#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ga6 s VAL 2003N 0.00 4.23 -0.06 0.00 1.01 -1.26 -4.16 120.40 120.16 3ga6 s VAL 2003Ca 0.00 1.87 0.04 0.00 0.00 0.00 0.00 61.98 63.89 3ga6 s VAL 2003Cb 0.00 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 32.16 3ga6 s VAL 2003CO 0.00 0.50 -0.19 -0.22 0.00 0.00 0.00 175.10 175.19 3ga6 s LEU 2004N -1.19 1.93 -0.24 3.92 0.20 -0.42 -4.98 118.68 117.90 3ga6 s LEU 2004Ca 0.38 -0.41 -0.05 0.00 0.69 0.00 0.00 54.13 54.74 3ga6 s LEU 2004Cb -0.24 -1.10 -0.01 0.00 -0.43 0.00 0.00 46.19 44.40 3ga6 s LEU 2004CO 0.29 0.15 0.01 -0.75 -0.29 0.00 0.00 176.35 175.75 3ga6 s LYS 2005N 0.17 3.44 -0.11 1.98 2.20 -1.26 -1.40 119.74 124.76 3ga6 s LYS 2005Ca -0.09 -0.60 0.02 0.00 -0.36 0.00 0.00 55.97 54.94 3ga6 s LYS 2005Cb -0.14 -3.15 -0.01 0.00 -1.51 0.00 0.00 37.83 33.01 3ga6 s LYS 2005CO 0.04 -0.22 -0.17 0.42 -0.36 0.00 0.00 175.35 175.07 3ga6 s ILE 2006N 1.53 2.75 -0.01 5.43 1.01 0.12 -0.56 121.20 131.47 3ga6 s ILE 2006Ca 0.06 -0.78 0.07 0.00 0.00 0.00 0.00 60.65 60.00 3ga6 s ILE 2006Cb -0.15 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 3ga6 s ILE 2006CO -0.00 0.54 -0.22 -0.63 0.00 0.00 0.00 174.94 174.63 3ga6 s ILE 2007N 0.22 2.42 -0.12 2.92 1.01 0.09 -0.50 121.20 127.23 3ga6 s ILE 2007Ca -0.10 -1.07 0.00 0.00 0.00 0.00 0.00 60.65 59.47 3ga6 s ILE 2007Cb -0.16 -1.91 0.02 0.00 0.01 0.00 0.00 42.46 40.42 3ga6 s ILE 2007CO 0.06 0.51 -0.10 -0.55 0.00 0.00 0.00 174.94 174.86 3ga6 s SER 2008N -0.86 2.26 -0.06 3.58 0.15 0.26 0.19 113.70 119.22 3ga6 s SER 2008Ca 0.11 -0.35 -0.00 0.00 0.70 0.00 0.00 55.95 56.42 3ga6 s SER 2008Cb -0.10 -0.92 0.03 0.00 -1.71 0.00 0.00 66.02 63.31 3ga6 s SER 2008CO 0.01 -0.09 -0.02 0.86 1.20 0.00 0.00 173.24 175.20 3ga6 s TRP 2009N 1.53 0.70 -0.56 3.44 -0.00 0.09 -0.87 118.94 123.27 3ga6 s TRP 2009Ca 0.03 -0.19 -0.22 0.00 -0.00 0.00 0.00 56.10 55.71 3ga6 s TRP 2009Cb -0.13 -0.72 0.05 0.00 -0.00 0.00 0.00 33.47 32.67 3ga6 s TRP 2009CO -0.07 -0.26 0.86 1.21 -0.00 0.00 0.00 176.95 178.69 3ga6 s ASN 2010N 1.43 6.27 0.20 5.86 3.04 -1.26 -0.83 114.94 129.65 3ga6 s ASN 2010Ca -0.03 -0.65 0.21 0.00 0.04 0.00 0.00 52.86 52.43 3ga6 s ASN 2010Cb -0.13 -2.39 0.01 0.00 -1.54 0.00 0.00 41.25 37.20 3ga6 s ASN 2010CO -0.03 -1.18 1.08 0.58 -3.04 0.00 0.00 177.10 174.51 3ga6 h VAL 2011N 5.97 0.15 -5.99 -5.21 2.07 -1.45 -3.37 116.25 108.42 3ga6 h VAL 2011Ca -0.27 -1.28 -0.22 0.00 0.82 0.00 0.00 66.70 65.75 3ga6 h VAL 2011Cb 1.08 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.57 3ga6 h VAL 2011CO 1.08 0.09 -0.62 -3.20 0.02 0.00 0.00 177.57 174.93 3ga6 n ASN 2012N -2.80 -6.52 -0.55 0.57 5.15 -0.55 -4.59 115.26 105.97 3ga6 n ASN 2012Ca -0.02 -0.28 0.00 0.00 -0.60 0.00 0.00 54.58 53.68 3ga6 n ASN 2012Cb 0.62 -3.59 0.00 0.00 -0.53 0.00 0.00 39.78 36.28 3ga6 n ASN 2012CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ga6 n GLY 2013N -1.27 -1.06 0.26 8.20 0.00 -0.82 -4.81 105.19 105.69 3ga6 n GLY 2013Ca -0.10 -0.62 -0.11 0.00 0.00 0.00 0.00 46.02 45.19 3ga6 n GLY 2013CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ga6 h LEU 2014N 0.00 0.89 -1.13 0.99 5.85 -1.38 -1.87 115.31 118.66 3ga6 h LEU 2014Ca 0.00 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3ga6 h LEU 2014Cb 0.00 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.74 3ga6 h LEU 2014CO 0.00 1.16 0.55 0.03 -0.34 0.00 0.00 178.44 179.84 3ga6 h ARG 2015N 0.69 1.14 -0.19 1.25 3.08 -1.90 -2.22 114.38 116.23 3ga6 h ARG 2015Ca 0.06 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 3ga6 h ARG 2015Cb 0.94 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 3ga6 h ARG 2015CO 0.09 0.77 -0.08 0.00 -1.07 0.00 0.00 179.97 179.68 3ga6 h ALA 2016N 1.44 0.27 0.00 0.04 0.00 -1.81 -2.69 119.26 116.51 3ga6 h ALA 2016Ca 0.31 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3ga6 h ALA 2016Cb -0.11 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3ga6 h ALA 2016CO -0.06 0.08 -0.14 -0.24 0.00 0.00 0.00 179.25 178.88 3ga6 h VAL 2017N 0.09 0.41 -0.51 0.00 3.04 -1.25 -1.18 116.25 116.85 3ga6 h VAL 2017Ca 0.04 -0.82 -0.11 0.00 -1.01 0.00 0.00 66.70 64.81 3ga6 h VAL 2017Cb 0.55 1.59 -0.02 0.00 -2.01 0.00 0.00 31.29 31.40 3ga6 h VAL 2017CO 0.03 0.14 -0.12 -0.74 -1.01 0.00 0.00 177.57 175.87 3ga6 h HIS 2018N 0.00 1.07 0.00 3.17 6.17 -1.18 0.34 115.15 124.72 3ga6 h HIS 2018Ca -0.00 -0.22 0.00 0.00 0.71 0.00 0.00 60.37 60.86 3ga6 h HIS 2018Cb 0.58 -0.27 0.00 0.00 2.52 0.00 0.00 27.41 30.24 3ga6 h HIS 2018CO 0.00 1.01 0.00 0.54 0.71 0.00 0.00 177.93 180.19 3ga6 n ARG 2019N -4.14 0.78 -0.29 5.26 1.74 -0.47 -3.11 116.66 116.43 3ga6 n ARG 2019Ca 0.01 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.16 3ga6 n ARG 2019Cb 0.40 -1.33 0.09 0.00 -1.02 0.00 0.00 32.46 30.59 3ga6 n ARG 2019CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3ga6 n LYS 2020N -0.83 0.82 -0.87 5.56 5.02 -0.82 -5.01 118.16 122.02 3ga6 n LYS 2020Ca 0.13 -2.06 0.00 0.00 -2.02 0.00 0.00 58.31 54.36 3ga6 n LYS 2020Cb 0.06 -1.12 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 3ga6 n LYS 2020CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ga6 n GLY 2021N -0.87 0.84 0.29 0.72 0.00 -1.06 -4.89 105.19 100.22 3ga6 n GLY 2021Ca 0.10 -0.58 0.03 0.00 0.00 0.00 0.00 46.02 45.58 3ga6 n GLY 2021CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3ga6 h PHE 2022N 0.00 0.70 -0.16 1.61 3.57 -1.12 -2.36 116.94 119.18 3ga6 h PHE 2022Ca 0.00 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.45 3ga6 h PHE 2022Cb 0.29 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 3ga6 h PHE 2022CO 0.00 0.23 -0.27 -0.07 -2.23 0.00 0.00 178.31 175.97 3ga6 h LEU 2023N 0.63 0.29 0.03 0.59 3.38 -1.85 -0.77 115.31 117.62 3ga6 h LEU 2023Ca 0.39 -0.09 -0.23 0.00 0.09 0.00 0.00 57.88 58.05 3ga6 h LEU 2023Cb 0.46 -0.08 0.02 0.00 0.09 0.00 0.00 40.66 41.15 3ga6 h LEU 2023CO -0.30 0.56 -0.90 0.50 0.09 0.00 0.00 178.44 178.39 3ga6 h LYS 2024N 0.26 0.55 -0.22 1.13 1.63 -1.92 -1.68 116.57 116.31 3ga6 h LYS 2024Ca 0.04 -0.64 0.03 0.00 -0.85 0.00 0.00 60.65 59.23 3ga6 h LYS 2024Cb 0.61 0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 32.41 3ga6 h LYS 2024CO 0.04 1.25 0.05 2.35 -3.45 0.00 0.00 179.45 179.70 3ga6 h TRP 2025N 0.13 0.09 -0.77 1.91 7.01 -1.09 -1.83 115.95 121.40 3ga6 h TRP 2025Ca -0.12 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 60.89 3ga6 h TRP 2025Cb 1.59 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 28.61 3ga6 h TRP 2025CO 0.13 0.03 0.48 0.35 -2.79 0.00 0.00 178.44 176.64 3ga6 h PHE 2026N 0.14 0.99 -0.80 2.65 -0.00 -1.19 -1.37 116.94 117.36 3ga6 h PHE 2026Ca 0.10 0.01 0.17 0.00 -0.00 0.00 0.00 57.97 58.24 3ga6 h PHE 2026Cb 0.09 -0.33 -0.05 0.00 -0.00 0.00 0.00 35.95 35.66 3ga6 h PHE 2026CO -0.14 0.66 0.54 1.98 -0.00 0.00 0.00 178.31 181.34 3ga6 h MET 2027N 1.04 0.39 0.14 1.11 4.05 -0.70 -0.83 114.93 120.14 3ga6 h MET 2027Ca 0.28 -0.02 -0.35 0.00 -0.28 0.00 0.00 59.70 59.32 3ga6 h MET 2027Cb -0.06 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.64 3ga6 h MET 2027CO -0.05 0.26 -1.84 0.93 0.23 0.00 0.00 176.91 176.44 3ga6 h GLU 2028N 0.40 0.30 -0.14 0.39 5.08 -0.48 -3.36 114.58 116.77 3ga6 h GLU 2028Ca 0.40 -0.52 -0.17 0.00 -1.00 0.00 0.00 59.36 58.07 3ga6 h GLU 2028Cb 0.97 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 3ga6 h GLU 2028CO -0.13 1.21 -0.63 0.93 -1.00 0.00 0.00 179.01 179.38 3ga6 h GLU 2029N 0.08 0.53 -6.90 2.33 4.39 -1.09 -3.48 114.58 110.45 3ga6 h GLU 2029Ca -0.37 -0.37 -0.59 0.00 0.34 0.00 0.00 59.36 58.37 3ga6 h GLU 2029Cb 2.06 0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 30.70 3ga6 h GLU 2029CO 0.13 0.99 -0.98 1.63 -1.16 0.00 0.00 179.01 179.62 3ga6 n LYS 2030N -3.91 -0.79 -0.67 2.33 5.02 -0.34 -4.94 118.16 114.87 3ga6 n LYS 2030Ca -0.04 0.13 -0.28 0.00 -2.02 0.00 0.00 58.31 56.10 3ga6 n LYS 2030Cb 0.65 -3.14 0.24 0.00 -0.02 0.00 0.00 35.03 32.76 3ga6 n LYS 2030CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 3ga6 s PRO 2031N -7.25 -0.87 0.04 1.97 0.02 -1.26 -4.95 135.00 122.70 3ga6 s PRO 2031Ca 0.30 0.69 0.04 0.00 0.02 0.00 0.00 61.00 62.04 3ga6 s PRO 2031Cb -0.16 -1.57 -0.24 0.00 0.02 0.00 0.00 34.50 32.55 3ga6 s PRO 2031CO 0.97 -3.65 0.98 -0.44 -0.33 0.00 0.00 177.00 174.52 3ga6 h ASP 2032N -2.57 0.17 -3.52 2.53 3.32 -1.19 -3.45 116.42 111.71 3ga6 h ASP 2032Ca -0.60 -0.23 -0.39 0.00 0.02 0.00 0.00 57.03 55.84 3ga6 h ASP 2032Cb 1.34 -0.05 -0.33 0.00 0.22 0.00 0.00 39.33 40.50 3ga6 h ASP 2032CO 0.51 1.19 -0.76 -0.63 -1.72 0.00 0.00 179.24 177.83 3ga6 s ILE 2033N -2.65 0.44 -0.21 0.35 1.01 -0.86 -2.02 121.20 117.27 3ga6 s ILE 2033Ca -0.04 -0.09 -0.02 0.00 0.00 0.00 0.00 60.65 60.50 3ga6 s ILE 2033Cb 0.08 -0.47 0.00 0.00 0.01 0.00 0.00 42.46 42.08 3ga6 s ILE 2033CO 0.84 0.19 -0.09 -0.22 0.00 0.00 0.00 174.94 175.66 3ga6 s LEU 2034N 0.81 2.65 -0.21 2.97 0.20 0.15 -0.74 118.68 124.52 3ga6 s LEU 2034Ca -0.10 -0.47 -0.05 0.00 0.69 0.00 0.00 54.13 54.20 3ga6 s LEU 2034Cb -0.13 -1.66 -0.02 0.00 -0.43 0.00 0.00 46.19 43.95 3ga6 s LEU 2034CO -0.00 -0.01 -0.01 0.00 -0.29 0.00 0.00 176.35 176.04 3ga6 s LEU 2036N 1.12 3.65 0.16 0.00 1.43 0.43 -0.73 118.68 124.74 3ga6 s LEU 2036Ca 0.02 -0.14 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 3ga6 s LEU 2036Cb -0.14 -2.32 -0.04 0.00 0.03 0.00 0.00 46.19 43.71 3ga6 s LEU 2036CO 0.01 0.13 -0.12 -1.10 0.23 0.00 0.00 176.35 175.50 3ga6 s GLN 2037N -2.65 1.14 -0.91 1.70 1.11 -0.01 -2.29 119.66 117.75 3ga6 s GLN 2037Ca 0.29 -1.46 -0.08 0.00 0.01 0.00 0.00 55.36 54.11 3ga6 s GLN 2037Cb -0.11 -0.84 0.00 0.00 -1.01 0.00 0.00 33.01 31.05 3ga6 s GLN 2037CO 0.21 0.13 0.68 -1.91 0.01 0.00 0.00 175.29 174.41 3ga6 n GLU 2038N -0.14 -1.30 0.00 2.91 2.13 0.13 -1.57 120.64 122.79 3ga6 n GLU 2038Ca -0.10 0.82 0.12 0.00 0.66 0.00 0.00 57.16 58.65 3ga6 n GLU 2038Cb 0.60 -3.66 0.20 0.00 0.27 0.00 0.00 31.44 28.85 3ga6 n GLU 2038CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 3ga6 n ILE 2039N -3.00 0.00 -4.16 6.31 -6.64 -0.69 -1.48 119.36 109.71 3ga6 n ILE 2039Ca -0.17 -0.12 -0.29 0.00 -1.77 0.00 0.00 62.75 60.41 3ga6 n ILE 2039Cb 0.61 0.66 -0.06 0.00 -1.44 0.00 0.00 39.64 39.40 3ga6 n ILE 2039CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 3ga6 n LYS 2040N -0.74 -2.01 -3.60 6.28 5.02 0.11 -1.21 118.16 122.00 3ga6 n LYS 2040Ca 0.09 0.23 -0.08 0.00 -2.02 0.00 0.00 58.31 56.53 3ga6 n LYS 2040Cb 0.37 -4.03 -0.05 0.00 -0.02 0.00 0.00 35.03 31.30 3ga6 n LYS 2040CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ga6 s ALA 2041N -4.18 -1.99 0.35 7.82 0.00 -1.26 -4.46 121.76 118.04 3ga6 s ALA 2041Ca 0.02 1.69 -0.03 0.00 0.00 0.00 0.00 51.96 53.64 3ga6 s ALA 2041Cb -0.01 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 3ga6 s ALA 2041CO 0.95 -0.27 0.60 0.00 0.00 0.00 0.00 175.76 177.04 3ga6 s ALA 2042N -0.86 3.61 0.24 0.00 0.00 -1.26 -4.67 121.76 118.82 3ga6 s ALA 2042Ca 0.02 -0.70 -0.04 0.00 0.00 0.00 0.00 51.96 51.23 3ga6 s ALA 2042Cb -0.01 -2.28 0.41 0.00 0.00 0.00 0.00 23.12 21.24 3ga6 s ALA 2042CO -0.02 0.00 1.78 -1.35 0.00 0.00 0.00 175.76 176.17 3ga6 h PRO 2043N 0.97 0.65 0.00 0.00 0.11 -1.97 -1.77 132.00 129.99 3ga6 h PRO 2043Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3ga6 h PRO 2043Cb 1.21 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3ga6 h PRO 2043CO 0.63 0.43 0.00 1.05 -0.21 0.00 0.00 178.00 179.90 3ga6 h GLU 2044N 0.67 0.00 0.00 1.05 9.09 -1.98 -0.03 114.58 123.38 3ga6 h GLU 2044Ca 0.40 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.81 3ga6 h GLU 2044Cb 0.44 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.54 3ga6 h GLU 2044CO -0.29 0.00 0.00 1.04 0.05 0.00 0.00 179.01 179.81 3ga6 n GLN 2045N -2.60 0.54 -3.63 1.06 6.02 -0.66 -4.81 117.38 113.29 3ga6 n GLN 2045Ca 0.00 0.02 -0.38 0.00 -0.01 0.00 0.00 57.00 56.64 3ga6 n GLN 2045Cb 0.20 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.90 3ga6 n GLN 2045CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3ga6 s LEU 2046N -2.40 4.45 0.97 1.08 1.43 -0.03 -5.01 118.68 119.17 3ga6 s LEU 2046Ca 0.31 0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 54.08 3ga6 s LEU 2046Cb 0.19 -2.41 0.10 0.00 0.03 0.00 0.00 46.19 44.10 3ga6 s LEU 2046CO 0.39 0.35 0.68 -2.65 0.23 0.00 0.00 176.35 175.36 3ga6 n PRO 2047N 1.88 -0.64 0.14 1.29 -0.02 -1.26 -4.74 135.00 131.64 3ga6 n PRO 2047Ca -0.16 -0.14 -0.01 0.00 -2.02 0.00 0.00 63.50 61.17 3ga6 n PRO 2047Cb 0.53 -2.05 0.17 0.00 -0.02 0.00 0.00 33.50 32.13 3ga6 n PRO 2047CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3ga6 h ARG 2048N -1.82 0.00 0.00 -0.52 2.43 -1.95 -0.52 114.38 111.99 3ga6 h ARG 2048Ca -0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3ga6 h ARG 2048Cb 1.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 3ga6 h ARG 2048CO 0.38 0.61 0.00 0.87 -1.51 0.00 0.00 179.97 180.32 3ga6 h LYS 2049N 0.00 0.00 0.03 0.20 6.56 -1.91 -0.06 116.57 121.39 3ga6 h LYS 2049Ca -0.01 0.00 -0.33 0.00 -1.06 0.00 0.00 60.65 59.26 3ga6 h LYS 2049Cb 1.09 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.70 3ga6 h LYS 2049CO 0.08 0.00 -1.81 -0.11 -2.06 0.00 0.00 179.45 175.55 3ga6 n LEU 2050N -2.77 2.15 -0.06 2.94 7.94 -1.12 -4.46 117.00 121.62 3ga6 n LEU 2050Ca 0.02 0.31 -0.03 0.00 -1.11 0.00 0.00 56.01 55.20 3ga6 n LEU 2050Cb 0.34 -0.96 0.21 0.00 0.53 0.00 0.00 43.42 43.53 3ga6 n LEU 2050CO 0.27 0.53 0.88 -0.09 -1.11 0.00 0.00 177.39 177.87 3ga6 h ARG 2051N -0.68 0.67 -3.67 1.96 2.43 -1.03 -3.39 114.38 110.67 3ga6 h ARG 2051Ca -0.46 -0.18 -0.60 0.00 -0.81 0.00 0.00 59.98 57.93 3ga6 h ARG 2051Cb 1.59 -0.08 -0.40 0.00 -0.42 0.00 0.00 29.97 30.66 3ga6 h ARG 2051CO -0.18 0.71 -0.74 -1.01 -1.51 0.00 0.00 179.97 177.23 3ga6 s HIS 2052N -4.92 2.16 -0.22 2.20 3.76 -0.04 -4.75 115.29 113.47 3ga6 s HIS 2052Ca -0.09 -2.11 -0.12 0.00 -0.15 0.00 0.00 55.06 52.59 3ga6 s HIS 2052Cb 0.15 -1.99 -0.05 0.00 1.11 0.00 0.00 32.58 31.80 3ga6 s HIS 2052CO 0.79 -0.87 0.25 0.08 -0.85 0.00 0.00 174.74 174.14 3ga6 s VAL 2053N 1.25 5.30 0.26 -0.90 1.01 -1.26 -4.60 120.40 121.47 3ga6 s VAL 2053Ca 0.11 0.38 -0.30 0.00 0.00 0.00 0.00 61.98 62.18 3ga6 s VAL 2053Cb -0.19 -3.58 -0.14 0.00 0.00 0.00 0.00 36.38 32.47 3ga6 s VAL 2053CO -0.17 0.32 1.12 1.21 0.00 0.00 0.00 175.10 177.57 3ga6 n GLU 2054N 4.31 1.46 -0.98 2.72 2.13 -1.26 -0.81 120.64 128.20 3ga6 n GLU 2054Ca -0.13 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.21 3ga6 n GLU 2054Cb 0.52 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 30.26 3ga6 n GLU 2054CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ga6 n GLY 2055N 1.51 0.69 3.07 8.31 0.00 -1.26 -5.00 105.19 112.51 3ga6 n GLY 2055Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 3ga6 n GLY 2055CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ga6 s TYR 2056N -2.75 1.19 -0.06 1.61 2.02 0.01 -4.25 117.35 115.12 3ga6 s TYR 2056Ca 0.00 -0.27 -0.15 0.00 -0.37 0.00 0.00 57.07 56.28 3ga6 s TYR 2056Cb 0.00 -0.80 -0.05 0.00 -0.40 0.00 0.00 41.96 40.71 3ga6 s TYR 2056CO 0.00 -0.07 0.39 0.50 -1.57 0.00 0.00 175.55 174.80 3ga6 s ARG 2057N -0.08 4.05 -0.01 -0.62 6.06 0.13 -4.49 118.95 124.00 3ga6 s ARG 2057Ca 0.01 0.33 0.08 0.00 -2.50 0.00 0.00 55.73 53.65 3ga6 s ARG 2057Cb -0.07 -3.31 -0.02 0.00 0.06 0.00 0.00 34.95 31.61 3ga6 s ARG 2057CO 0.00 0.49 -0.25 -1.54 -2.50 0.00 0.00 175.30 171.50 3ga6 s SER 2058N -0.40 2.99 -0.10 -2.12 1.04 -1.26 -0.03 113.70 113.82 3ga6 s SER 2058Ca 0.22 -0.48 0.01 0.00 0.48 0.00 0.00 55.95 56.18 3ga6 s SER 2058Cb -0.15 -0.32 0.02 0.00 0.10 0.00 0.00 66.02 65.66 3ga6 s SER 2058CO 0.10 0.30 -0.10 -0.36 0.98 0.00 0.00 173.24 174.16 3ga6 s PHE 2059N -0.63 1.61 -0.16 5.02 0.40 0.12 -4.98 117.98 119.35 3ga6 s PHE 2059Ca 0.10 -0.76 0.00 0.00 -0.60 0.00 0.00 56.93 55.67 3ga6 s PHE 2059Cb -0.10 -1.25 0.00 0.00 0.51 0.00 0.00 43.02 42.18 3ga6 s PHE 2059CO -0.01 -0.46 -0.15 -0.06 0.70 0.00 0.00 175.22 175.24 3ga6 s PHE 2060N 1.32 2.79 -0.58 0.36 0.40 -1.26 -0.26 117.98 120.75 3ga6 s PHE 2060Ca -0.02 -1.10 0.04 0.00 -0.60 0.00 0.00 56.93 55.26 3ga6 s PHE 2060Cb -0.14 -1.90 0.15 0.00 0.51 0.00 0.00 43.02 41.64 3ga6 s PHE 2060CO -0.05 -0.51 0.36 0.99 0.70 0.00 0.00 175.22 176.71 3ga6 s THR 2061N 0.90 2.36 0.58 0.64 2.01 -0.00 -4.94 115.64 117.19 3ga6 s THR 2061Ca -0.04 -3.56 -0.13 0.00 0.31 0.00 0.00 61.69 58.27 3ga6 s THR 2061Cb -0.15 -2.59 -0.05 0.00 0.01 0.00 0.00 72.50 69.71 3ga6 s THR 2061CO -0.02 -0.94 1.02 -2.16 -0.69 0.00 0.00 174.62 171.83 3ga6 s PRO 2062N -0.66 3.69 0.78 4.92 0.04 -1.26 -1.52 135.00 140.98 3ga6 s PRO 2062Ca 0.22 0.85 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 3ga6 s PRO 2062Cb -0.14 -2.09 0.06 0.00 0.04 0.00 0.00 34.50 32.36 3ga6 s PRO 2062CO -0.09 -0.49 1.09 0.00 0.04 0.00 0.00 177.00 177.55 3ga6 s ALA 2063N -2.95 2.31 0.20 8.56 0.00 -1.26 -3.70 121.76 124.92 3ga6 s ALA 2063Ca 0.57 -0.11 0.08 0.00 0.00 0.00 0.00 51.96 52.50 3ga6 s ALA 2063Cb -0.11 -3.14 0.09 0.00 0.00 0.00 0.00 23.12 19.96 3ga6 s ALA 2063CO 0.45 -1.65 1.45 0.93 0.00 0.00 0.00 175.76 176.94 3ga6 h GLU 2064N -1.03 0.02 -6.27 0.00 5.08 -1.57 -3.42 114.58 107.38 3ga6 h GLU 2064Ca -0.46 -0.02 -0.56 0.00 -1.00 0.00 0.00 59.36 57.31 3ga6 h GLU 2064Cb 1.25 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 3ga6 h GLU 2064CO 0.58 0.81 1.12 0.50 -1.00 0.00 0.00 179.01 181.02 3ga6 s ARG 2065N -3.20 3.83 0.25 2.33 6.06 -1.26 -4.97 118.95 121.99 3ga6 s ARG 2065Ca -0.01 1.71 -0.31 0.00 -2.50 0.00 0.00 55.73 54.63 3ga6 s ARG 2065Cb 0.11 -4.03 -0.13 0.00 0.06 0.00 0.00 34.95 30.96 3ga6 s ARG 2065CO 0.79 -1.25 1.34 1.17 -2.50 0.00 0.00 175.30 174.85 3ga6 n LYS 2066N 7.60 1.92 -2.21 5.12 4.81 -1.26 -2.74 118.16 131.41 3ga6 n LYS 2066Ca 0.19 0.68 -0.18 0.00 -0.87 0.00 0.00 58.31 58.13 3ga6 n LYS 2066Cb 0.45 -2.29 -0.02 0.00 0.02 0.00 0.00 35.03 33.19 3ga6 n LYS 2066CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ga6 n GLY 2067N 1.84 -0.04 3.03 3.14 0.00 -1.26 -4.99 105.19 106.91 3ga6 n GLY 2067Ca 0.11 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 3ga6 n GLY 2067CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3ga6 s TYR 2068N -2.84 1.04 0.00 1.61 5.04 -1.11 -4.77 117.35 116.32 3ga6 s TYR 2068Ca 0.00 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.39 3ga6 s TYR 2068Cb 0.00 -0.71 0.00 0.00 0.35 0.00 0.00 41.96 41.60 3ga6 s TYR 2068CO 0.00 -0.07 0.00 0.45 -1.34 0.00 0.00 175.55 174.59 3ga6 n SER 2069N 3.10 0.00 0.00 4.32 2.88 -1.26 -4.06 113.62 118.60 3ga6 n SER 2069Ca -0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 3ga6 n SER 2069Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 3ga6 n SER 2069CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ga6 n GLY 2070N 0.00 -0.85 3.42 0.46 0.00 -0.93 0.06 105.19 107.35 3ga6 n GLY 2070Ca 0.00 -1.32 -0.21 0.00 0.00 0.00 0.00 46.02 44.49 3ga6 n GLY 2070CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ga6 s VAL 2071N -1.47 1.89 0.01 1.61 -7.23 -0.58 0.18 120.40 114.81 3ga6 s VAL 2071Ca 0.00 -2.21 -0.13 0.00 -1.81 0.00 0.00 61.98 57.83 3ga6 s VAL 2071Cb 0.00 -2.32 0.02 0.00 0.56 0.00 0.00 36.38 34.64 3ga6 s VAL 2071CO 0.00 -0.40 0.27 0.00 -0.31 0.00 0.00 175.10 174.66 3ga6 s ALA 2072N -2.87 -0.62 -0.02 1.32 0.00 -0.97 -0.82 121.76 117.78 3ga6 s ALA 2072Ca 0.28 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.32 3ga6 s ALA 2072Cb 0.01 0.18 0.03 0.00 0.00 0.00 0.00 23.12 23.33 3ga6 s ALA 2072CO 0.11 -0.31 0.02 1.41 0.00 0.00 0.00 175.76 177.00 3ga6 s MET 2073N -1.86 0.07 -0.11 0.00 1.75 0.64 -0.43 119.30 119.36 3ga6 s MET 2073Ca -0.10 0.15 0.00 0.00 -1.25 0.00 0.00 55.69 54.50 3ga6 s MET 2073Cb -0.04 -0.33 -0.02 0.00 2.84 0.00 0.00 34.83 37.29 3ga6 s MET 2073CO 0.01 -0.16 -0.12 0.71 -0.65 0.00 0.00 175.02 174.81 3ga6 s TYR 2074N 1.07 2.82 -0.09 4.11 1.51 0.48 0.12 117.35 127.37 3ga6 s TYR 2074Ca -0.09 -0.41 -0.06 0.00 -1.01 0.00 0.00 57.07 55.49 3ga6 s TYR 2074Cb -0.13 -1.79 0.03 0.00 -0.11 0.00 0.00 41.96 39.96 3ga6 s TYR 2074CO -0.03 -0.04 0.22 -0.08 -1.11 0.00 0.00 175.55 174.52 3ga6 s THR 2075N -0.03 -0.02 0.12 -0.71 -1.32 0.96 -0.68 115.64 113.96 3ga6 s THR 2075Ca -0.02 0.07 -0.16 0.00 -1.21 0.00 0.00 61.69 60.37 3ga6 s THR 2075Cb -0.14 -0.33 -0.03 0.00 -1.51 0.00 0.00 72.50 70.49 3ga6 s THR 2075CO 0.04 0.03 1.59 0.11 -2.21 0.00 0.00 174.62 174.17 3ga6 h LYS 2076N 6.45 0.61 -5.49 7.08 1.57 -1.58 0.38 116.57 125.59 3ga6 h LYS 2076Ca -0.33 -0.17 -0.64 0.00 -1.87 0.00 0.00 60.65 57.64 3ga6 h LYS 2076Cb 1.18 -0.07 -0.11 0.00 0.08 0.00 0.00 32.23 33.31 3ga6 h LYS 2076CO 0.38 0.69 -0.51 0.08 -0.57 0.00 0.00 179.45 179.52 3ga6 s VAL 2077N -5.14 5.28 0.35 0.50 1.01 -1.26 -4.60 120.40 116.54 3ga6 s VAL 2077Ca -0.13 0.13 -0.25 0.00 0.00 0.00 0.00 61.98 61.73 3ga6 s VAL 2077Cb 0.09 -3.34 -0.10 0.00 0.00 0.00 0.00 36.38 33.03 3ga6 s VAL 2077CO 0.77 0.53 0.98 -2.84 0.00 0.00 0.00 175.10 174.55 3ga6 s PRO 2078N -0.33 4.43 0.78 2.72 0.02 -1.26 -4.96 135.00 136.39 3ga6 s PRO 2078Ca 0.11 1.38 -0.11 0.00 0.02 0.00 0.00 61.00 62.41 3ga6 s PRO 2078Cb -0.12 -2.69 0.06 0.00 0.02 0.00 0.00 34.50 31.78 3ga6 s PRO 2078CO 0.01 0.13 1.09 -2.14 -0.33 0.00 0.00 177.00 175.76 3ga6 s PRO 2079N -2.25 2.22 0.23 5.54 0.02 -1.26 -4.95 135.00 134.55 3ga6 s PRO 2079Ca 0.53 1.09 -0.01 0.00 0.02 0.00 0.00 61.00 62.63 3ga6 s PRO 2079Cb -0.19 -1.90 0.25 0.00 0.02 0.00 0.00 34.50 32.68 3ga6 s PRO 2079CO 0.25 -1.64 1.63 0.66 -0.33 0.00 0.00 177.00 177.56 3ga6 h SER 2080N -1.13 0.61 -5.31 2.53 4.64 -0.91 -3.47 113.55 110.52 3ga6 h SER 2080Ca -0.44 -0.24 -0.11 0.00 -0.47 0.00 0.00 61.79 60.53 3ga6 h SER 2080Cb 1.24 -0.17 -0.09 0.00 -0.31 0.00 0.00 62.40 63.07 3ga6 h SER 2080CO 0.53 0.90 -0.16 -0.94 -0.87 0.00 0.00 176.83 176.28 3ga6 s SER 2081N -6.82 0.09 -0.16 4.97 1.04 -1.25 -5.01 113.70 106.55 3ga6 s SER 2081Ca -0.08 -1.07 -0.07 0.00 0.48 0.00 0.00 55.95 55.22 3ga6 s SER 2081Cb 0.13 0.59 0.07 0.00 0.10 0.00 0.00 66.02 66.91 3ga6 s SER 2081CO 0.82 -1.16 0.35 -0.22 0.98 0.00 0.00 173.24 174.01 3ga6 s LEU 2082N -3.07 -0.33 -0.05 2.42 1.98 -1.26 -1.86 118.68 116.50 3ga6 s LEU 2082Ca 0.25 0.81 -0.01 0.00 -2.89 0.00 0.00 54.13 52.29 3ga6 s LEU 2082Cb -0.00 1.10 -0.03 0.00 0.66 0.00 0.00 46.19 47.91 3ga6 s LEU 2082CO 0.11 -0.22 0.02 -0.60 -1.89 0.00 0.00 176.35 173.77 3ga6 s ARG 2083N 2.19 2.96 -0.17 1.98 3.52 -0.02 -4.93 118.95 124.48 3ga6 s ARG 2083Ca -0.03 -0.46 0.16 0.00 -0.13 0.00 0.00 55.73 55.28 3ga6 s ARG 2083Cb -0.11 -2.79 0.42 0.00 -1.56 0.00 0.00 34.95 30.91 3ga6 s ARG 2083CO -0.11 0.68 1.30 0.39 -0.81 0.00 0.00 175.30 176.75 3ga6 n GLU 2084N 1.81 2.05 -3.61 5.12 1.02 -1.26 -0.18 120.64 125.59 3ga6 n GLU 2084Ca -0.17 -2.81 -0.04 0.00 -0.02 0.00 0.00 57.16 54.13 3ga6 n GLU 2084Cb 0.53 -1.69 -0.02 0.00 -0.02 0.00 0.00 31.44 30.25 3ga6 n GLU 2084CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3ga6 s GLY 2085N -2.47 -0.36 0.00 0.62 0.00 -1.26 -4.60 107.32 99.25 3ga6 s GLY 2085Ca 0.38 0.94 0.29 0.00 0.00 0.00 0.00 44.72 46.32 3ga6 s GLY 2085CO 0.04 0.28 1.85 0.69 0.00 0.00 0.00 173.10 175.97 3ga6 n PHE 2086N -0.30 0.00 -0.69 1.90 3.72 -1.26 -4.92 117.46 115.92 3ga6 n PHE 2086Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 3ga6 n PHE 2086Cb 0.61 -0.35 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 3ga6 n PHE 2086CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ga6 n GLY 2087N 1.41 0.83 3.02 1.37 0.00 -1.26 -5.03 105.19 105.53 3ga6 n GLY 2087Ca 0.10 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 3ga6 n GLY 2087CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ga6 s VAL 2088N -2.00 1.58 0.14 1.61 1.01 -1.26 -5.05 120.40 116.42 3ga6 s VAL 2088Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.06 3ga6 s VAL 2088Cb 0.00 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 3ga6 s VAL 2088CO 0.00 0.44 1.59 -0.33 0.00 0.00 0.00 175.10 176.81 3ga6 h GLU 2089N 8.05 -0.38 0.00 2.72 5.08 -1.99 -2.51 114.58 125.56 3ga6 h GLU 2089Ca -0.38 0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 57.97 3ga6 h GLU 2089Cb 1.13 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 3ga6 h GLU 2089CO 0.53 -0.25 -0.19 0.07 -1.00 0.00 0.00 179.01 178.16 3ga6 h ARG 2090N -0.39 0.00 0.00 2.33 0.11 -2.01 -2.29 114.38 112.13 3ga6 h ARG 2090Ca 0.11 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.19 3ga6 h ARG 2090Cb 0.58 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.66 3ga6 h ARG 2090CO -0.44 0.19 -0.57 1.19 0.10 0.00 0.00 179.97 180.44 3ga6 n PHE 2091N -3.66 0.50 0.96 4.08 0.99 -1.00 -4.29 117.46 115.04 3ga6 n PHE 2091Ca -0.01 0.15 0.10 0.00 -0.00 0.00 0.00 57.45 57.69 3ga6 n PHE 2091Cb 0.32 -0.62 -0.05 0.00 -1.00 0.00 0.00 39.48 38.12 3ga6 n PHE 2091CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 3ga6 n ASP 2092N -2.04 0.87 -0.76 4.37 8.00 -0.87 -4.34 116.55 121.78 3ga6 n ASP 2092Ca 0.04 -0.82 0.07 0.00 0.71 0.00 0.00 54.79 54.78 3ga6 n ASP 2092Cb 0.43 0.90 0.18 0.00 -0.02 0.00 0.00 41.12 42.60 3ga6 n ASP 2092CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3ga6 n THR 2093N -1.54 0.98 -0.14 -3.53 -2.24 -1.21 -4.33 114.28 102.27 3ga6 n THR 2093Ca 0.04 -0.99 0.12 0.00 -2.27 0.00 0.00 64.05 60.95 3ga6 n THR 2093Cb 0.34 0.52 0.28 0.00 -2.10 0.00 0.00 70.33 69.37 3ga6 n THR 2093CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ga6 n GLU 2094N 0.71 2.65 -3.37 -0.78 1.02 -1.26 -1.51 120.64 118.11 3ga6 n GLU 2094Ca 0.14 -2.52 -0.16 0.00 -0.02 0.00 0.00 57.16 54.60 3ga6 n GLU 2094Cb 0.46 -1.54 0.09 0.00 -0.02 0.00 0.00 31.44 30.43 3ga6 n GLU 2094CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ga6 n GLY 2095N 1.55 -0.34 0.00 0.62 0.00 -1.24 -3.68 105.19 102.11 3ga6 n GLY 2095Ca 0.22 0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.37 3ga6 n GLY 2095CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ga6 n ARG 2096N -3.99 4.28 -3.91 1.61 1.74 -1.26 -1.97 116.66 113.16 3ga6 n ARG 2096Ca -0.27 -0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.57 3ga6 n ARG 2096Cb 0.66 -0.89 -0.17 0.00 -1.02 0.00 0.00 32.46 31.04 3ga6 n ARG 2096CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ga6 s ILE 2097N -1.77 0.61 -0.06 0.55 1.01 -1.26 -0.94 121.20 119.34 3ga6 s ILE 2097Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.63 3ga6 s ILE 2097Cb 0.06 -0.69 0.02 0.00 0.01 0.00 0.00 42.46 41.86 3ga6 s ILE 2097CO 0.33 0.29 -0.04 -1.10 0.00 0.00 0.00 174.94 174.42 3ga6 s GLN 2098N 1.65 0.87 -0.34 2.79 -0.21 -0.86 -4.32 119.66 119.25 3ga6 s GLN 2098Ca 0.01 -0.08 0.02 0.00 0.02 0.00 0.00 55.36 55.33 3ga6 s GLN 2098Cb -0.13 -0.95 0.10 0.00 1.00 0.00 0.00 33.01 33.04 3ga6 s GLN 2098CO -0.05 -0.14 0.08 0.42 -2.12 0.00 0.00 175.29 173.49 3ga6 s ILE 2099N 1.19 1.69 -0.12 1.08 1.01 0.75 -0.58 121.20 126.22 3ga6 s ILE 2099Ca -0.07 -1.99 -0.05 0.00 0.00 0.00 0.00 60.65 58.54 3ga6 s ILE 2099Cb -0.14 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 3ga6 s ILE 2099CO -0.01 -0.64 0.06 0.00 0.00 0.00 0.00 174.94 174.34 3ga6 s ALA 2100N 1.15 3.51 -0.44 9.38 0.00 0.02 -0.84 121.76 134.53 3ga6 s ALA 2100Ca 0.11 -0.74 -0.12 0.00 0.00 0.00 0.00 51.96 51.21 3ga6 s ALA 2100Cb -0.19 -1.74 0.07 0.00 0.00 0.00 0.00 23.12 21.26 3ga6 s ALA 2100CO -0.15 0.50 0.31 0.34 0.00 0.00 0.00 175.76 176.77 3ga6 s ASP 2101N -0.63 5.87 -0.29 0.00 -1.08 -0.78 0.19 116.67 119.95 3ga6 s ASP 2101Ca 0.11 -1.37 0.12 0.00 -0.52 0.00 0.00 52.55 50.89 3ga6 s ASP 2101Cb -0.12 -2.08 0.79 0.00 -1.46 0.00 0.00 42.92 40.06 3ga6 s ASP 2101CO 0.02 -0.57 1.79 0.49 0.52 0.00 0.00 175.17 177.43 3ga6 n PHE 2102N 5.05 2.31 0.00 -5.34 3.01 0.01 -0.13 117.46 122.37 3ga6 n PHE 2102Ca -0.11 -0.98 0.00 0.00 1.01 0.00 0.00 57.45 57.36 3ga6 n PHE 2102Cb 0.44 -0.61 0.00 0.00 -0.01 0.00 0.00 39.48 39.29 3ga6 n PHE 2102CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3ga6 n ASP 2103N 0.22 0.00 0.00 4.37 4.64 -1.26 -4.17 116.55 120.34 3ga6 n ASP 2103Ca 0.35 0.00 0.07 0.00 -1.38 0.00 0.00 54.79 53.83 3ga6 n ASP 2103Cb 1.31 0.00 0.39 0.00 -1.04 0.00 0.00 41.12 41.78 3ga6 n ASP 2103CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 3ga6 n ASP 2104N 1.96 0.00 0.00 1.67 9.92 -1.26 -4.82 116.55 124.02 3ga6 n ASP 2104Ca 0.00 -0.68 0.00 0.00 -0.53 0.00 0.00 54.79 53.58 3ga6 n ASP 2104Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 3ga6 n ASP 2104CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 3ga6 n PHE 2105N -0.88 0.00 -3.86 1.24 -1.74 -1.26 -4.70 117.46 106.26 3ga6 n PHE 2105Ca 0.10 0.00 -0.36 0.00 -0.56 0.00 0.00 57.45 56.63 3ga6 n PHE 2105Cb 0.05 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 40.99 3ga6 n PHE 2105CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 3ga6 s LEU 2106N 0.00 4.39 -0.29 5.98 1.43 -0.31 -0.81 118.68 129.07 3ga6 s LEU 2106Ca 0.00 0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 53.53 3ga6 s LEU 2106Cb 0.00 -2.22 0.03 0.00 0.03 0.00 0.00 46.19 44.03 3ga6 s LEU 2106CO 0.00 0.37 0.01 -0.22 0.23 0.00 0.00 176.35 176.74 3ga6 s LEU 2107N -1.24 3.74 -0.46 1.79 2.96 0.13 -1.15 118.68 124.44 3ga6 s LEU 2107Ca 0.18 -1.01 -0.23 0.00 -0.22 0.00 0.00 54.13 52.85 3ga6 s LEU 2107Cb -0.12 -1.76 0.03 0.00 0.50 0.00 0.00 46.19 44.84 3ga6 s LEU 2107CO 0.08 -0.22 0.77 -0.31 -1.32 0.00 0.00 176.35 175.35 3ga6 s TYR 2108N 1.35 2.99 -0.46 5.38 1.51 -0.17 -0.80 117.35 127.14 3ga6 s TYR 2108Ca -0.01 0.07 -0.15 0.00 -1.01 0.00 0.00 57.07 55.97 3ga6 s TYR 2108Cb -0.18 -3.65 0.07 0.00 -0.11 0.00 0.00 41.96 38.09 3ga6 s TYR 2108CO -0.01 -1.01 0.37 1.21 -1.11 0.00 0.00 175.55 175.01 3ga6 s ASN 2109N 2.21 6.07 -0.03 2.29 2.47 0.25 -1.05 114.94 127.15 3ga6 s ASN 2109Ca 0.28 -1.35 0.06 0.00 0.42 0.00 0.00 52.86 52.27 3ga6 s ASN 2109Cb -0.13 -2.15 -0.01 0.00 -1.45 0.00 0.00 41.25 37.50 3ga6 s ASN 2109CO 0.21 -0.63 -0.22 -0.63 -3.72 0.00 0.00 177.10 172.11 3ga6 s ILE 2110N 1.61 1.74 -0.68 -5.21 -1.09 0.19 -2.03 121.20 115.74 3ga6 s ILE 2110Ca 0.04 -0.93 -0.06 0.00 -2.23 0.00 0.00 60.65 57.47 3ga6 s ILE 2110Cb -0.24 -1.46 0.18 0.00 -1.58 0.00 0.00 42.46 39.36 3ga6 s ILE 2110CO 0.06 0.49 0.53 -0.47 -1.23 0.00 0.00 174.94 174.32 3ga6 s TYR 2111N -0.41 3.49 0.44 3.97 5.04 -0.11 -2.25 117.35 127.53 3ga6 s TYR 2111Ca 0.05 -2.54 -0.24 0.00 -2.44 0.00 0.00 57.07 51.90 3ga6 s TYR 2111Cb -0.10 -3.35 -0.08 0.00 0.35 0.00 0.00 41.96 38.78 3ga6 s TYR 2111CO 0.00 -0.87 1.24 -0.06 -1.34 0.00 0.00 175.55 174.51 3ga6 s PHE 2112N -0.04 2.81 0.62 4.97 0.40 -0.11 -4.78 117.98 121.85 3ga6 s PHE 2112Ca 0.17 1.48 -0.16 0.00 -0.60 0.00 0.00 56.93 57.82 3ga6 s PHE 2112Cb -0.18 -3.53 -0.02 0.00 0.51 0.00 0.00 43.02 39.80 3ga6 s PHE 2112CO -0.05 -1.84 1.11 -2.14 0.70 0.00 0.00 175.22 172.99 3ga6 s PRO 2113N -2.51 3.02 -0.21 0.24 0.02 -1.26 -4.68 135.00 129.62 3ga6 s PRO 2113Ca 0.61 1.42 -0.15 0.00 0.02 0.00 0.00 61.00 62.90 3ga6 s PRO 2113Cb -0.34 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.17 3ga6 s PRO 2113CO 0.42 -1.08 0.37 1.21 -0.33 0.00 0.00 177.00 177.59 3ga6 s ASN 2114N -2.40 6.38 -0.28 2.53 2.47 -1.26 -4.82 114.94 117.57 3ga6 s ASN 2114Ca 0.68 0.44 0.12 0.00 0.42 0.00 0.00 52.86 54.52 3ga6 s ASN 2114Cb -0.21 -2.21 0.71 0.00 -1.45 0.00 0.00 41.25 38.09 3ga6 s ASN 2114CO 0.37 -0.07 1.70 0.61 -3.72 0.00 0.00 177.10 175.99 3ga6 n GLY 2115N 4.05 3.69 0.07 1.21 0.00 -1.26 -4.58 105.19 108.37 3ga6 n GLY 2115Ca -0.09 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.77 3ga6 n GLY 2115CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ga6 h LYS 2116N 2.68 0.03 -0.44 1.61 1.57 -1.89 -3.29 116.57 116.85 3ga6 h LYS 2116Ca 0.15 -0.05 0.13 0.00 -1.87 0.00 0.00 60.65 59.01 3ga6 h LYS 2116Cb 2.04 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 34.35 3ga6 h LYS 2116CO 0.56 0.95 0.45 0.00 -0.57 0.00 0.00 179.45 180.84 3ga6 h MET 2117N -0.86 0.00 -2.67 3.15 -0.00 -1.97 -3.43 114.93 109.15 3ga6 h MET 2117Ca -0.01 0.00 0.07 0.00 -0.00 0.00 0.00 59.70 59.76 3ga6 h MET 2117Cb 0.98 0.00 -0.11 0.00 -0.00 0.00 0.00 31.60 32.47 3ga6 h MET 2117CO 0.01 0.00 0.35 -1.54 -0.00 0.00 0.00 176.91 175.73 3ga6 s SER 2118N -5.33 -0.38 0.32 -0.10 1.04 -1.26 -5.01 113.70 102.98 3ga6 s SER 2118Ca -0.04 -0.18 0.13 0.00 0.48 0.00 0.00 55.95 56.33 3ga6 s SER 2118Cb 0.16 0.54 0.53 0.00 0.10 0.00 0.00 66.02 67.35 3ga6 s SER 2118CO 0.56 -0.92 1.70 -0.33 0.98 0.00 0.00 173.24 175.23 3ga6 h GLU 2119N 2.00 0.00 0.00 4.02 5.08 -1.84 -2.08 114.58 121.76 3ga6 h GLU 2119Ca -0.26 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.05 3ga6 h GLU 2119Cb 1.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 3ga6 h GLU 2119CO 0.31 0.50 -0.25 1.05 -1.00 0.00 0.00 179.01 179.62 3ga6 h GLU 2120N 0.00 0.00 0.00 2.33 -0.00 -1.95 -1.34 114.58 113.62 3ga6 h GLU 2120Ca -0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 59.36 59.21 3ga6 h GLU 2120Cb 0.92 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.65 3ga6 h GLU 2120CO 0.06 0.25 -0.82 0.00 -0.00 0.00 0.00 179.01 178.50 3ga6 h ARG 2121N 0.00 0.00 -0.48 1.06 2.47 -1.81 -2.67 114.38 112.95 3ga6 h ARG 2121Ca -0.00 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.58 3ga6 h ARG 2121Cb 0.76 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.07 3ga6 h ARG 2121CO 0.03 0.54 -0.23 1.25 0.56 0.00 0.00 179.97 182.13 3ga6 h LEU 2122N 0.00 1.03 -0.67 3.04 5.85 -0.83 -1.29 115.31 122.44 3ga6 h LEU 2122Ca -0.05 -0.40 -0.13 0.00 0.84 0.00 0.00 57.88 58.14 3ga6 h LEU 2122Cb 1.51 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 3ga6 h LEU 2122CO 0.07 1.20 -0.39 0.50 -0.34 0.00 0.00 178.44 179.48 3ga6 h LYS 2123N 0.86 0.58 0.41 1.25 1.63 -1.31 -2.49 116.57 117.50 3ga6 h LYS 2123Ca 0.11 -0.29 -0.01 0.00 -0.85 0.00 0.00 60.65 59.61 3ga6 h LYS 2123Cb 0.81 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.42 3ga6 h LYS 2123CO 0.07 0.88 -0.37 -0.92 -3.45 0.00 0.00 179.45 175.66 3ga6 h TYR 2124N 0.48 -1.00 -0.64 1.91 3.20 -1.34 -0.61 116.97 118.97 3ga6 h TYR 2124Ca 0.04 0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.04 3ga6 h TYR 2124Cb 0.90 0.38 -0.09 0.00 1.54 0.00 0.00 36.73 39.46 3ga6 h TYR 2124CO 0.04 -0.53 0.14 -0.22 -1.64 0.00 0.00 178.16 175.96 3ga6 h LYS 2125N -0.79 0.26 -0.39 1.82 3.64 -1.21 0.47 116.57 120.37 3ga6 h LYS 2125Ca -0.04 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.21 3ga6 h LYS 2125Cb 0.70 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 3ga6 h LYS 2125CO -0.04 0.17 -0.23 -0.07 -2.27 0.00 0.00 179.45 177.02 3ga6 h LEU 2126N 0.27 0.78 -0.39 5.20 3.38 -1.34 -0.73 115.31 122.49 3ga6 h LEU 2126Ca 0.34 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.87 3ga6 h LEU 2126Cb 0.52 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3ga6 h LEU 2126CO -0.43 0.99 -0.75 -0.33 0.09 0.00 0.00 178.44 178.01 3ga6 h GLU 2127N 0.67 0.00 -0.14 1.13 5.08 -0.60 -2.05 114.58 118.67 3ga6 h GLU 2127Ca 0.09 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 3ga6 h GLU 2127Cb 0.74 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 3ga6 h GLU 2127CO 0.06 0.75 0.05 0.35 -1.00 0.00 0.00 179.01 179.22 3ga6 h PHE 2128N 0.00 0.09 -0.43 4.33 3.57 0.16 -0.45 116.94 124.22 3ga6 h PHE 2128Ca -0.01 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.58 3ga6 h PHE 2128Cb 1.39 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 40.03 3ga6 h PHE 2128CO 0.00 0.05 -0.07 1.88 -2.23 0.00 0.00 178.31 177.94 3ga6 h TYR 2129N 0.12 -0.15 -0.38 0.41 0.99 -0.97 0.20 116.97 117.19 3ga6 h TYR 2129Ca 0.06 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.81 3ga6 h TYR 2129Cb 0.03 0.13 -0.02 0.00 1.00 0.00 0.00 36.73 37.88 3ga6 h TYR 2129CO -0.11 -0.15 0.19 -0.44 -0.00 0.00 0.00 178.16 177.66 3ga6 h ASP 2130N 0.04 0.49 -0.84 3.88 3.32 -1.10 0.92 116.42 123.13 3ga6 h ASP 2130Ca 0.21 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3ga6 h ASP 2130Cb 0.32 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 3ga6 h ASP 2130CO -0.41 0.46 0.52 0.00 -1.72 0.00 0.00 179.24 178.09 3ga6 h ALA 2131N 1.05 1.06 0.21 3.45 0.00 -0.78 -2.19 119.26 122.06 3ga6 h ALA 2131Ca 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3ga6 h ALA 2131Cb 0.09 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3ga6 h ALA 2131CO -0.02 0.51 -0.12 0.35 0.00 0.00 0.00 179.25 179.97 3ga6 h PHE 2132N 1.14 -0.32 -0.51 0.00 3.57 -0.13 -2.62 116.94 118.07 3ga6 h PHE 2132Ca 0.30 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.81 3ga6 h PHE 2132Cb -0.06 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 3ga6 h PHE 2132CO -0.01 -0.20 0.33 1.25 -2.23 0.00 0.00 178.31 177.46 3ga6 h LEU 2133N -0.32 0.56 -1.71 0.59 7.12 -0.69 -1.21 115.31 119.65 3ga6 h LEU 2133Ca -0.02 -0.01 0.01 0.00 0.13 0.00 0.00 57.88 57.99 3ga6 h LEU 2133Cb 0.26 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 40.24 3ga6 h LEU 2133CO 0.02 0.40 0.22 -0.33 -0.13 0.00 0.00 178.44 178.62 3ga6 h GLU 2134N 0.67 0.38 0.09 1.25 5.08 -1.35 -0.71 114.58 119.99 3ga6 h GLU 2134Ca 0.19 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.35 3ga6 h GLU 2134Cb -0.05 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 29.14 3ga6 h GLU 2134CO -0.06 0.25 -0.76 0.22 -1.00 0.00 0.00 179.01 177.67 3ga6 h ASP 2135N 0.40 0.52 -0.03 1.42 3.58 -0.98 -2.35 116.42 118.98 3ga6 h ASP 2135Ca 0.13 -0.87 -0.11 0.00 0.42 0.00 0.00 57.03 56.60 3ga6 h ASP 2135Cb 0.02 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 40.90 3ga6 h ASP 2135CO -0.03 1.34 -0.32 1.62 -2.88 0.00 0.00 179.24 178.97 3ga6 h VAL 2136N -0.23 1.28 -0.10 2.25 3.04 -0.94 -2.41 116.25 119.14 3ga6 h VAL 2136Ca -0.12 -1.40 -0.01 0.00 -1.01 0.00 0.00 66.70 64.15 3ga6 h VAL 2136Cb 1.53 1.45 -0.00 0.00 -2.01 0.00 0.00 31.29 32.26 3ga6 h VAL 2136CO 0.15 0.44 0.02 0.78 -1.01 0.00 0.00 177.57 177.94 3ga6 h ASN 2137N 0.42 0.16 -0.31 3.17 4.21 -1.20 -0.15 115.58 121.90 3ga6 h ASN 2137Ca 0.05 -0.26 0.07 0.00 1.21 0.00 0.00 56.30 57.37 3ga6 h ASN 2137Cb 0.77 -0.04 -0.08 0.00 -1.12 0.00 0.00 38.32 37.84 3ga6 h ASN 2137CO 0.06 0.39 -0.28 -0.09 -1.29 0.00 0.00 177.43 176.22 3ga6 h ARG 2138N -0.06 -0.25 0.55 0.81 2.43 -1.26 0.39 114.38 116.98 3ga6 h ARG 2138Ca 0.03 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 3ga6 h ARG 2138Cb 0.29 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 3ga6 h ARG 2138CO 0.00 -0.17 -0.45 0.93 -1.51 0.00 0.00 179.97 178.77 3ga6 h GLU 2139N -0.26 -0.95 -0.45 0.20 4.39 -1.38 -2.13 114.58 114.00 3ga6 h GLU 2139Ca 0.15 0.06 0.07 0.00 0.34 0.00 0.00 59.36 59.99 3ga6 h GLU 2139Cb 0.50 0.22 -0.09 0.00 -0.10 0.00 0.00 28.75 29.28 3ga6 h GLU 2139CO -0.46 -0.63 -0.45 -0.09 -1.16 0.00 0.00 179.01 176.22 3ga6 h ARG 2140N -0.98 -0.30 -1.03 2.33 1.12 -0.68 0.08 114.38 114.91 3ga6 h ARG 2140Ca -0.06 0.02 0.27 0.00 -1.11 0.00 0.00 59.98 59.10 3ga6 h ARG 2140Cb 0.84 0.07 -0.08 0.00 -0.01 0.00 0.00 29.97 30.78 3ga6 h ARG 2140CO -0.01 -0.20 0.69 -0.44 -3.11 0.00 0.00 179.97 176.90 3ga6 h ASP 2141N -0.31 0.34 0.78 -3.80 3.32 -0.21 0.16 116.42 116.71 3ga6 h ASP 2141Ca 0.14 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.25 3ga6 h ASP 2141Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 3ga6 h ASP 2141CO -0.61 0.08 0.00 -1.54 -1.72 0.00 0.00 179.24 175.45 3ga6 n SER 2142N -4.52 0.00 0.00 6.45 3.41 -0.01 -4.89 113.62 114.07 3ga6 n SER 2142Ca 0.24 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 3ga6 n SER 2142Cb 0.92 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 3ga6 n SER 2142CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ga6 n GLY 2143N 0.98 1.02 3.72 5.00 0.00 0.57 -5.09 105.19 111.39 3ga6 n GLY 2143Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3ga6 n GLY 2143CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ga6 s ARG 2144N -0.18 4.64 0.55 1.61 1.81 -1.15 -5.01 118.95 121.23 3ga6 s ARG 2144Ca 0.00 1.41 -0.17 0.00 -1.72 0.00 0.00 55.73 55.25 3ga6 s ARG 2144Cb 0.00 -3.40 -0.06 0.00 -0.45 0.00 0.00 34.95 31.04 3ga6 s ARG 2144CO 0.00 0.14 1.03 -0.80 -0.68 0.00 0.00 175.30 174.99 3ga6 s ASN 2145N 0.31 6.12 -0.12 0.23 0.01 -1.26 -4.16 114.94 116.08 3ga6 s ASN 2145Ca 0.48 1.77 -0.10 0.00 -0.71 0.00 0.00 52.86 54.29 3ga6 s ASN 2145Cb -0.22 -2.53 0.03 0.00 0.41 0.00 0.00 41.25 38.94 3ga6 s ASN 2145CO 0.29 -0.93 0.30 0.54 -1.51 0.00 0.00 177.10 175.79 3ga6 s VAL 2146N -2.42 -0.00 0.00 1.60 0.11 -1.26 -1.16 120.40 117.27 3ga6 s VAL 2146Ca 0.63 0.02 0.07 0.00 -2.93 0.00 0.00 61.98 59.77 3ga6 s VAL 2146Cb -0.14 -0.43 -0.03 0.00 -1.53 0.00 0.00 36.38 34.25 3ga6 s VAL 2146CO 0.32 0.01 -0.22 -0.63 -3.33 0.00 0.00 175.10 171.25 3ga6 s ILE 2147N 0.31 2.43 -0.07 7.04 1.01 -0.30 -2.68 121.20 128.94 3ga6 s ILE 2147Ca -0.01 -1.11 0.01 0.00 0.00 0.00 0.00 60.65 59.54 3ga6 s ILE 2147Cb -0.03 -1.93 0.02 0.00 0.01 0.00 0.00 42.46 40.53 3ga6 s ILE 2147CO -0.01 0.48 -0.09 -0.63 0.00 0.00 0.00 174.94 174.69 3ga6 s ILE 2148N -0.75 0.91 0.16 2.92 1.09 -0.13 -1.00 121.20 124.39 3ga6 s ILE 2148Ca 0.12 -0.32 0.02 0.00 -1.10 0.00 0.00 60.65 59.37 3ga6 s ILE 2148Cb -0.10 -0.88 -0.05 0.00 -1.06 0.00 0.00 42.46 40.38 3ga6 s ILE 2148CO 0.01 0.31 -0.03 0.00 -0.10 0.00 0.00 174.94 175.14 3ga6 n GLY 2150N -0.22 0.96 3.49 0.00 0.00 -1.18 -0.64 105.19 107.61 3ga6 n GLY 2150Ca -0.08 -1.90 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 3ga6 n GLY 2150CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3ga6 s ASN 2151N -4.00 6.30 0.44 1.61 3.84 -0.95 -2.58 114.94 119.60 3ga6 s ASN 2151Ca 0.00 -0.56 0.24 0.00 0.21 0.00 0.00 52.86 52.75 3ga6 s ASN 2151Cb 0.00 -2.39 0.50 0.00 -0.55 0.00 0.00 41.25 38.82 3ga6 s ASN 2151CO 0.00 -1.12 1.66 -0.26 -2.79 0.00 0.00 177.10 174.59 3ga6 h PHE 2152N 9.21 0.00 -0.24 0.43 -1.00 -0.86 -0.26 116.94 124.22 3ga6 h PHE 2152Ca -0.27 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.41 3ga6 h PHE 2152Cb 1.08 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.60 3ga6 h PHE 2152CO 0.86 0.06 -0.09 0.09 -1.61 0.00 0.00 178.31 177.61 3ga6 n ASN 2153N -3.12 -4.88 -3.91 2.17 3.02 -1.17 -4.82 115.26 102.55 3ga6 n ASN 2153Ca 0.03 0.13 -0.16 0.00 -0.03 0.00 0.00 54.58 54.55 3ga6 n ASN 2153Cb 0.51 -2.83 -0.15 0.00 -0.61 0.00 0.00 39.78 36.70 3ga6 n ASN 2153CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3ga6 s THR 2154N -1.77 0.32 -0.07 3.41 2.01 -1.26 -3.93 115.64 114.34 3ga6 s THR 2154Ca 0.00 -0.13 -0.21 0.00 0.31 0.00 0.00 61.69 61.66 3ga6 s THR 2154Cb 0.00 -0.30 -0.04 0.00 0.01 0.00 0.00 72.50 72.17 3ga6 s THR 2154CO 0.00 0.11 0.60 0.00 -0.69 0.00 0.00 174.62 174.65 3ga6 s ALA 2155N 0.19 3.41 -0.02 7.40 0.00 0.18 -4.46 121.76 128.47 3ga6 s ALA 2155Ca -0.02 0.01 -0.03 0.00 0.00 0.00 0.00 51.96 51.92 3ga6 s ALA 2155Cb -0.05 -2.81 -0.02 0.00 0.00 0.00 0.00 23.12 20.24 3ga6 s ALA 2155CO -0.00 -0.01 0.29 1.25 0.00 0.00 0.00 175.76 177.29 3ga6 h HIS 2156N 6.50 -0.11 -0.64 0.00 2.76 -1.87 -3.43 115.15 118.36 3ga6 h HIS 2156Ca -0.42 -0.00 -0.56 0.00 -2.20 0.00 0.00 60.37 57.19 3ga6 h HIS 2156Cb 1.19 0.04 -0.03 0.00 1.55 0.00 0.00 27.41 30.16 3ga6 h HIS 2156CO 0.64 -0.07 -0.26 1.03 -1.30 0.00 0.00 177.93 177.97 3ga6 s ARG 2157N -1.90 2.27 0.31 5.26 0.52 -1.26 -4.75 118.95 119.40 3ga6 s ARG 2157Ca -0.02 -1.92 0.01 0.00 -0.52 0.00 0.00 55.73 53.28 3ga6 s ARG 2157Cb 0.00 -2.23 0.51 0.00 0.52 0.00 0.00 34.95 33.76 3ga6 s ARG 2157CO 0.05 -0.66 1.86 0.93 0.02 0.00 0.00 175.30 177.51 3ga6 h GLU 2158N 0.63 0.70 0.00 3.54 5.08 -1.93 -2.58 114.58 120.02 3ga6 h GLU 2158Ca -0.35 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 3ga6 h GLU 2158Cb 1.30 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3ga6 h GLU 2158CO 0.54 0.64 0.00 1.51 -1.00 0.00 0.00 179.01 180.70 3ga6 n ILE 2159N -4.29 1.63 1.18 3.13 3.06 -1.26 -2.56 119.36 120.24 3ga6 n ILE 2159Ca 0.03 0.41 0.12 0.00 -2.50 0.00 0.00 62.75 60.81 3ga6 n ILE 2159Cb 0.22 -1.32 0.24 0.00 0.54 0.00 0.00 39.64 39.32 3ga6 n ILE 2159CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 3ga6 n ASP 2160N -1.51 1.83 -3.97 9.51 8.00 -0.97 -4.16 116.55 125.28 3ga6 n ASP 2160Ca 0.01 -1.43 -0.08 0.00 0.71 0.00 0.00 54.79 54.00 3ga6 n ASP 2160Cb 0.06 0.18 -0.08 0.00 -0.02 0.00 0.00 41.12 41.26 3ga6 n ASP 2160CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3ga6 s LEU 2161N -2.28 1.80 0.19 0.64 2.34 -1.06 0.10 118.68 120.41 3ga6 s LEU 2161Ca 0.26 -0.83 0.21 0.00 0.06 0.00 0.00 54.13 53.83 3ga6 s LEU 2161Cb 0.19 0.69 -0.01 0.00 -0.56 0.00 0.00 46.19 46.51 3ga6 s LEU 2161CO 0.45 -0.70 1.03 0.00 -1.06 0.00 0.00 176.35 176.08 3ga6 h ALA 2162N 2.89 0.56 -2.23 1.48 0.00 -1.57 -3.38 119.26 117.01 3ga6 h ALA 2162Ca -0.34 -0.19 -0.59 0.00 0.00 0.00 0.00 54.91 53.79 3ga6 h ALA 2162Cb 1.18 0.06 -0.42 0.00 0.00 0.00 0.00 17.79 18.61 3ga6 h ALA 2162CO 0.59 0.21 -0.67 0.54 0.00 0.00 0.00 179.25 179.93 3ga6 n ARG 2163N -2.76 2.81 -0.05 0.00 5.12 -1.26 -4.94 116.66 115.59 3ga6 n ARG 2163Ca -0.02 -4.67 -0.09 0.00 -1.93 0.00 0.00 57.85 51.14 3ga6 n ARG 2163Cb 0.62 -2.19 -0.02 0.00 -1.16 0.00 0.00 32.46 29.71 3ga6 n ARG 2163CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3ga6 h PRO 2164N 3.40 0.19 -0.42 5.56 0.11 -1.86 -2.96 132.00 136.02 3ga6 h PRO 2164Ca 0.15 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.10 3ga6 h PRO 2164Cb 0.59 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 3ga6 h PRO 2164CO 0.80 0.12 -0.30 0.87 -0.21 0.00 0.00 178.00 179.28 3ga6 h LYS 2165N 0.19 0.95 0.00 1.05 1.57 -1.96 -2.61 116.57 115.75 3ga6 h LYS 2165Ca 0.09 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 3ga6 h LYS 2165Cb 0.05 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3ga6 h LYS 2165CO -0.09 1.12 0.00 -0.85 -0.57 0.00 0.00 179.45 179.06 3ga6 n GLU 2166N -4.10 0.18 -0.20 3.15 0.00 -1.21 -3.13 120.64 115.33 3ga6 n GLU 2166Ca -0.01 0.43 0.07 0.00 0.00 0.00 0.00 57.16 57.64 3ga6 n GLU 2166Cb 0.50 -1.85 0.16 0.00 0.00 0.00 0.00 31.44 30.25 3ga6 n GLU 2166CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3ga6 n ASN 2167N -2.18 2.89 0.33 -1.84 3.02 -1.00 -4.67 115.26 111.80 3ga6 n ASN 2167Ca 0.02 -2.66 0.22 0.00 -0.03 0.00 0.00 54.58 52.12 3ga6 n ASN 2167Cb 0.21 -0.35 1.12 0.00 -0.61 0.00 0.00 39.78 40.15 3ga6 n ASN 2167CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3ga6 h SER 2168N 0.95 0.00 0.00 6.41 4.64 -1.45 -1.48 113.55 122.62 3ga6 h SER 2168Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3ga6 h SER 2168Cb 1.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.07 3ga6 h SER 2168CO 0.07 0.00 -0.45 -3.20 -0.87 0.00 0.00 176.83 172.39 3ga6 n ASN 2169N -3.10 1.76 -4.38 4.97 5.15 -1.26 -4.52 115.26 113.88 3ga6 n ASN 2169Ca -0.02 -3.66 -0.33 0.00 -0.60 0.00 0.00 54.58 49.97 3ga6 n ASN 2169Cb 0.11 -0.50 -0.14 0.00 -0.53 0.00 0.00 39.78 38.72 3ga6 n ASN 2169CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3ga6 s VAL 2170N -2.99 2.84 0.24 3.44 1.01 -0.56 -5.01 120.40 119.38 3ga6 s VAL 2170Ca 0.36 -0.76 -0.31 0.00 0.00 0.00 0.00 61.98 61.27 3ga6 s VAL 2170Cb 0.35 -2.14 -0.13 0.00 0.00 0.00 0.00 36.38 34.46 3ga6 s VAL 2170CO -0.06 0.55 1.55 -0.24 0.00 0.00 0.00 175.10 176.91 3ga6 n SER 2171N 3.09 3.39 0.00 3.32 2.88 -1.26 -1.28 113.62 123.75 3ga6 n SER 2171Ca -0.18 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 3ga6 n SER 2171Cb 0.52 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 3ga6 n SER 2171CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ga6 n GLY 2172N 2.68 2.08 1.50 0.46 0.00 -1.25 -4.84 105.19 105.81 3ga6 n GLY 2172Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 3ga6 n GLY 2172CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3ga6 n PHE 2173N -0.31 -0.15 -2.29 1.61 7.35 -0.40 0.52 117.46 123.78 3ga6 n PHE 2173Ca 0.00 -0.77 -0.32 0.00 -0.76 0.00 0.00 57.45 55.60 3ga6 n PHE 2173Cb 0.00 0.36 -0.02 0.00 0.35 0.00 0.00 39.48 40.17 3ga6 n PHE 2173CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 3ga6 s LEU 2174N -0.78 3.57 0.13 -2.13 1.43 -1.12 -4.56 118.68 115.22 3ga6 s LEU 2174Ca 0.14 1.59 -0.20 0.00 -1.03 0.00 0.00 54.13 54.63 3ga6 s LEU 2174Cb 0.20 -4.51 -0.01 0.00 0.03 0.00 0.00 46.19 41.90 3ga6 s LEU 2174CO -0.07 -0.70 1.70 -0.65 0.23 0.00 0.00 176.35 176.86 3ga6 h PRO 2175N 0.72 -0.01 -0.58 1.29 0.11 -1.94 -1.31 132.00 130.28 3ga6 h PRO 2175Ca -0.46 0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.76 3ga6 h PRO 2175Cb 1.19 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.19 3ga6 h PRO 2175CO 0.61 -0.01 -0.22 -0.39 -0.21 0.00 0.00 178.00 177.78 3ga6 h VAL 2176N -0.02 0.31 0.34 3.15 -1.51 -1.97 0.21 116.25 116.76 3ga6 h VAL 2176Ca 0.11 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.56 3ga6 h VAL 2176Cb 0.18 0.31 0.00 0.00 -2.13 0.00 0.00 31.29 29.65 3ga6 h VAL 2176CO -0.24 0.00 -0.16 -0.33 -1.23 0.00 0.00 177.57 175.61 3ga6 h GLU 2177N -0.08 -0.44 -0.62 5.19 5.08 -1.84 0.22 114.58 122.10 3ga6 h GLU 2177Ca 0.27 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 3ga6 h GLU 2177Cb 0.49 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 3ga6 h GLU 2177CO -0.64 -0.26 0.34 0.00 -1.00 0.00 0.00 179.01 177.45 3ga6 h ARG 2178N -0.51 0.85 -0.29 2.33 3.08 -1.08 -2.06 114.38 116.68 3ga6 h ARG 2178Ca -0.05 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 59.80 3ga6 h ARG 2178Cb 0.39 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3ga6 h ARG 2178CO 0.08 0.63 -0.31 0.00 -1.07 0.00 0.00 179.97 179.29 3ga6 h ALA 2179N 1.51 0.91 -0.07 0.04 0.00 -0.32 -1.21 119.26 120.13 3ga6 h ALA 2179Ca 0.22 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3ga6 h ALA 2179Cb 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3ga6 h ALA 2179CO -0.04 0.62 0.05 2.35 0.00 0.00 0.00 179.25 182.23 3ga6 h TRP 2180N 0.53 0.09 -0.65 0.00 7.01 -0.04 -1.13 115.95 121.76 3ga6 h TRP 2180Ca 0.06 0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.10 3ga6 h TRP 2180Cb 0.80 -0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.79 3ga6 h TRP 2180CO 0.03 0.07 0.43 0.82 -2.79 0.00 0.00 178.44 177.01 3ga6 h ILE 2181N 0.09 1.08 -0.26 2.65 2.04 -1.13 0.40 117.51 122.37 3ga6 h ILE 2181Ca 0.03 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.66 3ga6 h ILE 2181Cb 0.00 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.30 3ga6 h ILE 2181CO -0.01 0.14 0.07 0.44 0.00 0.00 0.00 178.15 178.79 3ga6 h ASP 2182N 0.77 0.05 0.12 1.72 3.32 -0.81 -1.82 116.42 119.77 3ga6 h ASP 2182Ca 0.26 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 3ga6 h ASP 2182Cb 0.09 0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.68 3ga6 h ASP 2182CO -0.07 0.06 -0.06 0.50 -1.72 0.00 0.00 179.24 177.95 3ga6 h LYS 2183N 0.18 -0.15 -0.51 3.56 3.64 -0.25 -1.59 116.57 121.43 3ga6 h LYS 2183Ca 0.12 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.59 3ga6 h LYS 2183Cb 0.11 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 31.86 3ga6 h LYS 2183CO -0.14 0.05 -0.41 0.35 -2.27 0.00 0.00 179.45 177.03 3ga6 h PHE 2184N -0.34 -1.18 -0.47 1.91 3.57 -0.90 0.20 116.94 119.73 3ga6 h PHE 2184Ca -0.02 0.07 0.08 0.00 3.53 0.00 0.00 57.97 61.64 3ga6 h PHE 2184Cb 0.28 0.59 -0.07 0.00 2.79 0.00 0.00 35.95 39.54 3ga6 h PHE 2184CO -0.01 -0.42 0.08 0.82 -2.23 0.00 0.00 178.31 176.55 3ga6 h ILE 2185N -0.25 0.72 0.00 1.41 2.04 -1.30 -0.85 117.51 119.28 3ga6 h ILE 2185Ca 0.18 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.96 3ga6 h ILE 2185Cb 0.57 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 3ga6 h ILE 2185CO -0.64 0.04 0.00 -0.33 0.00 0.00 0.00 178.15 177.22 3ga6 h GLU 2186N 0.21 0.00 0.00 2.37 4.39 -0.13 -1.04 114.58 120.38 3ga6 h GLU 2186Ca 0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.93 3ga6 h GLU 2186Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 3ga6 h GLU 2186CO -0.32 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 177.62 3ga6 n ASN 2187N -2.69 0.00 0.00 1.42 5.03 0.55 -4.83 115.26 114.74 3ga6 n ASN 2187Ca 0.00 -0.88 0.00 0.00 0.87 0.00 0.00 54.58 54.57 3ga6 n ASN 2187Cb 0.21 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.97 3ga6 n ASN 2187CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3ga6 n GLY 2188N 0.66 1.70 3.32 7.41 0.00 -0.44 -5.03 105.19 112.80 3ga6 n GLY 2188Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 3ga6 n GLY 2188CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ga6 s TYR 2189N -2.00 1.69 -0.09 1.61 1.51 -0.90 -0.23 117.35 118.93 3ga6 s TYR 2189Ca 0.00 -0.52 0.02 0.00 -1.01 0.00 0.00 57.07 55.56 3ga6 s TYR 2189Cb 0.00 -0.83 0.01 0.00 -0.11 0.00 0.00 41.96 41.03 3ga6 s TYR 2189CO 0.00 0.30 -0.15 0.08 -1.11 0.00 0.00 175.55 174.66 3ga6 s VAL 2190N -2.37 1.46 -0.45 0.71 1.01 -0.18 -4.46 120.40 116.12 3ga6 s VAL 2190Ca 0.16 -0.64 -0.28 0.00 0.00 0.00 0.00 61.98 61.22 3ga6 s VAL 2190Cb -0.04 -1.32 -0.01 0.00 0.00 0.00 0.00 36.38 35.01 3ga6 s VAL 2190CO 0.06 0.43 1.66 -0.62 0.00 0.00 0.00 175.10 176.63 3ga6 s ASP 2191N 0.81 5.89 0.12 3.32 -1.08 -1.26 -2.78 116.67 121.69 3ga6 s ASP 2191Ca -0.11 0.79 -0.15 0.00 -0.52 0.00 0.00 52.55 52.56 3ga6 s ASP 2191Cb -0.16 -2.53 -0.03 0.00 -1.46 0.00 0.00 42.92 38.75 3ga6 s ASP 2191CO 0.01 -1.80 1.57 0.71 0.52 0.00 0.00 175.17 176.19 3ga6 h THR 2192N 6.67 1.25 -0.71 1.71 1.35 -1.66 -2.94 112.91 118.59 3ga6 h THR 2192Ca -0.29 -0.96 0.15 0.00 -0.55 0.00 0.00 66.41 64.75 3ga6 h THR 2192Cb 1.14 1.12 -0.13 0.00 -1.73 0.00 0.00 68.15 68.55 3ga6 h THR 2192CO 1.11 0.32 -0.13 0.15 -0.25 0.00 0.00 175.52 176.73 3ga6 h PHE 2193N 0.50 -0.28 0.00 4.73 3.57 -1.80 0.90 116.94 124.56 3ga6 h PHE 2193Ca 0.11 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.67 3ga6 h PHE 2193Cb 0.44 0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.42 3ga6 h PHE 2193CO 0.03 -0.28 0.00 0.54 -2.23 0.00 0.00 178.31 176.37 3ga6 n ARG 2194N -5.43 0.06 0.17 1.11 5.12 -1.11 -0.90 116.66 115.67 3ga6 n ARG 2194Ca 0.10 0.50 0.04 0.00 -1.93 0.00 0.00 57.85 56.56 3ga6 n ARG 2194Cb 0.39 -1.67 0.24 0.00 -1.16 0.00 0.00 32.46 30.25 3ga6 n ARG 2194CO 0.00 0.00 0.00 0.52 -1.93 0.00 0.00 177.63 176.22 3ga6 h MET 2195N 0.00 0.00 0.00 5.56 2.86 -0.87 -3.37 114.93 119.11 3ga6 h MET 2195Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3ga6 h MET 2195Cb 0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.72 3ga6 h MET 2195CO 0.00 0.46 -0.35 1.19 1.06 0.00 0.00 176.91 179.27 3ga6 n PHE 2196N -3.50 0.00 -3.55 -0.22 3.72 -0.21 -5.00 117.46 108.71 3ga6 n PHE 2196Ca 0.00 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.15 3ga6 n PHE 2196Cb 0.58 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.97 3ga6 n PHE 2196CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3ga6 s ASN 2197N -1.26 2.48 0.00 4.37 3.84 -0.08 -4.99 114.94 119.30 3ga6 s ASN 2197Ca 0.00 -0.77 0.25 0.00 0.21 0.00 0.00 52.86 52.55 3ga6 s ASN 2197Cb 0.00 -0.09 0.62 0.00 -0.55 0.00 0.00 41.25 41.23 3ga6 s ASN 2197CO 0.00 -0.38 1.50 -1.54 -2.79 0.00 0.00 177.10 173.89 3ga6 n SER 2198N 5.28 2.32 -4.78 -4.21 3.41 -1.26 -4.29 113.62 110.09 3ga6 n SER 2198Ca -0.06 -1.78 -0.35 0.00 -0.26 0.00 0.00 58.87 56.43 3ga6 n SER 2198Cb 0.47 -0.06 -0.01 0.00 -0.26 0.00 0.00 64.21 64.35 3ga6 n SER 2198CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3ga6 s ASP 2199N -1.83 5.88 0.89 4.04 -0.00 -1.26 -5.07 116.67 119.32 3ga6 s ASP 2199Ca 0.34 2.09 -0.08 0.00 -0.00 0.00 0.00 52.55 54.89 3ga6 s ASP 2199Cb 0.20 -2.57 0.15 0.00 -0.00 0.00 0.00 42.92 40.70 3ga6 s ASP 2199CO 0.31 -1.10 0.90 -2.65 -0.00 0.00 0.00 175.17 172.62 3ga6 n PRO 2200N -1.26 -0.62 -1.26 8.23 -0.02 -1.26 -4.38 135.00 134.43 3ga6 n PRO 2200Ca 0.11 -1.67 -0.09 0.00 -2.02 0.00 0.00 63.50 59.83 3ga6 n PRO 2200Cb 0.51 -0.84 -0.04 0.00 -0.02 0.00 0.00 33.50 33.12 3ga6 n PRO 2200CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ga6 n GLY 2201N -1.14 0.94 3.40 -1.23 0.00 -1.26 -4.97 105.19 100.94 3ga6 n GLY 2201Ca 0.12 -0.14 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 3ga6 n GLY 2201CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ga6 s GLN 2202N -2.54 3.03 0.21 1.61 -1.52 -1.26 -5.01 119.66 114.17 3ga6 s GLN 2202Ca 0.00 -1.21 0.07 0.00 -1.95 0.00 0.00 55.36 52.27 3ga6 s GLN 2202Cb 0.00 -4.13 -0.05 0.00 -0.22 0.00 0.00 33.01 28.61 3ga6 s GLN 2202CO 0.00 -1.12 -0.13 0.71 -0.25 0.00 0.00 175.29 174.50 3ga6 s TYR 2203N 2.01 1.68 0.00 0.91 1.51 -1.26 -4.42 117.35 117.78 3ga6 s TYR 2203Ca 0.08 -0.62 0.00 0.00 -1.01 0.00 0.00 57.07 55.52 3ga6 s TYR 2203Cb -0.23 -0.81 0.00 0.00 -0.11 0.00 0.00 41.96 40.81 3ga6 s TYR 2203CO 0.08 0.31 0.00 0.25 -1.11 0.00 0.00 175.55 175.08 3ga6 n THR 2204N -0.38 0.00 -4.49 -0.71 -2.24 0.07 -4.90 114.28 101.63 3ga6 n THR 2204Ca -0.08 -0.32 -0.21 0.00 -2.27 0.00 0.00 64.05 61.17 3ga6 n THR 2204Cb 0.61 0.86 -0.15 0.00 -2.10 0.00 0.00 70.33 69.54 3ga6 n THR 2204CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3ga6 s TRP 2205N -1.09 1.05 -0.06 4.78 -0.00 -0.03 -1.24 118.94 122.36 3ga6 s TRP 2205Ca 0.00 -0.23 -0.01 0.00 -0.00 0.00 0.00 56.10 55.86 3ga6 s TRP 2205Cb 0.00 -0.71 0.03 0.00 -0.00 0.00 0.00 33.47 32.79 3ga6 s TRP 2205CO 0.00 -0.06 -0.00 -1.58 -0.00 0.00 0.00 176.95 175.31 3ga6 s TRP 2206N -0.08 0.57 0.17 5.86 0.51 -0.68 -0.59 118.94 124.69 3ga6 s TRP 2206Ca 0.01 -0.11 -0.31 0.00 -2.12 0.00 0.00 56.10 53.57 3ga6 s TRP 2206Cb -0.06 -0.68 -0.17 0.00 -0.81 0.00 0.00 33.47 31.74 3ga6 s TRP 2206CO 0.00 -0.26 0.83 0.45 -0.51 0.00 0.00 176.95 177.46 3ga6 n SER 2207N 4.79 -0.11 -0.34 2.95 2.88 -1.26 -4.77 113.62 117.75 3ga6 n SER 2207Ca -0.13 1.15 0.01 0.00 -1.33 0.00 0.00 58.87 58.56 3ga6 n SER 2207Cb 0.50 -1.05 0.17 0.00 -0.75 0.00 0.00 64.21 63.09 3ga6 n SER 2207CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 3ga6 h TYR 2208N 2.02 1.17 -3.78 0.66 0.99 -1.99 -3.37 116.97 112.67 3ga6 h TYR 2208Ca -0.37 0.03 -0.42 0.00 2.00 0.00 0.00 58.73 59.97 3ga6 h TYR 2208Cb 1.40 -0.39 0.17 0.00 1.00 0.00 0.00 36.73 38.92 3ga6 h TYR 2208CO 0.48 0.67 0.40 2.89 -0.00 0.00 0.00 178.16 182.60 3ga6 n ARG 2209N -4.45 -1.30 -1.25 4.88 0.00 -1.26 -4.40 116.66 108.88 3ga6 n ARG 2209Ca 0.13 -1.99 -0.09 0.00 -0.00 0.00 0.00 57.85 55.90 3ga6 n ARG 2209Cb 0.11 -1.34 -0.04 0.00 -0.00 0.00 0.00 32.46 31.20 3ga6 n ARG 2209CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 3ga6 n THR 2210N -3.81 0.00 -2.61 8.89 -1.04 -1.26 -2.02 114.28 112.42 3ga6 n THR 2210Ca 0.16 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 62.03 3ga6 n THR 2210Cb 0.56 -1.39 -0.00 0.00 -1.82 0.00 0.00 70.33 67.68 3ga6 n THR 2210CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3ga6 n ARG 2211N -0.49 -2.53 -0.33 -2.82 1.74 -1.26 -4.84 116.66 106.13 3ga6 n ARG 2211Ca -0.09 0.60 0.04 0.00 -0.77 0.00 0.00 57.85 57.63 3ga6 n ARG 2211Cb 0.56 -5.23 0.19 0.00 -1.02 0.00 0.00 32.46 26.97 3ga6 n ARG 2211CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ga6 h ALA 2212N 1.00 1.33 -0.15 7.54 0.00 -1.57 -0.59 119.26 126.82 3ga6 h ALA 2212Ca -0.33 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.44 3ga6 h ALA 2212Cb 1.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 3ga6 h ALA 2212CO 0.39 0.22 -0.56 -0.09 0.00 0.00 0.00 179.25 179.20 3ga6 h ARG 2213N 0.95 0.47 -0.30 0.00 2.43 -1.81 0.43 114.38 116.54 3ga6 h ARG 2213Ca 0.43 -0.30 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 3ga6 h ARG 2213Cb 0.35 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 3ga6 h ARG 2213CO -0.23 0.90 0.08 0.93 -1.51 0.00 0.00 179.97 180.14 3ga6 h GLU 2214N 0.35 0.20 -0.44 0.20 5.08 -1.63 -2.57 114.58 115.77 3ga6 h GLU 2214Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3ga6 h GLU 2214Cb 1.09 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3ga6 h GLU 2214CO 0.10 0.13 0.00 0.54 -1.00 0.00 0.00 179.01 178.78 3ga6 n ARG 2215N -5.06 1.73 -4.43 2.33 1.74 -0.34 -4.90 116.66 107.72 3ga6 n ARG 2215Ca -0.00 -0.84 -0.39 0.00 -0.77 0.00 0.00 57.85 55.86 3ga6 n ARG 2215Cb 0.12 -1.36 -0.08 0.00 -1.02 0.00 0.00 32.46 30.11 3ga6 n ARG 2215CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3ga6 n ASN 2216N 0.16 -0.95 -4.35 0.55 5.15 -0.50 -4.90 115.26 110.41 3ga6 n ASN 2216Ca 0.08 -1.24 -0.46 0.00 -0.60 0.00 0.00 54.58 52.36 3ga6 n ASN 2216Cb 0.30 -1.57 -0.02 0.00 -0.53 0.00 0.00 39.78 37.96 3ga6 n ASN 2216CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3ga6 s VAL 2217N -3.57 5.38 0.00 3.44 1.01 0.14 -4.96 120.40 121.84 3ga6 s VAL 2217Ca 0.57 -2.16 0.00 0.00 0.00 0.00 0.00 61.98 60.39 3ga6 s VAL 2217Cb -0.33 -4.52 0.00 0.00 0.00 0.00 0.00 36.38 31.53 3ga6 s VAL 2217CO 1.00 -1.11 0.00 0.61 0.00 0.00 0.00 175.10 175.60 3ga6 n GLY 2218N 4.41 4.42 3.04 4.51 0.00 -1.26 -4.55 105.19 115.75 3ga6 n GLY 2218Ca 0.13 -1.92 -0.17 0.00 0.00 0.00 0.00 46.02 44.05 3ga6 n GLY 2218CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ga6 s TRP 2219N -1.29 0.78 -0.62 1.61 0.52 0.24 -1.56 118.94 118.61 3ga6 s TRP 2219Ca 0.00 -0.24 -0.21 0.00 0.02 0.00 0.00 56.10 55.67 3ga6 s TRP 2219Cb 0.00 -0.48 0.08 0.00 -1.15 0.00 0.00 33.47 31.91 3ga6 s TRP 2219CO 0.00 -0.02 0.86 0.50 0.02 0.00 0.00 176.95 178.31 3ga6 s ARG 2220N -0.61 3.10 -0.01 4.98 6.06 0.29 -0.75 118.95 132.01 3ga6 s ARG 2220Ca 0.00 -0.97 0.10 0.00 -2.50 0.00 0.00 55.73 52.37 3ga6 s ARG 2220Cb -0.05 -4.23 -0.16 0.00 0.06 0.00 0.00 34.95 30.58 3ga6 s ARG 2220CO 0.00 -1.68 0.24 1.28 -2.50 0.00 0.00 175.30 172.64 3ga6 n LEU 2221N 7.17 0.03 -4.50 -0.88 4.77 -1.26 -3.98 117.00 118.34 3ga6 n LEU 2221Ca -0.06 -0.03 -0.34 0.00 -0.03 0.00 0.00 56.01 55.56 3ga6 n LEU 2221Cb 0.44 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.41 3ga6 n LEU 2221CO 0.62 0.01 -0.36 -1.81 -1.33 0.00 0.00 177.39 174.52 3ga6 s ASP 2222N -3.12 4.77 0.14 -1.43 1.01 -1.26 -0.15 116.67 116.62 3ga6 s ASP 2222Ca -0.03 -0.12 0.04 0.00 0.71 0.00 0.00 52.55 53.15 3ga6 s ASP 2222Cb 0.07 -1.73 -0.04 0.00 1.01 0.00 0.00 42.92 42.22 3ga6 s ASP 2222CO 0.43 0.19 -0.10 -0.31 0.21 0.00 0.00 175.17 175.58 3ga6 s TYR 2223N 0.25 1.24 -0.19 4.23 1.51 -1.06 -4.95 117.35 118.38 3ga6 s TYR 2223Ca -0.03 -0.74 -0.01 0.00 -1.01 0.00 0.00 57.07 55.28 3ga6 s TYR 2223Cb -0.14 -0.64 0.00 0.00 -0.11 0.00 0.00 41.96 41.07 3ga6 s TYR 2223CO 0.03 0.07 -0.12 -0.06 -1.11 0.00 0.00 175.55 174.37 3ga6 s PHE 2224N -3.15 2.86 0.18 2.71 0.40 -1.26 -3.11 117.98 116.61 3ga6 s PHE 2224Ca 0.15 -1.12 0.08 0.00 -0.60 0.00 0.00 56.93 55.43 3ga6 s PHE 2224Cb 0.01 -1.99 -0.04 0.00 0.51 0.00 0.00 43.02 41.52 3ga6 s PHE 2224CO 0.01 -0.57 -0.05 -0.06 0.70 0.00 0.00 175.22 175.25 3ga6 s PHE 2225N 1.19 2.74 0.10 0.36 0.40 0.27 -1.56 117.98 121.48 3ga6 s PHE 2225Ca 0.02 -0.18 0.02 0.00 -0.60 0.00 0.00 56.93 56.19 3ga6 s PHE 2225Cb -0.14 -1.33 -0.04 0.00 0.51 0.00 0.00 43.02 42.01 3ga6 s PHE 2225CO -0.05 0.52 -0.06 0.14 0.70 0.00 0.00 175.22 176.47 3ga6 s VAL 2226N -1.73 0.69 0.49 -0.44 -7.23 -1.12 -0.96 120.40 110.09 3ga6 s VAL 2226Ca 0.26 -1.94 -0.23 0.00 -1.81 0.00 0.00 61.98 58.27 3ga6 s VAL 2226Cb -0.09 -1.72 -0.06 0.00 0.56 0.00 0.00 36.38 35.06 3ga6 s VAL 2226CO 0.17 -0.84 1.24 0.54 -0.31 0.00 0.00 175.10 175.90 3ga6 s ASN 2227N -3.05 5.85 0.41 4.85 4.22 -1.09 -1.01 114.94 125.11 3ga6 s ASN 2227Ca 0.13 2.47 0.12 0.00 -2.14 0.00 0.00 52.86 53.45 3ga6 s ASN 2227Cb 0.05 -2.61 0.95 0.00 1.28 0.00 0.00 41.25 40.92 3ga6 s ASN 2227CO -0.04 -1.15 1.94 1.05 -2.04 0.00 0.00 177.10 176.86 3ga6 h GLU 2228N 1.85 0.50 0.00 3.55 4.11 -0.92 0.96 114.58 124.63 3ga6 h GLU 2228Ca -0.50 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.90 3ga6 h GLU 2228Cb 1.27 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3ga6 h GLU 2228CO 0.59 0.33 0.00 0.39 0.07 0.00 0.00 179.01 180.39 3ga6 n GLU 2229N -4.49 0.10 -0.15 1.06 4.71 -1.26 -1.98 120.64 118.63 3ga6 n GLU 2229Ca 0.13 0.44 0.08 0.00 -0.01 0.00 0.00 57.16 57.80 3ga6 n GLU 2229Cb 0.42 -1.73 0.16 0.00 -1.01 0.00 0.00 31.44 29.28 3ga6 n GLU 2229CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3ga6 n PHE 2230N -1.92 0.39 0.22 -0.32 7.35 0.33 -4.68 117.46 118.83 3ga6 n PHE 2230Ca 0.01 -0.28 0.08 0.00 -0.76 0.00 0.00 57.45 56.50 3ga6 n PHE 2230Cb 0.13 -0.01 0.49 0.00 0.35 0.00 0.00 39.48 40.45 3ga6 n PHE 2230CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 3ga6 h LYS 2231N 3.15 0.00 0.00 -4.13 3.64 -1.39 -2.83 116.57 115.00 3ga6 h LYS 2231Ca 0.00 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 3ga6 h LYS 2231Cb 0.78 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 3ga6 h LYS 2231CO 0.00 0.27 -0.39 0.78 -2.27 0.00 0.00 179.45 177.84 3ga6 h GLY 2232N 1.33 0.00 2.00 5.01 0.00 -1.83 -3.01 103.07 106.57 3ga6 h GLY 2232Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 3ga6 h GLY 2232CO 0.03 0.00 -0.44 0.50 0.00 0.00 0.00 176.54 176.63 3ga6 h LYS 2233N 0.00 0.00 -6.31 4.80 1.57 -1.79 -3.43 116.57 111.41 3ga6 h LYS 2233Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 3ga6 h LYS 2233Cb 0.71 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.98 3ga6 h LYS 2233CO 0.05 0.44 1.11 0.54 -0.57 0.00 0.00 179.45 181.02 3ga6 s VAL 2234N -3.17 3.77 -0.19 0.50 0.11 -1.14 -2.08 120.40 118.19 3ga6 s VAL 2234Ca 0.03 0.85 0.18 0.00 -2.93 0.00 0.00 61.98 60.10 3ga6 s VAL 2234Cb 0.09 -3.82 -0.25 0.00 -1.53 0.00 0.00 36.38 30.86 3ga6 s VAL 2234CO 0.72 -0.38 0.12 0.29 -3.33 0.00 0.00 175.10 172.52 3ga6 n LYS 2235N 7.72 0.69 -3.76 1.54 4.76 -0.11 -4.99 118.16 124.01 3ga6 n LYS 2235Ca 0.18 0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.50 3ga6 n LYS 2235Cb 0.46 -1.54 -0.10 0.00 -1.84 0.00 0.00 35.03 32.01 3ga6 n LYS 2235CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 3ga6 s ARG 2236N -2.52 0.48 -0.14 1.97 3.52 -0.81 -4.98 118.95 116.47 3ga6 s ARG 2236Ca -0.10 0.28 -0.05 0.00 -0.13 0.00 0.00 55.73 55.74 3ga6 s ARG 2236Cb 0.06 0.23 0.07 0.00 -1.56 0.00 0.00 34.95 33.75 3ga6 s ARG 2236CO 0.83 -0.09 0.29 0.45 -0.81 0.00 0.00 175.30 175.97 3ga6 s SER 2237N -0.26 0.26 0.27 -2.12 0.15 -1.26 -0.43 113.70 110.31 3ga6 s SER 2237Ca -0.04 0.65 -0.07 0.00 0.70 0.00 0.00 55.95 57.19 3ga6 s SER 2237Cb -0.03 0.81 -0.01 0.00 -1.71 0.00 0.00 66.02 65.08 3ga6 s SER 2237CO 0.02 -0.24 0.42 -1.66 1.20 0.00 0.00 173.24 172.97 3ga6 s TRP 2238N 2.45 0.76 -0.10 3.44 -2.14 -0.75 -4.56 118.94 118.05 3ga6 s TRP 2238Ca 0.01 -1.05 0.04 0.00 2.66 0.00 0.00 56.10 57.75 3ga6 s TRP 2238Cb -0.12 -0.04 0.00 0.00 -3.10 0.00 0.00 33.47 30.21 3ga6 s TRP 2238CO -0.09 -0.99 -0.22 0.42 -2.66 0.00 0.00 176.95 173.41 3ga6 s ILE 2239N -3.68 1.91 -1.27 0.66 1.01 -1.26 -1.22 121.20 117.35 3ga6 s ILE 2239Ca 0.28 -0.93 -0.10 0.00 0.00 0.00 0.00 60.65 59.91 3ga6 s ILE 2239Cb 0.01 -1.66 0.17 0.00 0.01 0.00 0.00 42.46 40.99 3ga6 s ILE 2239CO 0.14 0.53 1.82 0.18 0.00 0.00 0.00 174.94 177.60 3ga6 n LEU 2240N 3.60 6.50 0.27 2.97 4.32 -0.83 -4.85 117.00 128.98 3ga6 n LEU 2240Ca -0.20 -4.64 0.18 0.00 -0.02 0.00 0.00 56.01 51.34 3ga6 n LEU 2240Cb 0.53 -1.49 0.97 0.00 -1.62 0.00 0.00 43.42 41.81 3ga6 n LEU 2240CO 0.27 1.32 1.05 0.77 -1.22 0.00 0.00 177.39 179.58 3ga6 h SER 2241N 5.89 0.00 -0.17 -1.43 4.64 -1.91 -2.93 113.55 117.64 3ga6 h SER 2241Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 3ga6 h SER 2241Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3ga6 h SER 2241CO 1.58 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 178.01 3ga6 n ASP 2242N -2.78 2.37 -4.60 4.97 8.00 -1.26 -4.92 116.55 118.34 3ga6 n ASP 2242Ca -0.02 -1.88 -0.43 0.00 0.71 0.00 0.00 54.79 53.17 3ga6 n ASP 2242Cb 0.07 -0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.03 3ga6 n ASP 2242CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3ga6 s VAL 2243N -0.92 4.25 0.78 2.53 1.01 -1.10 -5.03 120.40 121.92 3ga6 s VAL 2243Ca 0.12 1.18 -0.06 0.00 0.00 0.00 0.00 61.98 63.22 3ga6 s VAL 2243Cb 0.07 -4.57 0.14 0.00 0.00 0.00 0.00 36.38 32.01 3ga6 s VAL 2243CO 0.09 -0.97 1.08 -0.04 0.00 0.00 0.00 175.10 175.26 3ga6 s MET 2244N 4.33 1.48 0.00 2.72 -1.94 -1.26 -4.68 119.30 119.95 3ga6 s MET 2244Ca 0.46 -0.80 0.00 0.00 -1.71 0.00 0.00 55.69 53.65 3ga6 s MET 2244Cb -0.08 -2.18 0.00 0.00 2.01 0.00 0.00 34.83 34.58 3ga6 s MET 2244CO 0.30 -1.67 0.00 0.41 -0.01 0.00 0.00 175.02 174.05 3ga6 n GLY 2245N -3.09 1.13 3.66 -0.03 0.00 -1.26 -5.00 105.19 100.60 3ga6 n GLY 2245Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3ga6 n GLY 2245CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ga6 s SER 2246N -1.06 -0.25 0.00 1.61 0.15 -1.26 -4.56 113.70 108.33 3ga6 s SER 2246Ca 0.00 -0.58 0.28 0.00 0.70 0.00 0.00 55.95 56.35 3ga6 s SER 2246Cb 0.00 0.64 1.13 0.00 -1.71 0.00 0.00 66.02 66.08 3ga6 s SER 2246CO 0.00 -1.18 1.81 -0.90 1.20 0.00 0.00 173.24 174.17 3ga6 n ASP 2247N -0.40 0.41 -4.53 5.45 5.75 -1.26 -4.68 116.55 117.29 3ga6 n ASP 2247Ca -0.07 -0.37 -0.33 0.00 -0.01 0.00 0.00 54.79 54.01 3ga6 n ASP 2247Cb 0.61 -0.09 -0.12 0.00 -1.03 0.00 0.00 41.12 40.49 3ga6 n ASP 2247CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 3ga6 s HIS 2248N -2.62 2.80 0.43 2.11 3.76 -1.26 -1.68 115.29 118.82 3ga6 s HIS 2248Ca 0.24 -0.08 -0.01 0.00 -0.15 0.00 0.00 55.06 55.06 3ga6 s HIS 2248Cb 0.20 -1.65 -0.02 0.00 1.11 0.00 0.00 32.58 32.21 3ga6 s HIS 2248CO 0.51 0.26 0.66 0.00 -0.85 0.00 0.00 174.74 175.32 3ga6 s PRO 2250N -4.53 1.86 0.00 0.00 0.02 -1.26 -4.67 135.00 126.43 3ga6 s PRO 2250Ca 0.45 0.57 0.02 0.00 0.02 0.00 0.00 61.00 62.07 3ga6 s PRO 2250Cb -0.10 -1.90 -0.01 0.00 0.02 0.00 0.00 34.50 32.51 3ga6 s PRO 2250CO 0.39 -1.76 -0.07 0.96 -0.33 0.00 0.00 177.00 176.19 3ga6 s ILE 2251N -3.17 0.53 0.26 2.83 -4.36 -0.05 -1.96 121.20 115.27 3ga6 s ILE 2251Ca 0.61 -0.43 0.12 0.00 -0.26 0.00 0.00 60.65 60.70 3ga6 s ILE 2251Cb -0.15 -0.47 -0.05 0.00 1.25 0.00 0.00 42.46 43.04 3ga6 s ILE 2251CO 0.54 0.05 -0.21 -0.83 0.24 0.00 0.00 174.94 174.74 3ga6 s GLY 2252N -0.41 1.85 -0.03 6.27 0.00 -0.35 -0.58 107.32 114.07 3ga6 s GLY 2252Ca 0.00 -1.82 -0.01 0.00 0.00 0.00 0.00 44.72 42.89 3ga6 s GLY 2252CO -0.00 -1.90 0.05 -2.27 0.00 0.00 0.00 173.10 168.98 3ga6 s LEU 2253N -3.31 0.87 -0.16 0.66 2.96 0.34 -1.80 118.68 118.24 3ga6 s LEU 2253Ca 0.28 0.08 -0.02 0.00 -0.22 0.00 0.00 54.13 54.25 3ga6 s LEU 2253Cb -0.06 -0.03 -0.02 0.00 0.50 0.00 0.00 46.19 46.59 3ga6 s LEU 2253CO 0.14 -0.15 -0.08 -1.61 -1.32 0.00 0.00 176.35 173.32 3ga6 s GLU 2254N 1.28 3.47 0.34 1.98 2.02 0.42 -0.71 118.70 127.51 3ga6 s GLU 2254Ca -0.07 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.31 3ga6 s GLU 2254Cb -0.13 -2.80 0.01 0.00 0.10 0.00 0.00 34.13 31.30 3ga6 s GLU 2254CO -0.03 0.13 0.05 0.44 0.02 0.00 0.00 175.26 175.86 3ga6 n ILE 2255N 3.82 0.00 -1.79 -1.63 -0.00 -0.50 -0.93 119.36 118.34 3ga6 n ILE 2255Ca -0.18 -1.57 0.00 0.00 -0.00 0.00 0.00 62.75 61.00 3ga6 n ILE 2255Cb 0.52 0.23 0.00 0.00 -0.00 0.00 0.00 39.64 40.39 3ga6 n ILE 2255CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76