.91 6.16 0.00 -0.66 -3.48 119.26 122.19 2z47 h ALA 2087Ca 0.06 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2z47 h ALA 2087Cb 0.74 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2z47 h ALA 2087CO 0.05 0.66 0.00 0.41 0.00 0.00 0.00 179.25 180.38 2z47 n GLY 2088N 0.01 3.45 1.41 0.00 0.00 -0.97 -1.70 105.19 107.38 2z47 n GLY 2088Ca -0.01 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 45.99 2z47 n GLY 2088CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2z47 n ALA 2089N 11.23 2.68 -2.61 4.61 0.00 -1.26 -4.85 120.51 130.31 2z47 n ALA 2089Ca 0.00 -1.35 -0.41 0.00 0.00 0.00 0.00 53.44 51.67 2z47 n ALA 2089Cb 0.00 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 2z47 n ALA 2089CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2z47 s ASP 2090N -0.95 6.22 0.26 0.00 3.68 -0.69 -4.89 116.67 120.31 2z47 s ASP 2090Ca 0.48 -0.71 -0.01 0.00 2.13 0.00 0.00 52.55 54.44 2z47 s ASP 2090Cb 0.28 -2.53 0.51 0.00 -1.45 0.00 0.00 42.92 39.73 2z47 s ASP 2090CO 0.29 -1.71 1.79 0.00 0.13 0.00 0.00 175.17 175.66 2z47 h ALA 2091N 9.90 1.32 -0.18 3.66 0.00 -1.88 0.21 119.26 132.27 2z47 h ALA 2091Ca -0.21 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2z47 h ALA 2091Cb 1.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2z47 h ALA 2091CO 1.28 0.02 0.12 0.00 0.00 0.00 0.00 179.25 180.67 2z47 h ALA 2092N 1.53 0.23 -0.13 0.00 0.00 -1.96 -0.92 119.26 118.01 2z47 h ALA 2092Ca 0.46 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.24 2z47 h ALA 2092Cb 0.56 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2z47 h ALA 2092CO -0.31 -0.28 -0.39 0.87 0.00 0.00 0.00 179.25 179.14 2z47 h LYS 2093N 0.24 0.29 -0.67 0.00 1.79 -1.70 -1.60 116.57 114.92 2z47 h LYS 2093Ca 0.07 -0.14 -0.05 0.00 -2.18 0.00 0.00 60.65 58.36 2z47 h LYS 2093Cb -0.01 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.60 2z47 h LYS 2093CO -0.01 0.64 0.24 -0.22 -1.08 0.00 0.00 179.45 179.02 2z47 h LYS 2094N 0.25 1.02 -0.32 3.15 3.64 -0.19 0.22 116.57 124.32 2z47 h LYS 2094Ca 0.02 -0.20 -0.11 0.00 -1.27 0.00 0.00 60.65 59.09 2z47 h LYS 2094Cb 0.80 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2z47 h LYS 2094CO 0.06 0.87 -0.24 -0.22 -2.27 0.00 0.00 179.45 177.65 2z47 h LYS 2095N 0.96 0.73 -0.56 1.90 1.63 -0.99 0.27 116.57 120.52 2z47 h LYS 2095Ca 0.22 -0.35 -0.07 0.00 -0.85 0.00 0.00 60.65 59.60 2z47 h LYS 2095Cb 0.26 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 2z47 h LYS 2095CO -0.01 0.97 0.09 1.49 -3.45 0.00 0.00 179.45 178.54 2z47 h GLU 2096N 0.49 0.92 0.00 1.90 4.81 -0.98 -2.64 114.58 119.08 2z47 h GLU 2096Ca 0.06 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 2z47 h GLU 2096Cb 0.80 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2z47 h GLU 2096CO 0.06 0.88 -1.54 1.28 -0.73 0.00 0.00 179.01 178.97 2z47 n LEU 2097N -4.35 0.25 0.00 1.64 4.77 0.73 -1.03 117.00 119.02 2z47 n LEU 2097Ca 0.02 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 2z47 n LEU 2097Cb 0.27 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2z47 n LEU 2097CO 0.41 0.06 0.05 0.35 -1.33 0.00 0.00 177.39 176.93 2z47 n THR 2098N -1.92 0.00 -1.75 -5.08 -2.24 0.91 -4.85 114.28 99.35 2z47 n THR 2098Ca -0.01 -0.29 -0.41 0.00 -2.27 0.00 0.00 64.05 61.07 2z47 n THR 2098Cb 0.42 1.14 0.01 0.00 -2.10 0.00 0.00 70.33 69.80 2z47 n THR 2098CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2z47 n GLY 2099N 0.39 0.97 0.21 3.38 0.00 -0.88 -4.90 105.19 104.37 2z47 n GLY 2099Ca 0.00 0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.36 2z47 n GLY 2099CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2z47 s LYS 2101N -3.28 0.35 -0.11 0.00 -0.14 -1.26 -4.73 119.74 110.58 2z47 s LYS 2101Ca 0.05 0.06 0.00 0.00 -1.36 0.00 0.00 55.97 54.72 2z47 s LYS 2101Cb 0.07 0.16 0.00 0.00 -1.68 0.00 0.00 37.83 36.37 2z47 s LYS 2101CO 0.66 -0.07 0.00 0.41 -0.76 0.00 0.00 175.35 175.59 2z47 n GLY 2102N 2.39 0.49 3.98 -3.33 0.00 0.11 -4.98 105.19 103.86 2z47 n GLY 2102Ca -0.16 -0.57 -0.22 0.00 0.00 0.00 0.00 46.02 45.07 2z47 n GLY 2102CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2z47 s SER 2103N -2.55 4.90 0.00 1.61 1.04 -0.49 -4.67 113.70 113.53 2z47 s SER 2103Ca 0.00 -1.02 0.25 0.00 0.48 0.00 0.00 55.95 55.66 2z47 s SER 2103Cb 0.00 0.37 1.23 0.00 0.10 0.00 0.00 66.02 67.72 2z47 s SER 2103CO 0.00 -1.26 1.83 0.29 0.98 0.00 0.00 173.24 175.08 2z47 n LYS 2104N -2.06 0.31 -0.13 4.02 5.02 -0.20 -3.51 118.16 121.62 2z47 n LYS 2104Ca 0.09 0.06 -0.27 0.00 -2.02 0.00 0.00 58.31 56.16 2z47 n LYS 2104Cb 0.63 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 34.04 2z47 n LYS 2104CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2z47 s HIS 2106N -2.50 3.00 -2.00 0.00 3.76 -1.23 -4.64 115.29 111.69 2z47 s HIS 2106Ca -0.36 -2.22 0.11 0.00 -0.15 0.00 0.00 55.06 52.44 2z47 s HIS 2106Cb 0.13 -1.95 0.66 0.00 1.11 0.00 0.00 32.58 32.53 2z47 s HIS 2106CO 0.50 -0.86 1.10 -1.13 -0.85 0.00 0.00 174.74 173.51