#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nd6 s GLU 2001N 0.00 3.39 -0.10 1.64 2.12 -0.76 -4.88 118.70 120.10 1nd6 s GLU 2001Ca 0.00 -0.25 -0.28 0.00 0.36 0.00 0.00 54.97 54.80 1nd6 s GLU 2001Cb 0.00 -3.07 -0.02 0.00 0.26 0.00 0.00 34.13 31.30 1nd6 s GLU 2001CO 0.00 0.67 0.93 -1.17 -0.54 0.00 0.00 175.26 175.16 1nd6 s LEU 2002N -0.75 4.25 -0.02 2.70 2.96 -1.26 0.13 118.68 126.69 1nd6 s LEU 2002Ca 0.13 1.43 0.04 0.00 -0.22 0.00 0.00 54.13 55.50 1nd6 s LEU 2002Cb -0.12 -3.44 -0.06 0.00 0.50 0.00 0.00 46.19 43.08 1nd6 s LEU 2002CO 0.03 -0.38 0.06 1.17 -1.32 0.00 0.00 176.35 175.90 1nd6 n LYS 2003N 4.82 1.42 -3.67 1.98 4.81 0.45 -4.94 118.16 123.03 1nd6 n LYS 2003Ca 0.06 -0.02 -0.13 0.00 -0.87 0.00 0.00 58.31 57.35 1nd6 n LYS 2003Cb 0.49 -1.10 -0.08 0.00 0.02 0.00 0.00 35.03 34.36 1nd6 n LYS 2003CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1nd6 s PHE 2004N -2.21 -0.66 0.03 5.64 5.36 -1.10 -4.71 117.98 120.32 1nd6 s PHE 2004Ca -0.02 1.59 0.01 0.00 -0.96 0.00 0.00 56.93 57.56 1nd6 s PHE 2004Cb 0.02 0.24 -0.02 0.00 -0.34 0.00 0.00 43.02 42.92 1nd6 s PHE 2004CO 0.16 -0.32 -0.05 0.54 -1.46 0.00 0.00 175.22 174.09 1nd6 s VAL 2005N 0.38 0.32 -0.03 3.12 0.11 -0.65 -0.19 120.40 123.45 1nd6 s VAL 2005Ca -0.01 -0.86 0.02 0.00 -2.93 0.00 0.00 61.98 58.21 1nd6 s VAL 2005Cb -0.04 -0.40 0.01 0.00 -1.53 0.00 0.00 36.38 34.42 1nd6 s VAL 2005CO -0.00 -0.36 -0.06 -0.89 -3.33 0.00 0.00 175.10 170.46 1nd6 s THR 2006N -1.20 0.60 -0.10 5.04 2.01 -0.45 -2.26 115.64 119.29 1nd6 s THR 2006Ca -0.11 -0.22 0.02 0.00 0.31 0.00 0.00 61.69 61.69 1nd6 s THR 2006Cb -0.09 -0.57 0.01 0.00 0.01 0.00 0.00 72.50 71.86 1nd6 s THR 2006CO -0.00 0.21 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.23 1nd6 s LEU 2007N 0.50 1.75 -0.27 4.42 1.43 -0.80 -1.12 118.68 124.59 1nd6 s LEU 2007Ca -0.07 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 1nd6 s LEU 2007Cb -0.11 -1.07 0.08 0.00 0.03 0.00 0.00 46.19 45.12 1nd6 s LEU 2007CO 0.00 0.04 0.01 -0.69 0.23 0.00 0.00 176.35 175.94 1nd6 s VAL 2008N 0.84 1.46 0.28 -1.59 1.01 -0.76 -0.25 120.40 121.39 1nd6 s VAL 2008Ca -0.10 -1.43 0.08 0.00 0.00 0.00 0.00 61.98 60.52 1nd6 s VAL 2008Cb -0.15 -1.89 -0.06 0.00 0.00 0.00 0.00 36.38 34.28 1nd6 s VAL 2008CO 0.01 -0.33 -0.08 0.72 0.00 0.00 0.00 175.10 175.42 1nd6 s PHE 2009N 1.38 2.03 0.33 5.22 -0.12 -1.04 -0.47 117.98 125.30 1nd6 s PHE 2009Ca 0.01 -0.63 -0.01 0.00 -0.05 0.00 0.00 56.93 56.25 1nd6 s PHE 2009Cb -0.18 -1.13 -0.04 0.00 -0.63 0.00 0.00 43.02 41.04 1nd6 s PHE 2009CO -0.11 0.37 0.54 0.50 -0.05 0.00 0.00 175.22 176.47 1nd6 s ARG 2010N -3.69 3.52 1.28 1.99 3.52 -0.60 -1.47 118.95 123.50 1nd6 s ARG 2010Ca 0.29 -0.24 -0.19 0.00 -0.13 0.00 0.00 55.73 55.46 1nd6 s ARG 2010Cb 0.03 -2.66 0.32 0.00 -1.56 0.00 0.00 34.95 31.07 1nd6 s ARG 2010CO 0.12 0.17 1.01 -3.38 -0.81 0.00 0.00 175.30 172.41 1nd6 s HIS 2011N -2.24 0.34 0.75 5.12 -3.43 -0.87 -3.07 115.29 111.88 1nd6 s HIS 2011Ca 0.41 0.73 -0.06 0.00 -0.80 0.00 0.00 55.06 55.33 1nd6 s HIS 2011Cb -0.10 -3.11 0.16 0.00 -1.43 0.00 0.00 32.58 28.10 1nd6 s HIS 2011CO 0.34 -4.30 1.02 0.41 -2.00 0.00 0.00 174.74 170.21 1nd6 n GLY 2012N 0.47 -0.23 3.43 -1.38 0.00 -1.26 -1.27 105.19 104.95 1nd6 n GLY 2012Ca 0.10 -1.89 -0.46 0.00 0.00 0.00 0.00 46.02 43.77 1nd6 n GLY 2012CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nd6 n ASP 2013N -3.27 -0.94 -4.03 1.61 -0.08 -1.26 -4.83 116.55 103.75 1nd6 n ASP 2013Ca 0.15 1.07 -0.10 0.00 -1.51 0.00 0.00 54.79 54.40 1nd6 n ASP 2013Cb 0.53 -1.03 -0.08 0.00 2.34 0.00 0.00 41.12 42.88 1nd6 n ASP 2013CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nd6 s ARG 2014N -1.18 1.12 0.73 -0.67 1.70 -1.26 -2.29 118.95 117.09 1nd6 s ARG 2014Ca 0.62 -1.28 -0.11 0.00 -0.47 0.00 0.00 55.73 54.48 1nd6 s ARG 2014Cb -0.80 0.34 0.03 0.00 -0.57 0.00 0.00 34.95 33.94 1nd6 s ARG 2014CO 0.58 -0.39 1.10 -1.54 -1.08 0.00 0.00 175.30 173.97 1nd6 s SER 2015N -3.01 5.24 0.82 -2.89 1.04 -0.20 -4.88 113.70 109.83 1nd6 s SER 2015Ca 0.21 1.17 -0.12 0.00 0.48 0.00 0.00 55.95 57.69 1nd6 s SER 2015Cb 0.04 -1.95 0.09 0.00 0.10 0.00 0.00 66.02 64.30 1nd6 s SER 2015CO 0.02 -1.47 1.15 -2.16 0.98 0.00 0.00 173.24 171.76 1nd6 s PRO 2016N -5.32 1.69 0.04 4.02 0.04 -1.26 -3.44 135.00 130.77 1nd6 s PRO 2016Ca 0.59 1.54 0.14 0.00 0.04 0.00 0.00 61.00 63.31 1nd6 s PRO 2016Cb -0.12 -1.80 -0.16 0.00 0.04 0.00 0.00 34.50 32.46 1nd6 s PRO 2016CO 0.52 -2.13 0.85 0.82 0.04 0.00 0.00 177.00 177.10 1nd6 h ILE 2017N -1.14 0.75 -2.75 0.56 2.04 -1.91 0.77 117.51 115.83 1nd6 h ILE 2017Ca -0.45 -2.38 -0.04 0.00 1.00 0.00 0.00 64.86 62.99 1nd6 h ILE 2017Cb 1.27 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 39.62 1nd6 h ILE 2017CO 0.47 0.43 0.15 -0.67 0.00 0.00 0.00 178.15 178.53 1nd6 n ASP 2018N -3.01 -1.48 -3.46 1.72 2.03 -1.26 -4.56 116.55 106.52 1nd6 n ASP 2018Ca -0.11 -2.10 -0.11 0.00 0.52 0.00 0.00 54.79 52.99 1nd6 n ASP 2018Cb 0.92 2.49 -0.02 0.00 -0.72 0.00 0.00 41.12 43.79 1nd6 n ASP 2018CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1nd6 s THR 2019N -2.43 0.00 0.57 5.18 -1.32 -1.26 -4.56 115.64 111.83 1nd6 s THR 2019Ca 0.12 -0.04 -0.14 0.00 -1.21 0.00 0.00 61.69 60.41 1nd6 s THR 2019Cb -0.03 -1.04 -0.05 0.00 -1.51 0.00 0.00 72.50 69.86 1nd6 s THR 2019CO 0.09 0.00 1.02 0.72 -2.21 0.00 0.00 174.62 174.24 1nd6 s PHE 2020N -3.58 3.37 0.20 9.09 -0.12 -1.03 -4.98 117.98 120.92 1nd6 s PHE 2020Ca 0.02 1.43 -0.14 0.00 -0.05 0.00 0.00 56.93 58.19 1nd6 s PHE 2020Cb -0.01 -2.83 0.21 0.00 -0.63 0.00 0.00 43.02 39.77 1nd6 s PHE 2020CO -0.11 -0.68 1.63 -1.35 -0.05 0.00 0.00 175.22 174.65 1nd6 h PRO 2021N 0.35 -0.01 0.00 1.99 0.11 -1.83 -1.90 132.00 130.70 1nd6 h PRO 2021Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1nd6 h PRO 2021Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1nd6 h PRO 2021CO 0.60 -0.01 0.00 2.41 -0.21 0.00 0.00 178.00 180.79 1nd6 n THR 2022N -5.42 0.98 -1.91 -1.15 -1.04 0.06 -4.80 114.28 101.00 1nd6 n THR 2022Ca 0.07 0.30 -0.42 0.00 -2.04 0.00 0.00 64.05 61.96 1nd6 n THR 2022Cb 0.32 -1.18 -0.03 0.00 -1.82 0.00 0.00 70.33 67.62 1nd6 n THR 2022CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1nd6 s ASP 2023N -3.72 6.58 0.08 8.00 -1.08 -0.72 -4.88 116.67 120.93 1nd6 s ASP 2023Ca 0.04 2.55 -0.14 0.00 -0.52 0.00 0.00 52.55 54.48 1nd6 s ASP 2023Cb 0.08 -2.57 -0.16 0.00 -1.46 0.00 0.00 42.92 38.81 1nd6 s ASP 2023CO 0.31 -0.88 1.29 -0.65 0.52 0.00 0.00 175.17 175.75 1nd6 h PRO 2024N 7.93 0.71 -6.23 4.34 0.11 -1.89 -3.42 132.00 133.55 1nd6 h PRO 2024Ca -0.43 -0.57 -0.54 0.00 0.11 0.00 0.00 66.00 64.58 1nd6 h PRO 2024Cb 1.20 0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.38 1nd6 h PRO 2024CO 0.93 1.18 1.23 0.42 -0.21 0.00 0.00 178.00 181.55 1nd6 s ILE 2025N -3.77 3.57 0.61 4.15 1.01 -1.26 -4.99 121.20 120.52 1nd6 s ILE 2025Ca -0.11 0.47 0.07 0.00 0.00 0.00 0.00 60.65 61.08 1nd6 s ILE 2025Cb 0.08 -4.09 0.10 0.00 0.01 0.00 0.00 42.46 38.55 1nd6 s ILE 2025CO 0.88 -0.91 0.84 -0.54 0.00 0.00 0.00 174.94 175.21 1nd6 s LYS 2026N 6.06 2.14 0.50 2.79 -0.14 -1.26 -4.96 119.74 124.87 1nd6 s LYS 2026Ca 0.63 -1.52 0.27 0.00 -1.36 0.00 0.00 55.97 54.00 1nd6 s LYS 2026Cb -0.14 -2.57 1.35 0.00 -1.68 0.00 0.00 37.83 34.79 1nd6 s LYS 2026CO 0.25 -1.01 1.88 1.49 -0.76 0.00 0.00 175.35 177.20 1nd6 h GLU 2027N 0.00 0.13 -0.06 1.68 4.81 -1.95 0.68 114.58 119.87 1nd6 h GLU 2027Ca -0.31 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 58.93 1nd6 h GLU 2027Cb 1.28 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 1nd6 h GLU 2027CO 0.40 0.09 0.06 0.77 -0.73 0.00 0.00 179.01 179.60 1nd6 h SER 2028N 0.14 0.00 0.80 1.04 0.02 -1.98 -1.37 113.55 112.19 1nd6 h SER 2028Ca 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 1nd6 h SER 2028Cb 1.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.07 1nd6 h SER 2028CO -0.07 0.00 0.00 -1.20 -1.14 0.00 0.00 176.83 174.42 1nd6 n SER 2029N -3.98 0.01 -4.41 3.07 7.64 0.23 -4.69 113.62 111.49 1nd6 n SER 2029Ca -0.01 0.50 -0.34 0.00 1.01 0.00 0.00 58.87 60.03 1nd6 n SER 2029Cb 0.16 -0.51 -0.13 0.00 -1.01 0.00 0.00 64.21 62.72 1nd6 n SER 2029CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1nd6 s TRP 2030N -3.00 2.97 0.17 1.43 0.52 -0.52 -5.04 118.94 115.46 1nd6 s TRP 2030Ca 0.11 -0.56 -0.29 0.00 0.02 0.00 0.00 56.10 55.38 1nd6 s TRP 2030Cb 0.15 -2.00 -0.02 0.00 -1.15 0.00 0.00 33.47 30.44 1nd6 s TRP 2030CO 0.42 -0.25 1.55 -1.35 0.02 0.00 0.00 176.95 177.34 1nd6 h PRO 2031N 7.25 -0.10 -0.58 4.98 0.11 -1.84 -0.31 132.00 141.52 1nd6 h PRO 2031Ca -0.34 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1nd6 h PRO 2031Cb 1.18 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1nd6 h PRO 2031CO 0.60 -0.07 0.00 1.04 -0.21 0.00 0.00 178.00 179.37 1nd6 n GLN 2032N -5.32 2.45 0.00 1.05 3.00 -1.26 -5.06 117.38 112.24 1nd6 n GLN 2032Ca 0.02 -2.06 0.00 0.00 -0.01 0.00 0.00 57.00 54.95 1nd6 n GLN 2032Cb 0.31 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.05 1nd6 n GLN 2032CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nd6 n GLY 2033N 1.32 -1.99 3.77 1.08 0.00 -0.13 -4.75 105.19 104.50 1nd6 n GLY 2033Ca 0.19 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 1nd6 n GLY 2033CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nd6 s PHE 2034N 0.00 2.69 -1.58 1.61 2.99 -1.26 -3.97 117.98 118.47 1nd6 s PHE 2034Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 56.93 58.47 1nd6 s PHE 2034Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 43.02 39.74 1nd6 s PHE 2034CO 0.00 -1.54 0.00 0.41 -0.00 0.00 0.00 175.22 174.09 1nd6 n GLY 2035N 0.15 1.52 3.77 4.36 0.00 0.27 -4.92 105.19 110.35 1nd6 n GLY 2035Ca 0.11 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 1nd6 n GLY 2035CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nd6 s GLN 2036N -3.25 2.98 -0.04 1.61 -1.52 -1.25 -4.53 119.66 113.65 1nd6 s GLN 2036Ca 0.00 -0.57 -0.30 0.00 -1.95 0.00 0.00 55.36 52.54 1nd6 s GLN 2036Cb 0.00 -2.79 -0.05 0.00 -0.22 0.00 0.00 33.01 29.95 1nd6 s GLN 2036CO 0.00 0.61 1.44 -1.17 -0.25 0.00 0.00 175.29 175.92 1nd6 s LEU 2037N -1.98 4.30 0.00 2.90 2.96 -1.26 -1.03 118.68 124.57 1nd6 s LEU 2037Ca 0.25 2.08 -0.12 0.00 -0.22 0.00 0.00 54.13 56.12 1nd6 s LEU 2037Cb -0.12 -3.55 0.19 0.00 0.50 0.00 0.00 46.19 43.21 1nd6 s LEU 2037CO 0.17 -0.77 1.13 0.35 -1.32 0.00 0.00 176.35 175.91 1nd6 n THR 2038N 4.94 0.00 0.57 3.68 -2.24 -0.97 -4.90 114.28 115.35 1nd6 n THR 2038Ca 0.14 -0.95 0.13 0.00 -2.27 0.00 0.00 64.05 61.10 1nd6 n THR 2038Cb 0.44 -1.47 0.42 0.00 -2.10 0.00 0.00 70.33 67.61 1nd6 n THR 2038CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1nd6 h GLN 2039N 0.00 0.00 -0.14 -0.78 4.20 -1.95 -2.40 115.11 114.04 1nd6 h GLN 2039Ca -0.37 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.12 1nd6 h GLN 2039Cb 1.05 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.84 1nd6 h GLN 2039CO 0.28 0.00 -0.79 1.25 -0.67 0.00 0.00 178.83 178.89 1nd6 h LEU 2040N 0.00 0.94 -0.76 1.46 5.85 -1.92 -2.15 115.31 118.74 1nd6 h LEU 2040Ca 0.00 -0.64 -0.05 0.00 0.84 0.00 0.00 57.88 58.03 1nd6 h LEU 2040Cb 0.68 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1nd6 h LEU 2040CO 0.00 1.43 0.28 1.23 -0.34 0.00 0.00 178.44 181.04 1nd6 h GLY 2041N 0.52 1.23 0.97 3.75 0.00 -1.59 0.15 103.07 108.10 1nd6 h GLY 2041Ca -0.06 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.59 1nd6 h GLY 2041CO 0.16 0.64 0.02 -0.33 0.00 0.00 0.00 176.54 177.03 1nd6 h MET 2042N 1.10 0.03 -0.29 4.80 2.86 -1.38 -1.51 114.93 120.55 1nd6 h MET 2042Ca 0.25 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.94 1nd6 h MET 2042Cb 0.24 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.84 1nd6 h MET 2042CO -0.02 0.05 -0.08 0.93 1.06 0.00 0.00 176.91 178.86 1nd6 h GLU 2043N 0.00 -0.01 -0.87 1.72 5.08 -1.03 0.14 114.58 119.62 1nd6 h GLU 2043Ca 0.01 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.49 1nd6 h GLU 2043Cb 0.03 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.20 1nd6 h GLU 2043CO -0.00 -0.01 0.49 1.96 -1.00 0.00 0.00 179.01 180.45 1nd6 h GLN 2044N -0.01 0.74 0.00 2.33 4.20 -0.53 0.12 115.11 121.95 1nd6 h GLN 2044Ca 0.14 -0.04 -0.18 0.00 0.06 0.00 0.00 58.65 58.62 1nd6 h GLN 2044Cb 0.22 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 1nd6 h GLN 2044CO -0.30 0.49 -0.89 0.45 -0.67 0.00 0.00 178.83 177.91 1nd6 h HIS 2045N 0.76 0.00 -0.43 2.96 3.86 -0.66 -1.81 115.15 119.83 1nd6 h HIS 2045Ca 0.44 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.61 1nd6 h HIS 2045Cb 0.50 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.95 1nd6 h HIS 2045CO -0.06 0.87 0.11 -0.92 0.86 0.00 0.00 177.93 178.79 1nd6 h TYR 2046N 0.00 0.65 -0.29 2.45 3.20 0.27 0.75 116.97 123.99 1nd6 h TYR 2046Ca -0.02 -0.04 -0.15 0.00 3.14 0.00 0.00 58.73 61.66 1nd6 h TYR 2046Cb 1.67 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.75 1nd6 h TYR 2046CO 0.00 0.55 -0.42 1.49 -1.64 0.00 0.00 178.16 178.14 1nd6 h GLU 2047N 0.63 0.80 -0.73 1.82 4.22 -0.66 -1.96 114.58 118.69 1nd6 h GLU 2047Ca 0.14 -0.47 -0.05 0.00 0.08 0.00 0.00 59.36 59.07 1nd6 h GLU 2047Cb 0.22 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 1nd6 h GLU 2047CO -0.00 1.10 0.27 1.25 -2.18 0.00 0.00 179.01 179.45 1nd6 h LEU 2048N 0.56 1.00 0.17 1.64 6.46 -0.66 -0.47 115.31 124.01 1nd6 h LEU 2048Ca 0.03 -0.16 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 1nd6 h LEU 2048Cb 1.01 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.68 1nd6 h LEU 2048CO 0.10 0.90 -0.08 1.23 -0.62 0.00 0.00 178.44 179.97 1nd6 h GLY 2049N 1.11 -0.23 0.83 3.75 0.00 -0.74 -0.09 103.07 107.69 1nd6 h GLY 2049Ca 0.24 0.09 0.07 0.00 0.00 0.00 0.00 47.33 47.73 1nd6 h GLY 2049CO -0.02 -0.09 0.59 0.83 0.00 0.00 0.00 176.54 177.86 1nd6 h GLU 2050N -0.24 0.99 0.36 4.80 5.08 -0.96 -0.45 114.58 124.16 1nd6 h GLU 2050Ca -0.02 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1nd6 h GLU 2050Cb 0.19 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1nd6 h GLU 2050CO 0.04 0.66 -0.17 -0.92 -1.00 0.00 0.00 179.01 177.61 1nd6 h TYR 2051N 1.02 -0.44 -0.76 4.33 3.20 -0.69 -1.96 116.97 121.67 1nd6 h TYR 2051Ca 0.40 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.43 1nd6 h TYR 2051Cb 0.22 0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.59 1nd6 h TYR 2051CO -0.00 -0.16 0.51 0.82 -1.64 0.00 0.00 178.16 177.69 1nd6 h ILE 2052N -0.68 0.74 -0.45 1.81 2.04 -0.61 0.42 117.51 120.78 1nd6 h ILE 2052Ca -0.05 -0.10 -0.08 0.00 1.00 0.00 0.00 64.86 65.63 1nd6 h ILE 2052Cb 0.48 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1nd6 h ILE 2052CO 0.08 0.05 -0.04 -0.09 0.00 0.00 0.00 178.15 178.15 1nd6 h ARG 2053N 0.30 0.82 -0.07 2.37 2.43 -0.77 -1.44 114.38 118.03 1nd6 h ARG 2053Ca 0.37 -0.28 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1nd6 h ARG 2053Cb 1.02 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1nd6 h ARG 2053CO -0.10 0.90 -0.07 0.87 -1.51 0.00 0.00 179.97 180.06 1nd6 h LYS 2054N 0.66 0.17 -0.60 0.20 1.57 -0.23 -2.24 116.57 116.10 1nd6 h LYS 2054Ca 0.12 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1nd6 h LYS 2054Cb 0.56 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 1nd6 h LYS 2054CO 0.03 0.62 0.40 -0.09 -0.57 0.00 0.00 179.45 179.84 1nd6 h ARG 2055N -0.27 0.78 -0.51 3.15 2.43 -1.05 -2.66 114.38 116.26 1nd6 h ARG 2055Ca 0.01 -0.05 -0.21 0.00 -0.81 0.00 0.00 59.98 58.92 1nd6 h ARG 2055Cb 0.59 -0.18 -0.13 0.00 -0.42 0.00 0.00 29.97 29.83 1nd6 h ARG 2055CO 0.02 0.52 0.13 0.66 -1.51 0.00 0.00 179.97 179.78 1nd6 n TYR 2056N -4.45 1.63 -0.30 2.20 0.53 -0.54 -4.77 117.16 111.45 1nd6 n TYR 2056Ca 0.06 -1.45 -0.03 0.00 -1.02 0.00 0.00 57.90 55.46 1nd6 n TYR 2056Cb 0.06 -0.57 0.02 0.00 -1.03 0.00 0.00 39.34 37.82 1nd6 n TYR 2056CO 0.00 0.00 0.00 -0.09 -1.02 0.00 0.00 176.86 175.75 1nd6 h ARG 2057N 1.40 -0.07 0.00 -0.72 9.65 -1.03 0.18 114.38 123.79 1nd6 h ARG 2057Ca 0.26 0.00 -0.23 0.00 -1.10 0.00 0.00 59.98 58.92 1nd6 h ARG 2057Cb 1.95 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 30.51 1nd6 h ARG 2057CO 0.54 -0.05 -1.16 0.87 2.80 0.00 0.00 179.97 182.97 1nd6 h LYS 2058N -0.07 0.00 -0.04 0.20 1.57 -1.86 -3.10 116.57 113.26 1nd6 h LYS 2058Ca 0.29 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.06 1nd6 h LYS 2058Cb 0.58 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 1nd6 h LYS 2058CO -0.85 0.87 -0.01 0.35 -0.57 0.00 0.00 179.45 179.23 1nd6 h PHE 2059N 0.00 0.09 -0.88 -1.35 3.57 -1.70 -3.02 116.94 113.65 1nd6 h PHE 2059Ca -0.08 -0.02 -0.55 0.00 3.53 0.00 0.00 57.97 60.85 1nd6 h PHE 2059Cb 1.82 -0.02 -0.23 0.00 2.79 0.00 0.00 35.95 40.31 1nd6 h PHE 2059CO 0.00 0.45 0.71 1.28 -2.23 0.00 0.00 178.31 178.52 1nd6 n LEU 2060N -4.84 7.21 0.33 0.59 4.32 0.55 -4.66 117.00 120.50 1nd6 n LEU 2060Ca -0.07 -3.97 0.20 0.00 -0.02 0.00 0.00 56.01 52.15 1nd6 n LEU 2060Cb 0.23 -1.03 1.09 0.00 -1.62 0.00 0.00 43.42 42.09 1nd6 n LEU 2060CO 0.34 1.42 1.17 -0.55 -1.22 0.00 0.00 177.39 178.55 1nd6 h ASN 2061N 1.93 0.00 -1.98 -1.43 -0.00 -1.44 -3.42 115.58 109.24 1nd6 h ASN 2061Ca 0.49 0.00 -0.43 0.00 -0.00 0.00 0.00 56.30 56.35 1nd6 h ASN 2061Cb 0.79 0.00 0.03 0.00 -0.00 0.00 0.00 38.32 39.14 1nd6 h ASN 2061CO 1.26 0.00 -0.18 -1.61 -0.00 0.00 0.00 177.43 176.90 1nd6 s GLU 2062N -4.22 2.81 0.43 4.14 2.02 -1.26 -5.06 118.70 117.56 1nd6 s GLU 2062Ca -0.05 -0.98 -0.07 0.00 0.02 0.00 0.00 54.97 53.89 1nd6 s GLU 2062Cb 0.13 -2.66 0.11 0.00 0.10 0.00 0.00 34.13 31.80 1nd6 s GLU 2062CO 0.41 -0.36 0.39 0.43 0.02 0.00 0.00 175.26 176.15 1nd6 n SER 2063N -2.00 -1.35 -4.75 -0.19 7.64 -1.26 -4.95 113.62 106.76 1nd6 n SER 2063Ca 0.06 -0.74 -0.41 0.00 1.01 0.00 0.00 58.87 58.79 1nd6 n SER 2063Cb 0.59 -0.35 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 1nd6 n SER 2063CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1nd6 s TYR 2064N -1.71 3.22 -0.13 1.43 5.04 -1.26 -5.01 117.35 118.93 1nd6 s TYR 2064Ca 0.25 1.37 -0.05 0.00 -2.44 0.00 0.00 57.07 56.19 1nd6 s TYR 2064Cb -0.02 -3.59 0.06 0.00 0.35 0.00 0.00 41.96 38.76 1nd6 s TYR 2064CO 0.19 -1.68 0.28 0.15 -1.34 0.00 0.00 175.55 173.15 1nd6 s LYS 2065N -0.97 0.18 0.26 4.97 1.02 -1.26 -5.06 119.74 118.88 1nd6 s LYS 2065Ca 0.52 0.75 -0.01 0.00 0.02 0.00 0.00 55.97 57.25 1nd6 s LYS 2065Cb -0.37 -0.00 0.55 0.00 -0.52 0.00 0.00 37.83 37.49 1nd6 s LYS 2065CO 0.44 -0.26 1.72 1.12 -0.92 0.00 0.00 175.35 177.45 1nd6 h HIS 2066N 8.10 0.56 0.00 3.18 2.07 -1.95 0.27 115.15 127.37 1nd6 h HIS 2066Ca -0.18 0.04 0.00 0.00 -2.85 0.00 0.00 60.37 57.37 1nd6 h HIS 2066Cb 1.12 -0.12 0.00 0.00 2.57 0.00 0.00 27.41 30.98 1nd6 h HIS 2066CO 0.36 0.02 0.00 -0.85 -3.07 0.00 0.00 177.93 174.39 1nd6 n GLU 2067N -5.02 0.06 -0.02 5.12 0.00 -1.26 -2.76 120.64 116.75 1nd6 n GLU 2067Ca 0.17 0.41 0.02 0.00 0.00 0.00 0.00 57.16 57.76 1nd6 n GLU 2067Cb 0.50 -1.64 -0.08 0.00 0.00 0.00 0.00 31.44 30.22 1nd6 n GLU 2067CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1nd6 n GLN 2068N -1.75 1.05 -4.31 3.44 6.02 0.78 -4.00 117.38 118.60 1nd6 n GLN 2068Ca 0.01 -0.07 -0.19 0.00 -0.01 0.00 0.00 57.00 56.75 1nd6 n GLN 2068Cb 0.11 -1.26 -0.15 0.00 1.02 0.00 0.00 30.24 29.96 1nd6 n GLN 2068CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1nd6 s VAL 2069N -2.58 0.66 -0.04 5.09 1.01 -0.18 -0.11 120.40 124.25 1nd6 s VAL 2069Ca -0.04 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.65 1nd6 s VAL 2069Cb 0.06 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.86 1nd6 s VAL 2069CO 0.44 0.21 -0.09 -0.47 0.00 0.00 0.00 175.10 175.18 1nd6 s TYR 2070N 0.12 1.07 -0.11 5.22 5.04 -0.35 -4.52 117.35 123.81 1nd6 s TYR 2070Ca -0.02 -0.31 0.02 0.00 -2.44 0.00 0.00 57.07 54.33 1nd6 s TYR 2070Cb -0.07 -0.78 0.01 0.00 0.35 0.00 0.00 41.96 41.47 1nd6 s TYR 2070CO 0.00 -0.15 -0.17 0.42 -1.34 0.00 0.00 175.55 174.30 1nd6 s ILE 2071N 0.39 1.66 0.11 3.14 1.09 -1.26 -0.89 121.20 125.45 1nd6 s ILE 2071Ca -0.07 -0.75 0.09 0.00 -1.10 0.00 0.00 60.65 58.82 1nd6 s ILE 2071Cb -0.11 -1.50 -0.04 0.00 -1.06 0.00 0.00 42.46 39.75 1nd6 s ILE 2071CO 0.01 0.47 -0.21 -0.60 -0.10 0.00 0.00 174.94 174.51 1nd6 s ARG 2072N 0.87 1.18 0.11 2.79 3.52 0.56 -1.33 118.95 126.65 1nd6 s ARG 2072Ca -0.08 -1.22 -0.12 0.00 -0.13 0.00 0.00 55.73 54.18 1nd6 s ARG 2072Cb -0.15 -1.45 0.02 0.00 -1.56 0.00 0.00 34.95 31.81 1nd6 s ARG 2072CO -0.00 0.33 0.30 0.45 -0.81 0.00 0.00 175.30 175.57 1nd6 s SER 2073N -2.02 -0.06 0.57 -2.12 0.15 -0.20 -0.58 113.70 109.44 1nd6 s SER 2073Ca 0.08 -0.49 -0.16 0.00 0.70 0.00 0.00 55.95 56.08 1nd6 s SER 2073Cb -0.09 0.41 -0.05 0.00 -1.71 0.00 0.00 66.02 64.57 1nd6 s SER 2073CO 0.05 -0.80 1.04 0.42 1.20 0.00 0.00 173.24 175.15 1nd6 s THR 2074N -3.84 4.03 -1.51 6.45 -4.23 -0.97 -4.08 115.64 111.50 1nd6 s THR 2074Ca 0.04 0.97 -0.12 0.00 -1.18 0.00 0.00 61.69 61.40 1nd6 s THR 2074Cb 0.03 -3.49 0.00 0.00 1.34 0.00 0.00 72.50 70.39 1nd6 s THR 2074CO -0.11 -0.56 2.48 -0.67 -0.54 0.00 0.00 174.62 175.22 1nd6 n ASP 2075N -1.87 5.80 -3.88 3.99 2.03 -1.23 -4.31 116.55 117.09 1nd6 n ASP 2075Ca 0.08 -2.77 -0.20 0.00 0.52 0.00 0.00 54.79 52.42 1nd6 n ASP 2075Cb 0.53 -1.61 -0.16 0.00 -0.72 0.00 0.00 41.12 39.16 1nd6 n ASP 2075CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1nd6 s VAL 2076N 2.55 0.49 0.26 5.18 1.01 -1.26 -4.78 120.40 123.85 1nd6 s VAL 2076Ca 0.55 -0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.39 1nd6 s VAL 2076Cb 0.15 -0.53 0.32 0.00 0.00 0.00 0.00 36.38 36.32 1nd6 s VAL 2076CO -0.07 0.22 1.62 0.44 0.00 0.00 0.00 175.10 177.30 1nd6 h ASP 2077N 7.28 -0.45 0.10 3.32 3.45 -1.91 0.13 116.42 128.33 1nd6 h ASP 2077Ca -0.37 0.22 -0.03 0.00 0.43 0.00 0.00 57.03 57.28 1nd6 h ASP 2077Cb 1.15 0.40 -0.01 0.00 -0.56 0.00 0.00 39.33 40.31 1nd6 h ASP 2077CO 0.45 -0.23 -0.13 0.08 -1.57 0.00 0.00 179.24 177.85 1nd6 h ARG 2078N 0.07 0.07 0.16 3.56 0.11 -1.96 0.59 114.38 116.97 1nd6 h ARG 2078Ca 0.45 -0.01 -0.24 0.00 0.10 0.00 0.00 59.98 60.28 1nd6 h ARG 2078Cb 0.80 -0.01 0.02 0.00 1.11 0.00 0.00 29.97 31.88 1nd6 h ARG 2078CO -0.75 0.20 -1.09 1.79 0.10 0.00 0.00 179.97 180.22 1nd6 h THR 2079N 0.07 1.35 -0.46 0.08 1.35 -1.10 -1.87 112.91 112.32 1nd6 h THR 2079Ca 0.01 -2.53 0.00 0.00 -0.55 0.00 0.00 66.41 63.34 1nd6 h THR 2079Cb 0.27 3.06 -0.02 0.00 -1.73 0.00 0.00 68.15 69.72 1nd6 h THR 2079CO 0.02 0.73 0.29 -0.07 -0.25 0.00 0.00 175.52 176.24 1nd6 h LEU 2080N -0.26 0.55 -0.45 3.87 3.38 -1.12 -1.30 115.31 119.98 1nd6 h LEU 2080Ca -0.20 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1nd6 h LEU 2080Cb 1.77 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.37 1nd6 h LEU 2080CO 0.15 0.42 0.23 0.24 0.09 0.00 0.00 178.44 179.57 1nd6 h MET 2081N 0.62 0.64 -1.00 1.13 2.86 -0.97 -1.97 114.93 116.24 1nd6 h MET 2081Ca 0.17 -0.09 0.05 0.00 -2.06 0.00 0.00 59.70 57.77 1nd6 h MET 2081Cb -0.03 -0.12 -0.06 0.00 0.06 0.00 0.00 31.60 31.45 1nd6 h MET 2081CO -0.03 0.53 0.66 0.77 1.06 0.00 0.00 176.91 179.89 1nd6 h SER 2082N 0.58 1.08 -0.04 1.22 0.02 -0.97 0.24 113.55 115.69 1nd6 h SER 2082Ca 0.16 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1nd6 h SER 2082Cb 0.10 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 1nd6 h SER 2082CO -0.02 0.72 -0.00 0.00 -1.14 0.00 0.00 176.83 176.39 1nd6 h ALA 2083N 1.43 0.05 -0.58 3.77 0.00 -0.91 -0.71 119.26 122.30 1nd6 h ALA 2083Ca 0.41 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 1nd6 h ALA 2083Cb 0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1nd6 h ALA 2083CO -0.14 -0.28 0.16 0.52 0.00 0.00 0.00 179.25 179.51 1nd6 h MET 2084N -0.24 0.89 -0.33 0.00 2.86 -1.09 0.15 114.93 117.16 1nd6 h MET 2084Ca 0.01 -0.18 -0.09 0.00 -2.06 0.00 0.00 59.70 57.38 1nd6 h MET 2084Cb 0.34 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1nd6 h MET 2084CO 0.00 0.78 -0.16 1.15 1.06 0.00 0.00 176.91 179.75 1nd6 h THR 2085N 0.86 1.25 -0.14 2.22 2.02 -0.88 -1.54 112.91 116.70 1nd6 h THR 2085Ca 0.19 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.20 1nd6 h THR 2085Cb 0.28 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1nd6 h THR 2085CO -0.00 0.38 0.02 -1.13 0.37 0.00 0.00 175.52 175.15 1nd6 h ASN 2086N 0.54 0.22 0.11 4.18 -0.73 -0.14 -3.09 115.58 116.67 1nd6 h ASN 2086Ca 0.09 -0.27 -0.06 0.00 1.87 0.00 0.00 56.30 57.93 1nd6 h ASN 2086Cb 0.58 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 39.10 1nd6 h ASN 2086CO 0.04 0.44 -0.20 -0.07 -0.37 0.00 0.00 177.43 177.26 1nd6 h LEU 2087N 0.00 0.18 -2.07 0.34 3.38 -0.56 -1.06 115.31 115.52 1nd6 h LEU 2087Ca 0.04 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1nd6 h LEU 2087Cb 0.31 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1nd6 h LEU 2087CO 0.00 0.40 0.06 0.00 0.09 0.00 0.00 178.44 178.99 1nd6 h ALA 2088N 1.62 2.00 0.03 1.53 0.00 -1.20 0.11 119.26 123.36 1nd6 h ALA 2088Ca 0.03 -0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.57 1nd6 h ALA 2088Cb 0.47 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 1nd6 h ALA 2088CO 0.03 -0.10 -2.27 0.00 0.00 0.00 0.00 179.25 176.91 1nd6 n ALA 2089N -2.52 1.33 0.02 0.00 0.00 -1.01 -3.93 120.51 114.40 1nd6 n ALA 2089Ca -0.01 -1.00 -0.12 0.00 0.00 0.00 0.00 53.44 52.31 1nd6 n ALA 2089Cb 0.17 -0.33 -0.07 0.00 0.00 0.00 0.00 19.45 19.22 1nd6 n ALA 2089CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1nd6 h LEU 2090N 0.02 0.03 -5.92 0.00 6.46 -0.81 -3.35 115.31 111.74 1nd6 h LEU 2090Ca -0.51 -0.13 -0.60 0.00 -0.12 0.00 0.00 57.88 56.52 1nd6 h LEU 2090Cb 2.01 -0.01 -0.42 0.00 -0.73 0.00 0.00 40.66 41.52 1nd6 h LEU 2090CO -0.01 0.15 -0.56 0.49 -0.62 0.00 0.00 178.44 177.89 1nd6 n PHE 2091N -5.01 3.76 -2.14 1.25 3.01 -0.01 -4.82 117.46 113.50 1nd6 n PHE 2091Ca -0.07 -4.06 -0.36 0.00 1.01 0.00 0.00 57.45 53.97 1nd6 n PHE 2091Cb 0.09 -0.56 0.01 0.00 -0.01 0.00 0.00 39.48 39.01 1nd6 n PHE 2091CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1nd6 s PRO 2092N -2.83 3.30 0.07 -1.08 0.04 -1.25 -4.74 135.00 128.50 1nd6 s PRO 2092Ca 0.43 1.77 -0.30 0.00 0.04 0.00 0.00 61.00 62.94 1nd6 s PRO 2092Cb 0.19 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.59 1nd6 s PRO 2092CO -0.05 -0.93 1.03 -1.25 0.04 0.00 0.00 177.00 175.83 1nd6 s PRO 2093N -3.14 4.59 -0.01 0.56 0.04 -1.26 -4.99 135.00 130.79 1nd6 s PRO 2093Ca 0.72 1.53 -0.08 0.00 0.04 0.00 0.00 61.00 63.21 1nd6 s PRO 2093Cb -0.28 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 30.87 1nd6 s PRO 2093CO 0.32 0.01 0.16 -1.83 0.04 0.00 0.00 177.00 175.70 1nd6 s GLU 2094N 0.52 0.47 3.85 4.56 -1.05 -1.26 -4.70 118.70 121.08 1nd6 s GLU 2094Ca 0.51 -0.31 0.00 0.00 -0.15 0.00 0.00 54.97 55.02 1nd6 s GLU 2094Cb -0.24 0.20 0.00 0.00 -0.44 0.00 0.00 34.13 33.65 1nd6 s GLU 2094CO 0.30 -0.11 0.00 0.41 0.95 0.00 0.00 175.26 176.81 1nd6 n GLY 2095N 1.61 0.25 0.01 -3.83 0.00 -1.26 -3.36 105.19 98.61 1nd6 n GLY 2095Ca -0.22 -0.96 0.08 0.00 0.00 0.00 0.00 46.02 44.92 1nd6 n GLY 2095CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1nd6 n VAL 2096N 0.00 0.97 1.67 1.61 3.14 -1.26 -2.56 118.33 121.90 1nd6 n VAL 2096Ca 0.00 0.24 0.15 0.00 -2.96 0.00 0.00 64.34 61.77 1nd6 n VAL 2096Cb 0.00 -1.01 0.71 0.00 -1.06 0.00 0.00 33.84 32.48 1nd6 n VAL 2096CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1nd6 n SER 2097N -1.57 0.68 -4.51 6.55 3.41 -1.21 -4.68 113.62 112.27 1nd6 n SER 2097Ca 0.03 -1.08 -0.42 0.00 -0.26 0.00 0.00 58.87 57.14 1nd6 n SER 2097Cb 0.18 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 1nd6 n SER 2097CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1nd6 s ILE 2098N -2.12 4.03 -0.04 -1.33 1.01 -1.06 -4.69 121.20 117.00 1nd6 s ILE 2098Ca 0.39 0.14 0.12 0.00 0.00 0.00 0.00 60.65 61.30 1nd6 s ILE 2098Cb 0.21 -4.78 -0.04 0.00 0.01 0.00 0.00 42.46 37.86 1nd6 s ILE 2098CO 0.38 -1.61 1.39 4.11 0.00 0.00 0.00 174.94 179.22 1nd6 h TRP 2099N 9.76 0.00 -3.46 3.97 5.08 -1.86 -3.42 115.95 126.02 1nd6 h TRP 2099Ca -0.28 0.00 -0.61 0.00 1.08 0.00 0.00 58.89 59.08 1nd6 h TRP 2099Cb 1.06 0.00 -0.39 0.00 -3.00 0.00 0.00 29.16 26.83 1nd6 h TRP 2099CO 1.04 0.69 -0.76 1.21 -1.28 0.00 0.00 178.44 179.35 1nd6 s ASN 2100N -6.56 4.15 0.35 0.11 3.84 -1.26 -5.03 114.94 110.54 1nd6 s ASN 2100Ca 0.03 -1.62 0.13 0.00 0.21 0.00 0.00 52.86 51.61 1nd6 s ASN 2100Cb 0.09 -1.17 0.96 0.00 -0.55 0.00 0.00 41.25 40.57 1nd6 s ASN 2100CO 0.77 -0.35 1.75 -0.65 -2.79 0.00 0.00 177.10 175.84 1nd6 h PRO 2101N 7.91 0.51 -0.58 0.43 0.11 -2.00 -1.82 132.00 136.56 1nd6 h PRO 2101Ca -0.12 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.96 1nd6 h PRO 2101Cb 1.04 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1nd6 h PRO 2101CO 0.46 0.33 0.00 0.44 -0.21 0.00 0.00 178.00 179.03 1nd6 n ILE 2102N -4.77 0.77 -3.41 4.15 -5.35 -1.26 -4.65 119.36 104.83 1nd6 n ILE 2102Ca 0.26 -0.80 -0.23 0.00 -0.27 0.00 0.00 62.75 61.71 1nd6 n ILE 2102Cb 0.78 0.47 -0.10 0.00 -1.74 0.00 0.00 39.64 39.05 1nd6 n ILE 2102CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1nd6 s LEU 2103N -1.07 0.43 -1.05 7.28 2.96 -0.68 -5.06 118.68 121.48 1nd6 s LEU 2103Ca 0.41 -1.82 -0.21 0.00 -0.22 0.00 0.00 54.13 52.29 1nd6 s LEU 2103Cb 0.21 0.08 -0.08 0.00 0.50 0.00 0.00 46.19 46.90 1nd6 s LEU 2103CO 0.28 -0.29 1.95 0.18 -1.32 0.00 0.00 176.35 177.15 1nd6 n LEU 2104N 4.22 4.33 -3.62 -0.68 4.77 -1.26 -4.54 117.00 120.23 1nd6 n LEU 2104Ca 0.10 -3.28 -0.13 0.00 -0.03 0.00 0.00 56.01 52.68 1nd6 n LEU 2104Cb 0.41 -1.44 -0.06 0.00 -2.33 0.00 0.00 43.42 40.01 1nd6 n LEU 2104CO 0.11 -0.48 0.21 0.86 -1.33 0.00 0.00 177.39 176.76 1nd6 s TRP 2105N 6.29 -0.33 -0.01 -1.77 -0.00 -1.26 -4.43 118.94 117.44 1nd6 s TRP 2105Ca 0.58 0.30 -0.04 0.00 -0.00 0.00 0.00 56.10 56.94 1nd6 s TRP 2105Cb 0.09 0.28 -0.00 0.00 -0.00 0.00 0.00 33.47 33.84 1nd6 s TRP 2105CO 0.09 -0.62 0.09 1.14 -0.00 0.00 0.00 176.95 177.65 1nd6 s GLN 2106N -2.61 0.32 0.22 5.86 -2.07 -1.26 -4.78 119.66 115.33 1nd6 s GLN 2106Ca -0.04 -0.25 -0.30 0.00 -1.82 0.00 0.00 55.36 52.95 1nd6 s GLN 2106Cb -0.00 0.13 -0.09 0.00 -1.09 0.00 0.00 33.01 31.96 1nd6 s GLN 2106CO -0.03 -0.06 1.27 -1.25 -1.32 0.00 0.00 175.29 173.90 1nd6 s PRO 2107N -0.88 4.42 -0.07 9.60 0.04 -1.26 -4.97 135.00 141.88 1nd6 s PRO 2107Ca -0.10 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 1nd6 s PRO 2107Cb -0.06 -3.19 0.03 0.00 0.04 0.00 0.00 34.50 31.33 1nd6 s PRO 2107CO 0.00 -0.18 0.01 0.42 0.04 0.00 0.00 177.00 177.29 1nd6 s ILE 2108N -0.17 0.34 0.32 0.56 1.01 -1.26 -5.13 121.20 116.87 1nd6 s ILE 2108Ca 0.54 0.12 -0.29 0.00 0.00 0.00 0.00 60.65 61.01 1nd6 s ILE 2108Cb -0.36 -0.52 -0.11 0.00 0.01 0.00 0.00 42.46 41.48 1nd6 s ILE 2108CO 0.40 0.23 1.56 -2.16 0.00 0.00 0.00 174.94 174.97 1nd6 s PRO 2109N 1.99 4.12 -0.32 2.79 0.04 -1.26 -5.00 135.00 137.36 1nd6 s PRO 2109Ca 0.05 2.57 0.03 0.00 0.04 0.00 0.00 61.00 63.69 1nd6 s PRO 2109Cb -0.12 -3.01 0.09 0.00 0.04 0.00 0.00 34.50 31.50 1nd6 s PRO 2109CO -0.05 -0.60 0.04 0.08 0.04 0.00 0.00 177.00 176.51 1nd6 s VAL 2110N -0.35 1.99 0.47 -0.36 1.01 -1.26 -4.45 120.40 117.45 1nd6 s VAL 2110Ca 0.60 -2.07 -0.21 0.00 0.00 0.00 0.00 61.98 60.30 1nd6 s VAL 2110Cb -0.47 -2.44 -0.08 0.00 0.00 0.00 0.00 36.38 33.39 1nd6 s VAL 2110CO 0.53 -0.54 1.06 -1.00 0.00 0.00 0.00 175.10 175.15 1nd6 s HIS 2111N 1.06 3.00 0.31 5.22 3.76 -0.44 -4.87 115.29 123.33 1nd6 s HIS 2111Ca 0.08 1.58 -0.14 0.00 -0.15 0.00 0.00 55.06 56.43 1nd6 s HIS 2111Cb -0.19 -3.14 0.02 0.00 1.11 0.00 0.00 32.58 30.38 1nd6 s HIS 2111CO -0.11 -0.95 0.63 -0.08 -0.85 0.00 0.00 174.74 173.39 1nd6 s THR 2112N -1.84 0.00 0.00 1.30 -1.32 -1.26 -1.04 115.64 111.48 1nd6 s THR 2112Ca 0.66 -1.21 -0.01 0.00 -1.21 0.00 0.00 61.69 59.91 1nd6 s THR 2112Cb -0.20 -2.38 -0.01 0.00 -1.51 0.00 0.00 72.50 68.41 1nd6 s THR 2112CO 0.24 0.00 0.02 -0.69 -2.21 0.00 0.00 174.62 171.98 1nd6 s VAL 2113N -3.42 0.05 0.60 5.08 1.01 -1.26 -5.02 120.40 117.43 1nd6 s VAL 2113Ca 0.18 -0.41 -0.20 0.00 0.00 0.00 0.00 61.98 61.55 1nd6 s VAL 2113Cb -0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 1nd6 s VAL 2113CO 0.11 -0.23 1.32 -2.16 0.00 0.00 0.00 175.10 174.14 1nd6 s PRO 2114N -0.68 2.86 0.15 2.72 0.04 -1.26 -3.52 135.00 135.31 1nd6 s PRO 2114Ca -0.08 2.13 -0.29 0.00 0.04 0.00 0.00 61.00 62.81 1nd6 s PRO 2114Cb -0.05 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1nd6 s PRO 2114CO -0.00 -1.38 1.56 -0.07 0.04 0.00 0.00 177.00 177.15 1nd6 h LEU 2115N 1.00 -1.59 -1.54 -3.56 3.38 -1.96 -0.28 115.31 110.75 1nd6 h LEU 2115Ca -0.51 0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1nd6 h LEU 2115Cb 1.32 0.68 0.00 0.00 0.09 0.00 0.00 40.66 42.75 1nd6 h LEU 2115CO 0.55 -0.38 0.19 0.77 0.09 0.00 0.00 178.44 179.66 1nd6 h SER 2116N -0.34 0.00 -0.05 -0.43 4.64 -2.00 -0.11 113.55 115.25 1nd6 h SER 2116Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1nd6 h SER 2116Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1nd6 h SER 2116CO -0.60 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 174.74 1nd6 n GLU 2117N -2.43 0.62 -2.25 4.77 1.02 -0.23 -4.97 120.64 117.17 1nd6 n GLU 2117Ca -0.02 -1.12 -0.42 0.00 -0.02 0.00 0.00 57.16 55.58 1nd6 n GLU 2117Cb 0.22 -1.14 -0.03 0.00 -0.02 0.00 0.00 31.44 30.48 1nd6 n GLU 2117CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1nd6 s ASP 2118N -0.67 6.06 -0.65 1.62 -1.08 -0.06 -4.88 116.67 117.02 1nd6 s ASP 2118Ca 0.09 0.71 -0.01 0.00 -0.52 0.00 0.00 52.55 52.83 1nd6 s ASP 2118Cb 0.06 -2.54 0.43 0.00 -1.46 0.00 0.00 42.92 39.42 1nd6 s ASP 2118CO 0.09 -1.68 1.90 0.00 0.52 0.00 0.00 175.17 176.00 1nd6 n GLN 2119N 8.45 2.84 0.13 4.34 6.02 -1.26 -4.53 117.38 133.37 1nd6 n GLN 2119Ca 0.17 -3.49 0.00 0.00 -0.01 0.00 0.00 57.00 53.67 1nd6 n GLN 2119Cb 0.49 -2.28 0.00 0.00 1.02 0.00 0.00 30.24 29.46 1nd6 n GLN 2119CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1nd6 n LEU 2120N -0.81 -2.36 -0.03 1.08 7.94 -1.26 -4.98 117.00 116.59 1nd6 n LEU 2120Ca 0.58 0.51 0.03 0.00 -1.11 0.00 0.00 56.01 56.03 1nd6 n LEU 2120Cb 0.62 2.41 -0.12 0.00 0.53 0.00 0.00 43.42 46.85 1nd6 n LEU 2120CO 0.68 -0.06 -0.77 0.18 -1.11 0.00 0.00 177.39 176.31 1nd6 n LEU 2121N -3.04 0.00 -3.68 -1.96 4.77 -1.26 -4.57 117.00 107.25 1nd6 n LEU 2121Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1nd6 n LEU 2121Cb 0.00 0.11 -0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1nd6 n LEU 2121CO 0.00 0.11 2.71 0.00 -1.33 0.00 0.00 177.39 178.88 1nd6 n TYR 2122N -2.19 3.32 -2.99 -1.77 -0.00 -1.26 -4.64 117.16 107.62 1nd6 n TYR 2122Ca -0.09 -2.97 -0.34 0.00 -0.00 0.00 0.00 57.90 54.50 1nd6 n TYR 2122Cb 0.58 -2.48 -0.06 0.00 -0.00 0.00 0.00 39.34 37.37 1nd6 n TYR 2122CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1nd6 s LEU 2123N 1.63 4.10 0.32 2.98 1.02 -1.26 -4.04 118.68 123.44 1nd6 s LEU 2123Ca 0.49 1.49 -0.20 0.00 0.02 0.00 0.00 54.13 55.94 1nd6 s LEU 2123Cb 0.14 -4.13 -0.09 0.00 0.02 0.00 0.00 46.19 42.12 1nd6 s LEU 2123CO -0.08 -0.20 0.82 -2.16 0.02 0.00 0.00 176.35 174.76 1nd6 s PRO 2124N -2.77 4.23 0.26 1.29 0.04 -1.26 -4.59 135.00 132.20 1nd6 s PRO 2124Ca 0.54 0.95 -0.29 0.00 0.04 0.00 0.00 61.00 62.24 1nd6 s PRO 2124Cb -0.12 -2.56 -0.09 0.00 0.04 0.00 0.00 34.50 31.77 1nd6 s PRO 2124CO 0.17 0.20 1.18 -0.06 0.04 0.00 0.00 177.00 178.54 1nd6 s PHE 2125N -1.84 3.41 -0.51 0.56 0.08 -1.26 -4.94 117.98 113.49 1nd6 s PHE 2125Ca 0.52 1.54 0.04 0.00 0.12 0.00 0.00 56.93 59.15 1nd6 s PHE 2125Cb -0.13 -3.43 0.03 0.00 -0.57 0.00 0.00 43.02 38.92 1nd6 s PHE 2125CO 0.19 -1.08 0.63 0.54 -0.10 0.00 0.00 175.22 175.39 1nd6 n ARG 2126N 1.57 -0.42 -1.82 0.44 1.74 -1.26 -4.64 116.66 112.26 1nd6 n ARG 2126Ca 0.01 -0.74 -0.35 0.00 -0.77 0.00 0.00 57.85 56.00 1nd6 n ARG 2126Cb 0.44 -1.08 -0.00 0.00 -1.02 0.00 0.00 32.46 30.80 1nd6 n ARG 2126CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1nd6 n ASN 2127N 0.23 7.15 -3.49 0.55 2.04 -1.26 -4.77 115.26 115.70 1nd6 n ASN 2127Ca 0.02 -3.55 -0.29 0.00 -0.44 0.00 0.00 54.58 50.33 1nd6 n ASN 2127Cb 0.10 -1.16 -0.13 0.00 -2.53 0.00 0.00 39.78 36.06 1nd6 n ASN 2127CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nd6 h PRO 2129N 7.68 -0.07 -0.74 0.00 0.11 -1.81 -0.57 132.00 136.60 1nd6 h PRO 2129Ca -0.06 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.11 1nd6 h PRO 2129Cb 0.99 0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.07 1nd6 h PRO 2129CO 0.34 -0.05 0.49 -0.09 -0.21 0.00 0.00 178.00 178.48 1nd6 h ARG 2130N -0.07 0.80 -0.47 1.05 9.65 -1.27 -1.91 114.38 122.15 1nd6 h ARG 2130Ca 0.30 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 59.09 1nd6 h ARG 2130Cb 0.55 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 28.93 1nd6 h ARG 2130CO -0.73 0.53 0.14 0.35 2.80 0.00 0.00 179.97 183.05 1nd6 h PHE 2131N 0.82 0.77 -0.54 2.20 3.57 -1.38 -0.42 116.94 121.97 1nd6 h PHE 2131Ca 0.31 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.75 1nd6 h PHE 2131Cb 0.19 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 1nd6 h PHE 2131CO -0.00 0.69 0.33 1.96 -2.23 0.00 0.00 178.31 179.05 1nd6 h GLN 2132N 0.63 0.63 -0.62 1.11 1.08 -1.08 0.16 115.11 117.02 1nd6 h GLN 2132Ca 0.15 -0.04 0.06 0.00 -1.45 0.00 0.00 58.65 57.37 1nd6 h GLN 2132Cb 0.29 -0.14 -0.05 0.00 -0.05 0.00 0.00 27.48 27.52 1nd6 h GLN 2132CO -0.00 0.42 0.33 0.93 -0.95 0.00 0.00 178.83 179.55 1nd6 h GLU 2133N 0.65 0.60 -0.38 1.46 5.08 -1.03 0.55 114.58 121.51 1nd6 h GLU 2133Ca 0.21 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1nd6 h GLU 2133Cb 0.01 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1nd6 h GLU 2133CO -0.09 0.40 0.18 -0.07 -1.00 0.00 0.00 179.01 178.43 1nd6 h LEU 2134N 0.62 0.47 0.26 1.33 3.38 0.43 -0.34 115.31 121.45 1nd6 h LEU 2134Ca 0.28 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1nd6 h LEU 2134Cb 0.17 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1nd6 h LEU 2134CO -0.18 0.40 -0.13 -0.33 0.09 0.00 0.00 178.44 178.30 1nd6 h GLU 2135N 0.53 -0.34 -0.59 1.13 5.08 0.14 -0.82 114.58 119.70 1nd6 h GLU 2135Ca 0.13 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1nd6 h GLU 2135Cb 0.06 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1nd6 h GLU 2135CO -0.02 -0.07 0.39 0.66 -1.00 0.00 0.00 179.01 178.97 1nd6 h SER 2136N -0.59 0.65 -0.12 1.42 4.64 -0.74 -1.10 113.55 117.72 1nd6 h SER 2136Ca -0.04 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.14 1nd6 h SER 2136Cb 0.43 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 1nd6 h SER 2136CO 0.06 0.46 -0.35 -0.33 -0.87 0.00 0.00 176.83 175.81 1nd6 h GLU 2137N 0.77 0.63 -0.65 4.77 5.08 -0.92 -2.70 114.58 121.55 1nd6 h GLU 2137Ca 0.22 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1nd6 h GLU 2137Cb -0.03 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1nd6 h GLU 2137CO -0.05 0.88 0.36 1.15 -1.00 0.00 0.00 179.01 180.35 1nd6 h THR 2138N 0.53 1.19 0.00 1.13 2.02 0.12 -0.59 112.91 117.31 1nd6 h THR 2138Ca 0.06 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 1nd6 h THR 2138Cb 0.85 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1nd6 h THR 2138CO 0.07 0.21 -0.04 -0.07 0.37 0.00 0.00 175.52 176.07 1nd6 h LEU 2139N 0.90 0.00 0.00 2.58 4.07 -1.10 -2.91 115.31 118.85 1nd6 h LEU 2139Ca 0.23 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.19 1nd6 h LEU 2139Cb 0.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.76 1nd6 h LEU 2139CO -0.04 0.04 -1.25 0.29 -1.08 0.00 0.00 178.44 176.40 1nd6 n LYS 2140N -3.15 0.37 -1.43 1.13 5.02 -0.49 -4.72 118.16 114.89 1nd6 n LYS 2140Ca 0.01 -0.04 -0.34 0.00 -2.02 0.00 0.00 58.31 55.92 1nd6 n LYS 2140Cb 0.34 -1.59 0.09 0.00 -0.02 0.00 0.00 35.03 33.85 1nd6 n LYS 2140CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1nd6 s SER 2141N -4.10 4.25 0.04 4.39 1.04 -0.35 -4.93 113.70 114.05 1nd6 s SER 2141Ca 0.01 2.29 -0.18 0.00 0.48 0.00 0.00 55.95 58.56 1nd6 s SER 2141Cb 0.14 -2.58 -0.18 0.00 0.10 0.00 0.00 66.02 63.50 1nd6 s SER 2141CO 0.83 -2.22 1.23 -0.33 0.98 0.00 0.00 173.24 173.74 1nd6 h GLU 2142N -0.34 0.52 -0.77 4.02 5.08 -1.92 -2.89 114.58 118.28 1nd6 h GLU 2142Ca -0.47 -0.42 0.15 0.00 -1.00 0.00 0.00 59.36 57.61 1nd6 h GLU 2142Cb 1.29 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 30.48 1nd6 h GLU 2142CO 0.50 1.05 -0.25 1.49 -1.00 0.00 0.00 179.01 180.80 1nd6 h GLU 2143N 0.12 -0.04 0.04 2.33 4.57 -1.92 0.41 114.58 120.10 1nd6 h GLU 2143Ca -0.03 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1nd6 h GLU 2143Cb 1.14 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 1nd6 h GLU 2143CO 0.10 -0.02 -0.02 0.35 -1.18 0.00 0.00 179.01 178.24 1nd6 h PHE 2144N -0.04 -0.05 -0.11 0.92 3.57 -1.79 -2.83 116.94 116.61 1nd6 h PHE 2144Ca 0.34 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.88 1nd6 h PHE 2144Cb 0.58 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 1nd6 h PHE 2144CO -0.65 0.14 0.10 1.96 -2.23 0.00 0.00 178.31 177.63 1nd6 h GLN 2145N -0.24 0.00 0.00 1.11 1.08 -0.83 0.57 115.11 116.80 1nd6 h GLN 2145Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1nd6 h GLN 2145Cb 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1nd6 h GLN 2145CO 0.01 0.00 0.00 0.87 -0.95 0.00 0.00 178.83 178.76 1nd6 h LYS 2146N 0.00 0.00 0.00 1.46 6.56 -0.03 -2.23 116.57 122.33 1nd6 h LYS 2146Ca 0.05 0.00 -0.33 0.00 -1.06 0.00 0.00 60.65 59.32 1nd6 h LYS 2146Cb 0.25 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 31.85 1nd6 h LYS 2146CO -0.00 0.00 -2.20 0.54 -2.06 0.00 0.00 179.45 175.73 1nd6 n ARG 2147N -2.54 0.67 0.14 3.15 1.74 0.10 -4.43 116.66 115.49 1nd6 n ARG 2147Ca 0.04 0.05 -0.23 0.00 -0.77 0.00 0.00 57.85 56.93 1nd6 n ARG 2147Cb 0.37 -1.58 -0.16 0.00 -1.02 0.00 0.00 32.46 30.07 1nd6 n ARG 2147CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1nd6 h LEU 2148N 0.00 0.77 -0.87 0.55 5.85 -1.33 -3.39 115.31 116.89 1nd6 h LEU 2148Ca -0.46 -0.83 0.11 0.00 0.84 0.00 0.00 57.88 57.54 1nd6 h LEU 2148Cb 2.11 -0.25 -0.12 0.00 0.37 0.00 0.00 40.66 42.77 1nd6 h LEU 2148CO 0.04 1.66 -0.42 1.57 -0.34 0.00 0.00 178.44 180.94 1nd6 n HIS 2149N -3.68 -0.16 -0.16 1.25 -0.00 -0.84 -0.74 115.22 110.89 1nd6 n HIS 2149Ca -0.16 1.08 0.29 0.00 0.46 0.00 0.00 57.72 59.39 1nd6 n HIS 2149Cb 1.09 -0.71 0.72 0.00 -0.12 0.00 0.00 29.99 30.98 1nd6 n HIS 2149CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1nd6 h PRO 2150N 0.00 0.00 -0.01 1.57 0.11 -1.82 -0.83 132.00 131.02 1nd6 h PRO 2150Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1nd6 h PRO 2150Cb 0.45 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.56 1nd6 h PRO 2150CO -0.84 0.00 -0.45 0.66 -0.21 0.00 0.00 178.00 177.16 1nd6 n TYR 2151N -4.07 0.00 0.05 0.65 4.02 0.08 -4.43 117.16 113.46 1nd6 n TYR 2151Ca 0.18 0.00 0.21 0.00 -0.01 0.00 0.00 57.90 58.29 1nd6 n TYR 2151Cb 1.00 -0.07 0.71 0.00 -0.02 0.00 0.00 39.34 40.96 1nd6 n TYR 2151CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1nd6 h LYS 2152N 1.51 0.00 0.00 -0.72 1.57 -1.02 0.30 116.57 118.22 1nd6 h LYS 2152Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1nd6 h LYS 2152Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1nd6 h LYS 2152CO 0.00 0.00 -0.03 0.22 -0.57 0.00 0.00 179.45 179.07 1nd6 h ASP 2153N 0.00 0.02 -0.66 0.86 1.82 -1.79 -3.22 116.42 113.45 1nd6 h ASP 2153Ca 0.23 -0.90 -0.03 0.00 -0.39 0.00 0.00 57.03 55.95 1nd6 h ASP 2153Cb 1.30 -0.01 -0.03 0.00 0.68 0.00 0.00 39.33 41.27 1nd6 h ASP 2153CO -0.00 0.92 0.30 0.15 -1.61 0.00 0.00 179.24 178.99 1nd6 h PHE 2154N -0.87 0.97 -0.18 0.28 3.57 -1.32 -2.62 116.94 116.76 1nd6 h PHE 2154Ca -0.00 -0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.46 1nd6 h PHE 2154Cb 0.92 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 1nd6 h PHE 2154CO 0.24 0.74 0.13 0.82 -2.23 0.00 0.00 178.31 178.01 1nd6 h ILE 2155N 0.92 0.99 0.00 1.41 2.04 -0.62 -1.28 117.51 120.98 1nd6 h ILE 2155Ca 0.22 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 66.03 1nd6 h ILE 2155Cb 0.15 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1nd6 h ILE 2155CO -0.03 0.03 0.00 0.00 0.00 0.00 0.00 178.15 178.15 1nd6 h ALA 2156N 1.90 1.00 0.00 1.87 0.00 -1.47 -2.88 119.26 119.67 1nd6 h ALA 2156Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1nd6 h ALA 2156Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1nd6 h ALA 2156CO -0.01 0.00 -0.69 0.25 0.00 0.00 0.00 179.25 178.80 1nd6 n THR 2157N -3.01 0.25 0.22 0.00 -2.24 -0.49 -3.97 114.28 105.04 1nd6 n THR 2157Ca 0.01 -0.22 0.07 0.00 -2.27 0.00 0.00 64.05 61.64 1nd6 n THR 2157Cb 0.34 0.00 0.51 0.00 -2.10 0.00 0.00 70.33 69.09 1nd6 n THR 2157CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1nd6 h LEU 2158N 0.00 0.00 0.62 3.22 3.38 -1.43 -2.94 115.31 118.16 1nd6 h LEU 2158Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1nd6 h LEU 2158Cb 0.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1nd6 h LEU 2158CO 0.00 0.25 -0.49 1.23 0.09 0.00 0.00 178.44 179.51 1nd6 h GLY 2159N 1.05 -1.28 1.84 0.83 0.00 -1.68 -0.08 103.07 103.74 1nd6 h GLY 2159Ca -0.00 0.56 -0.05 0.00 0.00 0.00 0.00 47.33 47.84 1nd6 h GLY 2159CO 0.03 -0.40 -0.17 1.70 0.00 0.00 0.00 176.54 177.70 1nd6 h LYS 2160N -1.08 0.20 0.00 4.80 3.64 -1.81 -0.22 116.57 122.10 1nd6 h LYS 2160Ca -0.08 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.08 1nd6 h LYS 2160Cb 0.91 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.68 1nd6 h LYS 2160CO 0.01 0.38 -0.79 -0.07 -2.27 0.00 0.00 179.45 176.71 1nd6 h LEU 2161N 0.19 0.00 0.00 5.20 3.38 -1.33 -3.40 115.31 119.35 1nd6 h LEU 2161Ca 0.04 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1nd6 h LEU 2161Cb 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1nd6 h LEU 2161CO 0.03 0.79 -1.55 -1.54 0.09 0.00 0.00 178.44 176.26 1nd6 n SER 2162N -3.46 3.21 0.00 -0.43 3.41 -0.06 -4.80 113.62 111.50 1nd6 n SER 2162Ca -0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 1nd6 n SER 2162Cb 0.80 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.82 1nd6 n SER 2162CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nd6 n GLY 2163N 2.90 0.94 3.67 5.00 0.00 -0.10 -0.76 105.19 116.84 1nd6 n GLY 2163Ca -0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 1nd6 n GLY 2163CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nd6 s LEU 2164N 0.00 3.38 -0.22 0.99 1.43 -1.24 -4.80 118.68 118.21 1nd6 s LEU 2164Ca 0.00 -0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1nd6 s LEU 2164Cb 0.00 -2.09 0.10 0.00 0.03 0.00 0.00 46.19 44.23 1nd6 s LEU 2164CO 0.00 0.15 0.20 -1.00 0.23 0.00 0.00 176.35 175.93 1nd6 s HIS 2165N -1.42 -0.16 0.00 0.29 3.76 -1.26 -3.53 115.29 112.97 1nd6 s HIS 2165Ca 0.26 -0.07 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 1nd6 s HIS 2165Cb -0.11 -0.50 0.00 0.00 1.11 0.00 0.00 32.58 33.08 1nd6 s HIS 2165CO 0.18 -0.68 0.00 0.41 -0.85 0.00 0.00 174.74 173.80 1nd6 n GLY 2166N 5.30 1.45 2.16 -2.22 0.00 -1.26 -5.01 105.19 105.61 1nd6 n GLY 2166Ca -0.05 0.26 -0.05 0.00 0.00 0.00 0.00 46.02 46.18 1nd6 n GLY 2166CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1nd6 n GLN 2167N -0.03 0.97 -4.02 1.61 -0.06 -1.26 -4.76 117.38 109.83 1nd6 n GLN 2167Ca 0.00 -0.45 -0.34 0.00 -2.00 0.00 0.00 57.00 54.22 1nd6 n GLN 2167Cb 0.00 -1.68 -0.15 0.00 -4.06 0.00 0.00 30.24 24.35 1nd6 n GLN 2167CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 1nd6 s ASP 2168N 2.40 3.89 0.26 1.69 2.15 -1.26 -5.00 116.67 120.80 1nd6 s ASP 2168Ca 0.30 -0.78 0.03 0.00 0.43 0.00 0.00 52.55 52.53 1nd6 s ASP 2168Cb 0.14 -1.59 0.33 0.00 -0.30 0.00 0.00 42.92 41.49 1nd6 s ASP 2168CO 0.00 -0.07 1.64 -0.07 -0.17 0.00 0.00 175.17 176.49 1nd6 h LEU 2169N 7.97 0.40 -1.73 -1.34 3.38 -1.94 -2.65 115.31 119.40 1nd6 h LEU 2169Ca -0.37 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.38 1nd6 h LEU 2169Cb 1.12 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1nd6 h LEU 2169CO 0.59 0.79 -0.17 0.15 0.09 0.00 0.00 178.44 179.88 1nd6 h PHE 2170N 0.31 0.00 0.12 1.13 3.57 -1.93 -1.00 116.94 119.14 1nd6 h PHE 2170Ca 0.02 0.00 -0.28 0.00 3.53 0.00 0.00 57.97 61.24 1nd6 h PHE 2170Cb 0.89 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.63 1nd6 h PHE 2170CO 0.02 0.17 -1.30 0.78 -2.23 0.00 0.00 178.31 175.76 1nd6 h GLY 2171N 0.81 0.30 1.28 2.40 0.00 -1.89 -1.39 103.07 104.57 1nd6 h GLY 2171Ca -0.00 -0.76 -0.12 0.00 0.00 0.00 0.00 47.33 46.45 1nd6 h GLY 2171CO 0.02 0.67 -0.23 -2.22 0.00 0.00 0.00 176.54 174.78 1nd6 h ILE 2172N 0.07 1.27 0.13 2.60 1.08 -1.09 -0.58 117.51 120.99 1nd6 h ILE 2172Ca -0.15 -1.36 -0.01 0.00 -0.39 0.00 0.00 64.86 62.95 1nd6 h ILE 2172Cb 1.98 1.20 0.00 0.00 -3.07 0.00 0.00 36.82 36.93 1nd6 h ILE 2172CO 0.19 0.46 -0.06 -0.25 -0.69 0.00 0.00 178.15 177.80 1nd6 h TRP 2173N 0.72 -0.16 0.00 1.37 7.01 -1.26 0.37 115.95 124.00 1nd6 h TRP 2173Ca 0.10 -0.00 -0.13 0.00 2.11 0.00 0.00 58.89 60.96 1nd6 h TRP 2173Cb 0.76 0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.85 1nd6 h TRP 2173CO 0.04 0.30 -0.61 0.66 -2.79 0.00 0.00 178.44 176.04 1nd6 h SER 2174N -0.89 0.00 -0.00 2.65 4.64 -1.33 0.63 113.55 119.24 1nd6 h SER 2174Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1nd6 h SER 2174Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1nd6 h SER 2174CO 0.03 0.61 -0.53 0.29 -0.87 0.00 0.00 176.83 176.36 1nd6 n LYS 2175N -3.42 2.09 0.06 4.77 5.02 -0.23 -4.57 118.16 121.89 1nd6 n LYS 2175Ca 0.00 -0.30 0.00 0.00 -2.02 0.00 0.00 58.31 55.99 1nd6 n LYS 2175Cb 0.71 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 34.52 1nd6 n LYS 2175CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1nd6 n VAL 2176N -0.87 0.45 0.24 -0.18 0.31 -0.85 -2.46 118.33 114.97 1nd6 n VAL 2176Ca 0.04 0.15 -0.15 0.00 -0.01 0.00 0.00 64.34 64.37 1nd6 n VAL 2176Cb 0.26 -1.10 -0.08 0.00 -0.91 0.00 0.00 33.84 32.01 1nd6 n VAL 2176CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1nd6 h TYR 2177N 0.00 -0.56 -0.72 3.52 3.20 -0.15 -3.06 116.97 119.19 1nd6 h TYR 2177Ca 0.00 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 61.97 1nd6 h TYR 2177Cb 0.21 0.19 -0.08 0.00 1.54 0.00 0.00 36.73 38.58 1nd6 h TYR 2177CO 0.00 -0.26 0.33 0.22 -1.64 0.00 0.00 178.16 176.81 1nd6 h ASP 2178N -0.80 0.38 -0.14 -2.11 3.58 -1.12 -0.98 116.42 115.23 1nd6 h ASP 2178Ca -0.06 0.08 0.02 0.00 0.42 0.00 0.00 57.03 57.49 1nd6 h ASP 2178Cb 0.55 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.61 1nd6 h ASP 2178CO 0.10 0.20 0.02 -0.65 -2.88 0.00 0.00 179.24 176.03 1nd6 h PRO 2179N 0.53 0.07 -0.81 0.28 0.11 -1.80 -1.39 132.00 128.99 1nd6 h PRO 2179Ca 0.37 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.46 1nd6 h PRO 2179Cb 0.46 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.52 1nd6 h PRO 2179CO -0.32 0.04 0.46 -0.07 -0.21 0.00 0.00 178.00 177.90 1nd6 h LEU 2180N 0.07 1.00 -0.26 2.35 3.38 -1.33 -0.45 115.31 120.06 1nd6 h LEU 2180Ca 0.06 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1nd6 h LEU 2180Cb 0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1nd6 h LEU 2180CO -0.09 0.80 0.06 0.22 0.09 0.00 0.00 178.44 179.52 1nd6 h TYR 2181N 1.12 0.45 -0.02 1.13 3.20 -0.92 0.85 116.97 122.79 1nd6 h TYR 2181Ca 0.29 -0.06 0.01 0.00 3.14 0.00 0.00 58.73 62.11 1nd6 h TYR 2181Cb 0.01 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1nd6 h TYR 2181CO 0.00 0.52 -0.02 0.00 -1.64 0.00 0.00 178.16 177.02 1nd6 h GLU 2183N -0.03 0.48 -0.19 0.00 5.08 -0.90 -1.27 114.58 117.74 1nd6 h GLU 2183Ca 0.02 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 1nd6 h GLU 2183Cb 0.06 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1nd6 h GLU 2183CO -0.04 0.31 -0.27 0.66 -1.00 0.00 0.00 179.01 178.67 1nd6 h SER 2184N 0.49 0.37 -0.46 1.42 4.64 -0.32 -1.08 113.55 118.59 1nd6 h SER 2184Ca 0.34 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 1nd6 h SER 2184Cb 0.41 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 1nd6 h SER 2184CO -0.30 0.64 0.25 0.58 -0.87 0.00 0.00 176.83 177.12 1nd6 h VAL 2185N 0.32 1.17 -0.89 0.95 2.07 0.05 -2.84 116.25 117.09 1nd6 h VAL 2185Ca 0.05 -0.45 -0.48 0.00 0.82 0.00 0.00 66.70 66.64 1nd6 h VAL 2185Cb 0.65 0.62 -0.19 0.00 -1.52 0.00 0.00 31.29 30.86 1nd6 h VAL 2185CO 0.05 0.18 0.53 1.41 0.02 0.00 0.00 177.57 179.76 1nd6 n HIS 2186N -4.67 1.94 -3.92 1.57 8.25 -0.88 -4.88 115.22 112.64 1nd6 n HIS 2186Ca 0.01 -2.16 -0.28 0.00 -0.26 0.00 0.00 57.72 55.03 1nd6 n HIS 2186Cb 0.09 -1.20 -0.07 0.00 1.12 0.00 0.00 29.99 29.93 1nd6 n HIS 2186CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1nd6 n ASN 2187N 0.26 -0.14 -4.90 0.41 3.02 -1.07 -4.93 115.26 107.91 1nd6 n ASN 2187Ca 0.44 -1.00 -0.28 0.00 -0.03 0.00 0.00 54.58 53.71 1nd6 n ASN 2187Cb 0.55 -1.25 -0.02 0.00 -0.61 0.00 0.00 39.78 38.45 1nd6 n ASN 2187CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1nd6 s PHE 2188N -3.56 3.49 -0.27 3.10 0.08 -0.43 -5.04 117.98 115.36 1nd6 s PHE 2188Ca 0.27 0.75 -0.18 0.00 0.12 0.00 0.00 56.93 57.90 1nd6 s PHE 2188Cb -0.16 -2.21 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 1nd6 s PHE 2188CO 0.80 0.00 0.50 -0.08 -0.10 0.00 0.00 175.22 176.34 1nd6 s THR 2189N -2.32 5.07 0.55 0.64 -1.32 -1.26 -4.59 115.64 112.42 1nd6 s THR 2189Ca 0.46 0.78 -0.12 0.00 -1.21 0.00 0.00 61.69 61.60 1nd6 s THR 2189Cb -0.10 -3.83 -0.05 0.00 -1.51 0.00 0.00 72.50 67.00 1nd6 s THR 2189CO 0.34 0.05 0.96 -0.76 -2.21 0.00 0.00 174.62 173.01 1nd6 s LEU 2190N 2.30 3.44 1.17 9.08 1.43 -1.26 -5.05 118.68 129.79 1nd6 s LEU 2190Ca 0.20 1.38 -0.13 0.00 -1.03 0.00 0.00 54.13 54.55 1nd6 s LEU 2190Cb -0.16 -4.37 0.29 0.00 0.03 0.00 0.00 46.19 41.98 1nd6 s LEU 2190CO 0.10 -0.71 1.03 -2.16 0.23 0.00 0.00 176.35 174.83 1nd6 s PRO 2191N -4.70 -0.96 0.11 1.29 0.04 -1.26 -4.89 135.00 124.63 1nd6 s PRO 2191Ca 0.55 0.91 -0.31 0.00 0.04 0.00 0.00 61.00 62.18 1nd6 s PRO 2191Cb -0.11 -1.54 -0.11 0.00 0.04 0.00 0.00 34.50 32.79 1nd6 s PRO 2191CO 0.45 -3.77 1.58 0.77 0.04 0.00 0.00 177.00 176.07 1nd6 h SER 2192N -2.66 -1.27 0.24 6.66 0.02 -2.02 -2.39 113.55 112.13 1nd6 h SER 2192Ca -0.61 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1nd6 h SER 2192Cb 1.33 0.48 0.00 0.00 0.14 0.00 0.00 62.40 64.35 1nd6 h SER 2192CO 0.49 -0.50 0.00 -2.67 -1.14 0.00 0.00 176.83 173.01 1nd6 n TRP 2193N -5.47 0.33 -0.89 3.45 4.27 -1.26 -3.78 117.44 114.09 1nd6 n TRP 2193Ca -0.07 0.16 -0.12 0.00 -3.89 0.00 0.00 57.50 53.57 1nd6 n TRP 2193Cb 0.39 -0.75 -0.14 0.00 -1.36 0.00 0.00 31.31 29.45 1nd6 n TRP 2193CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1nd6 n ALA 2194N -1.62 5.77 -1.31 -1.67 0.00 -0.90 -4.74 120.51 116.05 1nd6 n ALA 2194Ca 0.01 -1.72 -0.32 0.00 0.00 0.00 0.00 53.44 51.42 1nd6 n ALA 2194Cb 0.09 -2.39 0.08 0.00 0.00 0.00 0.00 19.45 17.23 1nd6 n ALA 2194CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1nd6 s THR 2195N 1.36 3.23 0.53 0.00 -4.23 -1.25 -4.75 115.64 110.54 1nd6 s THR 2195Ca 0.59 0.45 0.26 0.00 -1.18 0.00 0.00 61.69 61.80 1nd6 s THR 2195Cb 0.27 -2.93 0.40 0.00 1.34 0.00 0.00 72.50 71.58 1nd6 s THR 2195CO -0.00 -0.47 1.99 -0.08 -0.54 0.00 0.00 174.62 175.51 1nd6 h GLU 2196N -0.81 0.00 -0.03 3.99 4.81 -1.95 0.79 114.58 121.38 1nd6 h GLU 2196Ca -0.44 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.71 1nd6 h GLU 2196Cb 1.24 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1nd6 h GLU 2196CO 0.52 0.00 -0.27 0.22 -0.73 0.00 0.00 179.01 178.75 1nd6 h ASP 2197N 0.00 0.29 0.01 1.04 1.82 -1.95 -2.54 116.42 115.09 1nd6 h ASP 2197Ca 0.26 -0.71 -0.01 0.00 -0.39 0.00 0.00 57.03 56.18 1nd6 h ASP 2197Cb 1.05 -0.09 -0.00 0.00 0.68 0.00 0.00 39.33 40.97 1nd6 h ASP 2197CO -0.00 0.95 -0.03 0.74 -1.61 0.00 0.00 179.24 179.29 1nd6 h THR 2198N -0.36 1.04 -0.17 2.25 2.02 -1.41 0.92 112.91 117.21 1nd6 h THR 2198Ca -0.03 -0.18 -0.15 0.00 0.77 0.00 0.00 66.41 66.83 1nd6 h THR 2198Cb 0.97 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1nd6 h THR 2198CO 0.05 0.06 -0.52 0.24 0.37 0.00 0.00 175.52 175.72 1nd6 h MET 2199N 0.05 0.47 -0.36 6.66 2.86 -0.89 -1.17 114.93 122.54 1nd6 h MET 2199Ca 0.01 -0.28 -0.03 0.00 -2.06 0.00 0.00 59.70 57.34 1nd6 h MET 2199Cb 0.08 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 1nd6 h MET 2199CO 0.00 0.88 0.11 1.15 1.06 0.00 0.00 176.91 180.11 1nd6 h THR 2200N 0.37 1.21 -0.16 2.22 2.02 -0.46 0.12 112.91 118.23 1nd6 h THR 2200Ca 0.01 -0.70 -0.08 0.00 0.77 0.00 0.00 66.41 66.41 1nd6 h THR 2200Cb 1.04 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1nd6 h THR 2200CO 0.09 0.24 -0.26 0.11 0.37 0.00 0.00 175.52 176.07 1nd6 h LYS 2201N 0.43 0.30 -0.21 6.66 1.57 -0.94 -1.42 116.57 122.95 1nd6 h LYS 2201Ca 0.12 -0.10 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 1nd6 h LYS 2201Cb 0.26 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1nd6 h LYS 2201CO -0.00 0.54 -0.39 -0.07 -0.57 0.00 0.00 179.45 178.96 1nd6 h LEU 2202N 0.27 0.71 -0.28 2.94 3.38 -0.90 -2.16 115.31 119.26 1nd6 h LEU 2202Ca 0.04 -0.54 -0.01 0.00 0.09 0.00 0.00 57.88 57.46 1nd6 h LEU 2202Cb 0.61 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1nd6 h LEU 2202CO 0.04 1.11 0.13 -0.09 0.09 0.00 0.00 178.44 179.73 1nd6 h ARG 2203N 0.32 0.41 -0.68 1.13 2.43 -0.78 -1.28 114.38 115.93 1nd6 h ARG 2203Ca 0.01 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.20 1nd6 h ARG 2203Cb 0.99 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.40 1nd6 h ARG 2203CO 0.09 0.39 0.34 0.93 -1.51 0.00 0.00 179.97 180.21 1nd6 h GLU 2204N 0.32 0.57 -0.31 0.20 5.08 -1.27 0.20 114.58 119.38 1nd6 h GLU 2204Ca 0.10 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1nd6 h GLU 2204Cb 0.12 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1nd6 h GLU 2204CO -0.01 0.38 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.20 1nd6 h LEU 2205N 0.59 0.50 -0.39 1.33 3.38 -1.07 0.50 115.31 120.14 1nd6 h LEU 2205Ca 0.33 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 58.09 1nd6 h LEU 2205Cb 0.33 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1nd6 h LEU 2205CO -0.25 0.64 -0.10 0.28 0.09 0.00 0.00 178.44 179.10 1nd6 h SER 2206N 0.48 0.76 -0.64 -0.43 0.02 0.13 0.16 113.55 114.03 1nd6 h SER 2206Ca 0.09 -0.37 -0.03 0.00 -0.84 0.00 0.00 61.79 60.65 1nd6 h SER 2206Cb 0.47 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 1nd6 h SER 2206CO 0.03 0.95 0.29 -0.33 -1.14 0.00 0.00 176.83 176.62 1nd6 h GLU 2207N 0.56 0.93 -0.21 3.45 5.08 -0.26 -0.61 114.58 123.51 1nd6 h GLU 2207Ca 0.10 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1nd6 h GLU 2207Cb 0.62 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1nd6 h GLU 2207CO 0.04 0.76 -0.10 1.25 -1.00 0.00 0.00 179.01 179.96 1nd6 h LEU 2208N 0.88 0.32 -0.18 1.33 5.85 -0.65 0.76 115.31 123.62 1nd6 h LEU 2208Ca 0.22 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1nd6 h LEU 2208Cb 0.15 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1nd6 h LEU 2208CO -0.02 0.45 0.08 -1.28 -0.34 0.00 0.00 178.44 177.33 1nd6 h SER 2209N 0.32 0.23 -0.29 1.25 0.87 0.52 -0.21 113.55 116.23 1nd6 h SER 2209Ca 0.07 -0.12 -0.14 0.00 -1.23 0.00 0.00 61.79 60.36 1nd6 h SER 2209Cb 0.37 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1nd6 h SER 2209CO 0.02 0.29 -0.33 0.25 -0.53 0.00 0.00 176.83 176.53 1nd6 h LEU 2210N 0.16 0.86 -0.00 2.23 5.85 -0.61 -2.69 115.31 121.10 1nd6 h LEU 2210Ca 0.06 -0.36 -0.00 0.00 0.84 0.00 0.00 57.88 58.42 1nd6 h LEU 2210Cb 0.12 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 1nd6 h LEU 2210CO -0.01 1.11 0.00 0.25 -0.34 0.00 0.00 178.44 179.46 1nd6 h LEU 2211N 0.69 0.00 -1.82 2.25 7.12 -0.70 -2.64 115.31 120.21 1nd6 h LEU 2211Ca 0.07 -0.22 0.00 0.00 0.13 0.00 0.00 57.88 57.86 1nd6 h LEU 2211Cb 0.89 -0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.02 1nd6 h LEU 2211CO 0.08 0.23 0.00 0.77 -0.13 0.00 0.00 178.44 179.39 1nd6 h SER 2212N -0.22 0.00 -0.18 1.25 4.64 -1.07 0.78 113.55 118.75 1nd6 h SER 2212Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1nd6 h SER 2212Cb 0.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1nd6 h SER 2212CO 0.00 0.00 -0.24 0.25 -0.87 0.00 0.00 176.83 175.97 1nd6 h LEU 2213N 0.00 0.51 0.00 5.97 7.12 -1.12 -3.37 115.31 124.42 1nd6 h LEU 2213Ca 0.00 -0.51 0.00 0.00 0.13 0.00 0.00 57.88 57.50 1nd6 h LEU 2213Cb 0.35 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.33 1nd6 h LEU 2213CO 0.00 0.93 -1.46 -1.22 -0.13 0.00 0.00 178.44 176.55 1nd6 n TYR 2214N -4.42 0.00 -1.17 1.25 0.53 -1.07 -4.99 117.16 107.29 1nd6 n TYR 2214Ca -0.06 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.82 1nd6 n TYR 2214Cb 0.43 -0.26 0.00 0.00 -1.03 0.00 0.00 39.34 38.48 1nd6 n TYR 2214CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1nd6 n GLY 2215N 1.64 5.44 5.00 2.72 0.00 0.27 -4.55 105.19 115.70 1nd6 n GLY 2215Ca -0.02 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.78 1nd6 n GLY 2215CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nd6 n ILE 2216N 0.00 0.00 -4.18 -0.61 2.08 -1.26 -4.56 119.36 110.84 1nd6 n ILE 2216Ca 0.00 0.00 -0.31 0.00 0.56 0.00 0.00 62.75 63.00 1nd6 n ILE 2216Cb 0.00 0.00 -0.16 0.00 -0.75 0.00 0.00 39.64 38.73 1nd6 n ILE 2216CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 1nd6 s HIS 2217N 0.00 2.40 -1.39 1.39 2.46 -1.26 -4.80 115.29 114.10 1nd6 s HIS 2217Ca 0.00 -1.34 -0.01 0.00 0.47 0.00 0.00 55.06 54.18 1nd6 s HIS 2217Cb 0.00 -1.71 0.01 0.00 -0.13 0.00 0.00 32.58 30.75 1nd6 s HIS 2217CO 0.00 -0.69 0.54 1.63 -2.47 0.00 0.00 174.74 173.76 1nd6 n LYS 2218N 4.57 -3.92 0.06 2.88 5.02 -1.26 -4.87 118.16 120.64 1nd6 n LYS 2218Ca -0.19 0.48 0.18 0.00 -2.02 0.00 0.00 58.31 56.76 1nd6 n LYS 2218Cb 0.50 -4.80 0.69 0.00 -0.02 0.00 0.00 35.03 31.40 1nd6 n LYS 2218CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1nd6 h GLN 2219N -1.85 0.00 -0.03 1.97 4.15 -1.84 -2.06 115.11 115.45 1nd6 h GLN 2219Ca -0.62 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 58.74 1nd6 h GLN 2219Cb 1.37 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.06 1nd6 h GLN 2219CO 0.61 0.00 -0.19 -0.22 -1.93 0.00 0.00 178.83 177.10 1nd6 h LYS 2220N 0.00 0.18 -0.39 1.69 1.63 -1.89 -1.64 116.57 116.15 1nd6 h LYS 2220Ca 0.20 -0.16 -0.10 0.00 -0.85 0.00 0.00 60.65 59.74 1nd6 h LYS 2220Cb 0.80 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.45 1nd6 h LYS 2220CO -0.00 0.83 -0.15 1.49 -3.45 0.00 0.00 179.45 178.16 1nd6 h GLU 2221N -0.41 0.72 -0.75 1.90 4.81 -1.82 -0.59 114.58 118.43 1nd6 h GLU 2221Ca -0.02 -0.25 0.04 0.00 -0.13 0.00 0.00 59.36 59.00 1nd6 h GLU 2221Cb 0.87 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.15 1nd6 h GLU 2221CO 0.04 0.83 0.47 0.87 -0.73 0.00 0.00 179.01 180.49 1nd6 h LYS 2222N 0.64 0.89 -0.74 1.92 1.57 -1.40 -1.79 116.57 117.67 1nd6 h LYS 2222Ca 0.10 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 1nd6 h LYS 2222Cb 0.62 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1nd6 h LYS 2222CO 0.04 0.59 0.22 0.77 -0.57 0.00 0.00 179.45 180.50 1nd6 h SER 2223N 0.91 1.09 0.20 0.86 0.02 -0.71 -0.09 113.55 115.83 1nd6 h SER 2223Ca 0.31 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1nd6 h SER 2223Cb 0.04 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 62.29 1nd6 h SER 2223CO -0.12 1.02 0.00 0.03 -1.14 0.00 0.00 176.83 176.62 1nd6 h ARG 2224N 1.11 0.00 -0.01 3.45 3.08 -0.28 0.29 114.38 122.02 1nd6 h ARG 2224Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1nd6 h ARG 2224Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1nd6 h ARG 2224CO -0.00 0.00 -0.32 1.28 -1.07 0.00 0.00 179.97 179.85 1nd6 n LEU 2225N -2.82 1.27 0.00 3.04 4.77 -0.57 -3.98 117.00 118.71 1nd6 n LEU 2225Ca -0.02 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 1nd6 n LEU 2225Cb 0.11 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1nd6 n LEU 2225CO 0.18 0.25 0.00 0.00 -1.33 0.00 0.00 177.39 176.50 1nd6 n GLN 2226N -0.38 0.00 0.28 3.23 1.13 -0.15 -4.76 117.38 116.72 1nd6 n GLN 2226Ca 0.05 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.23 1nd6 n GLN 2226Cb 0.26 0.00 0.80 0.00 0.11 0.00 0.00 30.24 31.41 1nd6 n GLN 2226CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1nd6 h GLY 2227N 0.00 0.00 2.00 1.08 0.00 -1.70 -2.78 103.07 101.68 1nd6 h GLY 2227Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1nd6 h GLY 2227CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.21 1nd6 h GLY 2228N 0.16 0.00 1.88 4.60 0.00 -0.59 -0.41 103.07 108.71 1nd6 h GLY 2228Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 1nd6 h GLY 2228CO 0.00 0.00 -0.93 -2.08 0.00 0.00 0.00 176.54 173.54 1nd6 h VAL 2229N 0.00 1.58 -0.00 4.60 2.07 -1.67 -2.15 116.25 120.67 1nd6 h VAL 2229Ca 0.00 -2.91 -0.02 0.00 0.82 0.00 0.00 66.70 64.59 1nd6 h VAL 2229Cb 0.01 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.40 1nd6 h VAL 2229CO 0.00 0.84 -0.09 0.25 0.02 0.00 0.00 177.57 178.59 1nd6 h LEU 2230N 0.05 0.08 -0.65 2.57 6.46 -1.29 -2.67 115.31 119.86 1nd6 h LEU 2230Ca -0.04 -0.78 0.13 0.00 -0.12 0.00 0.00 57.88 57.08 1nd6 h LEU 2230Cb 1.60 -0.02 -0.12 0.00 -0.73 0.00 0.00 40.66 41.38 1nd6 h LEU 2230CO 0.13 0.84 -0.22 0.58 -0.62 0.00 0.00 178.44 179.16 1nd6 h VAL 2231N -0.68 0.27 -0.24 1.05 2.07 -1.39 0.13 116.25 117.46 1nd6 h VAL 2231Ca -0.01 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1nd6 h VAL 2231Cb 0.86 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1nd6 h VAL 2231CO 0.02 0.00 0.07 -1.13 0.02 0.00 0.00 177.57 176.55 1nd6 h ASN 2232N -0.05 0.07 -0.40 0.57 -0.00 -1.44 0.28 115.58 114.61 1nd6 h ASN 2232Ca 0.30 0.03 0.08 0.00 -0.00 0.00 0.00 56.30 56.70 1nd6 h ASN 2232Cb 0.52 0.02 -0.07 0.00 -0.00 0.00 0.00 38.32 38.79 1nd6 h ASN 2232CO -0.69 0.07 -0.04 -0.08 -0.00 0.00 0.00 177.43 176.69 1nd6 h GLU 2233N 0.18 0.06 -0.32 6.67 4.57 -0.55 0.11 114.58 125.30 1nd6 h GLU 2233Ca 0.11 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.22 1nd6 h GLU 2233Cb 0.08 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1nd6 h GLU 2233CO -0.12 0.04 -0.04 0.82 -1.18 0.00 0.00 179.01 178.53 1nd6 h ILE 2234N 0.06 1.27 -0.35 2.32 2.04 -0.29 -2.44 117.51 120.13 1nd6 h ILE 2234Ca 0.20 -1.05 0.02 0.00 1.00 0.00 0.00 64.86 65.03 1nd6 h ILE 2234Cb 0.29 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1nd6 h ILE 2234CO -0.36 0.34 0.18 0.25 0.00 0.00 0.00 178.15 178.56 1nd6 h LEU 2235N 0.37 0.27 -1.77 1.44 6.46 0.05 -1.43 115.31 120.70 1nd6 h LEU 2235Ca 0.08 0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.82 1nd6 h LEU 2235Cb 0.52 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.40 1nd6 h LEU 2235CO 0.02 0.20 -0.16 0.78 -0.62 0.00 0.00 178.44 178.66 1nd6 h ASN 2236N 0.37 0.00 -0.13 1.25 2.35 -0.72 0.78 115.58 119.49 1nd6 h ASN 2236Ca 0.14 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.79 1nd6 h ASN 2236Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1nd6 h ASN 2236CO -0.09 0.16 -0.33 0.45 -1.65 0.00 0.00 177.43 175.97 1nd6 h HIS 2237N 0.00 0.57 -0.44 1.19 3.86 -0.88 -2.45 115.15 117.00 1nd6 h HIS 2237Ca -0.00 -0.22 -0.01 0.00 -1.16 0.00 0.00 60.37 58.97 1nd6 h HIS 2237Cb 0.34 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.68 1nd6 h HIS 2237CO 0.00 0.95 0.21 0.52 0.86 0.00 0.00 177.93 180.47 1nd6 h MET 2238N 0.04 0.62 0.09 2.45 2.86 -0.67 -0.93 114.93 119.38 1nd6 h MET 2238Ca -0.01 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1nd6 h MET 2238Cb 0.94 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.48 1nd6 h MET 2238CO 0.07 0.48 -0.04 0.87 1.06 0.00 0.00 176.91 179.35 1nd6 h LYS 2239N 0.62 -0.11 -0.59 1.72 1.57 -0.76 -2.50 116.57 116.51 1nd6 h LYS 2239Ca 0.16 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.98 1nd6 h LYS 2239Cb 0.07 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 1nd6 h LYS 2239CO -0.02 0.11 0.39 0.00 -0.57 0.00 0.00 179.45 179.36 1nd6 h ARG 2240N -0.33 0.65 0.00 3.15 3.08 -1.12 -0.90 114.38 118.91 1nd6 h ARG 2240Ca -0.01 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 1nd6 h ARG 2240Cb 0.28 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 1nd6 h ARG 2240CO 0.02 0.43 -0.06 0.00 -1.07 0.00 0.00 179.97 179.29 1nd6 h ALA 2241N 1.66 1.69 0.00 0.04 0.00 -0.75 1.17 119.26 123.07 1nd6 h ALA 2241Ca 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1nd6 h ALA 2241Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1nd6 h ALA 2241CO -0.07 0.07 -0.56 0.25 0.00 0.00 0.00 179.25 178.94 1nd6 n THR 2242N -4.16 0.33 -0.07 0.00 -2.24 -0.39 -3.94 114.28 103.80 1nd6 n THR 2242Ca -0.03 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 1nd6 n THR 2242Cb 0.14 -0.13 -0.14 0.00 -2.10 0.00 0.00 70.33 68.10 1nd6 n THR 2242CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nd6 n GLN 2243N -2.05 0.68 -4.00 -0.78 6.02 0.34 -4.86 117.38 112.73 1nd6 n GLN 2243Ca 0.04 0.14 -0.33 0.00 -0.01 0.00 0.00 57.00 56.83 1nd6 n GLN 2243Cb 0.43 -1.62 -0.14 0.00 1.02 0.00 0.00 30.24 29.93 1nd6 n GLN 2243CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1nd6 s ILE 2244N -2.53 2.50 0.35 5.09 1.01 0.38 -5.01 121.20 122.98 1nd6 s ILE 2244Ca -0.15 -1.66 0.15 0.00 0.00 0.00 0.00 60.65 58.98 1nd6 s ILE 2244Cb 0.07 -2.51 0.35 0.00 0.01 0.00 0.00 42.46 40.38 1nd6 s ILE 2244CO 0.77 -0.15 1.71 -0.65 0.00 0.00 0.00 174.94 176.62 1nd6 h PRO 2245N 7.84 0.41 -1.34 2.79 0.11 -1.86 -2.54 132.00 137.41 1nd6 h PRO 2245Ca -0.18 -0.02 -0.63 0.00 0.11 0.00 0.00 66.00 65.28 1nd6 h PRO 2245Cb 1.04 -0.09 -0.37 0.00 0.11 0.00 0.00 31.00 31.69 1nd6 h PRO 2245CO 0.50 0.27 -0.17 -1.13 -0.21 0.00 0.00 178.00 177.26 1nd6 n SER 2246N -4.87 5.76 -3.73 -2.05 3.41 -1.26 -5.04 113.62 105.84 1nd6 n SER 2246Ca 0.29 -3.76 -0.28 0.00 -0.26 0.00 0.00 58.87 54.86 1nd6 n SER 2246Cb 0.91 -0.62 0.20 0.00 -0.26 0.00 0.00 64.21 64.44 1nd6 n SER 2246CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nd6 n TYR 2247N -0.61 -3.97 -0.85 7.33 4.19 -0.96 -5.01 117.16 117.28 1nd6 n TYR 2247Ca 0.47 -1.07 -0.30 0.00 3.31 0.00 0.00 57.90 60.30 1nd6 n TYR 2247Cb 0.66 -1.00 0.16 0.00 0.49 0.00 0.00 39.34 39.65 1nd6 n TYR 2247CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1nd6 s LYS 2248N -5.66 1.03 -0.01 2.98 1.02 -1.26 -4.84 119.74 113.00 1nd6 s LYS 2248Ca 0.70 1.30 0.02 0.00 0.02 0.00 0.00 55.97 58.02 1nd6 s LYS 2248Cb -0.03 -1.75 -0.04 0.00 -0.52 0.00 0.00 37.83 35.50 1nd6 s LYS 2248CO 0.50 -2.54 0.04 1.63 -0.92 0.00 0.00 175.35 174.06 1nd6 n LYS 2249N -4.15 1.04 -3.70 1.68 5.02 0.84 -4.87 118.16 114.02 1nd6 n LYS 2249Ca 0.10 -0.02 -0.12 0.00 -2.02 0.00 0.00 58.31 56.25 1nd6 n LYS 2249Cb 0.53 -1.06 -0.12 0.00 -0.02 0.00 0.00 35.03 34.35 1nd6 n LYS 2249CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1nd6 s LEU 2250N -3.45 0.03 -0.11 -0.35 2.96 -0.83 -1.63 118.68 115.29 1nd6 s LEU 2250Ca -0.01 0.66 0.02 0.00 -0.22 0.00 0.00 54.13 54.58 1nd6 s LEU 2250Cb 0.01 0.91 0.01 0.00 0.50 0.00 0.00 46.19 47.63 1nd6 s LEU 2250CO 0.10 -0.20 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.14 1nd6 s ILE 2251N 1.71 1.62 -0.12 6.68 1.01 -0.96 -1.22 121.20 129.93 1nd6 s ILE 2251Ca -0.06 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 59.87 1nd6 s ILE 2251Cb -0.11 -1.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.88 1nd6 s ILE 2251CO -0.10 0.46 -0.13 -0.04 0.00 0.00 0.00 174.94 175.14 1nd6 s MET 2252N 0.87 3.24 -0.24 2.79 -1.94 -0.07 -1.89 119.30 122.06 1nd6 s MET 2252Ca -0.08 -0.67 -0.02 0.00 -1.71 0.00 0.00 55.69 53.20 1nd6 s MET 2252Cb -0.15 -2.60 0.02 0.00 2.01 0.00 0.00 34.83 34.10 1nd6 s MET 2252CO -0.00 0.30 -0.07 0.71 -0.01 0.00 0.00 175.02 175.95 1nd6 s TYR 2253N 0.14 3.02 -0.42 -0.03 1.51 0.66 -0.32 117.35 121.90 1nd6 s TYR 2253Ca -0.06 -1.45 -0.17 0.00 -1.01 0.00 0.00 57.07 54.38 1nd6 s TYR 2253Cb -0.15 -2.06 0.02 0.00 -0.11 0.00 0.00 41.96 39.67 1nd6 s TYR 2253CO 0.05 -0.70 0.43 0.45 -1.11 0.00 0.00 175.55 174.66 1nd6 s SER 2254N 1.35 6.19 0.00 2.29 0.15 0.26 -2.51 113.70 121.43 1nd6 s SER 2254Ca 0.02 -0.67 0.00 0.00 0.70 0.00 0.00 55.95 56.00 1nd6 s SER 2254Cb -0.16 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 61.93 1nd6 s SER 2254CO -0.05 -0.57 0.00 0.00 1.20 0.00 0.00 173.24 173.82 1nd6 n ALA 2255N 5.58 0.00 -2.62 5.45 0.00 -0.54 -2.30 120.51 126.07 1nd6 n ALA 2255Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.07 1nd6 n ALA 2255Cb 0.47 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.85 1nd6 n ALA 2255CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1nd6 s HIS 2256N 1.16 2.14 0.51 0.00 3.76 -1.26 -2.06 115.29 119.54 1nd6 s HIS 2256Ca 0.00 -0.80 0.29 0.00 -0.15 0.00 0.00 55.06 54.40 1nd6 s HIS 2256Cb 0.00 -1.76 1.65 0.00 1.11 0.00 0.00 32.58 33.59 1nd6 s HIS 2256CO 0.00 0.20 2.17 0.38 -0.85 0.00 0.00 174.74 176.64 1nd6 h ASP 2257N 1.41 0.00 0.96 1.40 -0.00 -1.92 0.23 116.42 118.49 1nd6 h ASP 2257Ca -0.43 0.00 -0.07 0.00 -0.00 0.00 0.00 57.03 56.53 1nd6 h ASP 2257Cb 1.28 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.60 1nd6 h ASP 2257CO 0.73 0.06 -0.35 0.74 -0.00 0.00 0.00 179.24 180.42 1nd6 h THR 2258N 0.00 0.79 0.13 1.15 2.02 -1.95 -1.34 112.91 113.71 1nd6 h THR 2258Ca -0.00 -1.52 -0.20 0.00 0.77 0.00 0.00 66.41 65.46 1nd6 h THR 2258Cb 0.16 1.96 0.02 0.00 -1.74 0.00 0.00 68.15 68.55 1nd6 h THR 2258CO 0.01 0.35 -0.93 0.74 0.37 0.00 0.00 175.52 176.06 1nd6 h THR 2259N 0.00 1.41 0.17 3.16 2.02 -0.85 -1.96 112.91 116.86 1nd6 h THR 2259Ca -0.00 -2.50 -0.01 0.00 0.77 0.00 0.00 66.41 64.66 1nd6 h THR 2259Cb 0.93 3.10 0.00 0.00 -1.74 0.00 0.00 68.15 70.44 1nd6 h THR 2259CO 0.05 0.71 -0.08 0.58 0.37 0.00 0.00 175.52 177.14 1nd6 h VAL 2260N -0.38 0.91 -0.67 3.16 2.07 -1.22 -1.09 116.25 119.03 1nd6 h VAL 2260Ca -0.18 -0.33 -0.07 0.00 0.82 0.00 0.00 66.70 66.95 1nd6 h VAL 2260Cb 1.65 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 32.50 1nd6 h VAL 2260CO 0.12 0.08 0.15 0.77 0.02 0.00 0.00 177.57 178.71 1nd6 h SER 2261N -0.38 1.02 -0.44 0.57 4.64 -1.39 -0.18 113.55 117.39 1nd6 h SER 2261Ca -0.02 -0.24 0.03 0.00 -0.47 0.00 0.00 61.79 61.08 1nd6 h SER 2261Cb 0.30 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 1nd6 h SER 2261CO 0.04 1.00 0.24 1.23 -0.87 0.00 0.00 176.83 178.47 1nd6 h GLY 2262N 1.00 0.62 0.81 -0.77 0.00 -1.26 0.30 103.07 103.76 1nd6 h GLY 2262Ca 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 1nd6 h GLY 2262CO 0.00 0.14 -0.09 -2.00 0.00 0.00 0.00 176.54 174.60 1nd6 h LEU 2263N 0.49 -0.21 -1.56 3.11 5.85 -0.94 -2.40 115.31 119.66 1nd6 h LEU 2263Ca 0.18 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1nd6 h LEU 2263Cb 0.05 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1nd6 h LEU 2263CO -0.10 0.02 0.27 1.56 -0.34 0.00 0.00 178.44 179.84 1nd6 h GLN 2264N -0.44 0.56 -0.41 1.25 4.20 -0.78 -0.71 115.11 118.78 1nd6 h GLN 2264Ca -0.03 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1nd6 h GLN 2264Cb 0.34 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1nd6 h GLN 2264CO 0.04 0.39 0.02 0.52 -0.67 0.00 0.00 178.83 179.13 1nd6 h MET 2265N 0.58 0.71 -0.29 1.46 2.86 -0.30 0.63 114.93 120.58 1nd6 h MET 2265Ca 0.15 -0.22 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 1nd6 h MET 2265Cb -0.04 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 1nd6 h MET 2265CO -0.03 0.78 -0.06 0.00 1.06 0.00 0.00 176.91 178.67 1nd6 h ALA 2266N 0.90 1.36 0.00 6.32 0.00 -0.81 -0.61 119.26 126.42 1nd6 h ALA 2266Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1nd6 h ALA 2266Cb 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1nd6 h ALA 2266CO 0.02 0.44 -0.14 -0.07 0.00 0.00 0.00 179.25 179.49 1nd6 h LEU 2267N 0.44 0.00 -1.55 0.00 3.38 -0.82 -3.46 115.31 113.30 1nd6 h LEU 2267Ca 0.09 -0.02 -0.22 0.00 0.09 0.00 0.00 57.88 57.82 1nd6 h LEU 2267Cb 0.38 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.23 1nd6 h LEU 2267CO 0.02 0.01 -0.47 -0.67 0.09 0.00 0.00 178.44 177.42 1nd6 n ASP 2268N -2.62 -2.75 -0.32 -0.43 -0.08 0.20 -4.63 116.55 105.92 1nd6 n ASP 2268Ca 0.04 -0.38 0.02 0.00 -1.51 0.00 0.00 54.79 52.96 1nd6 n ASP 2268Cb 0.48 -3.41 0.02 0.00 2.34 0.00 0.00 41.12 40.56 1nd6 n ASP 2268CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 1nd6 n VAL 2269N -3.27 0.34 -2.46 5.18 0.24 -0.17 -4.50 118.33 113.69 1nd6 n VAL 2269Ca -0.13 -0.40 -0.42 0.00 -2.04 0.00 0.00 64.34 61.35 1nd6 n VAL 2269Cb 0.59 0.47 -0.03 0.00 -1.47 0.00 0.00 33.84 33.39 1nd6 n VAL 2269CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1nd6 s TYR 2270N -0.50 3.50 -2.14 6.34 5.04 -1.19 -4.94 117.35 123.46 1nd6 s TYR 2270Ca 0.05 1.44 0.16 0.00 -2.44 0.00 0.00 57.07 56.27 1nd6 s TYR 2270Cb 0.04 -3.36 0.57 0.00 0.35 0.00 0.00 41.96 39.56 1nd6 s TYR 2270CO 0.00 -0.98 1.42 0.27 -1.34 0.00 0.00 175.55 174.92 1nd6 n ASN 2271N 3.21 1.56 0.00 4.32 0.23 -1.26 -4.92 115.26 118.40 1nd6 n ASN 2271Ca 0.06 -1.82 0.00 0.00 -0.53 0.00 0.00 54.58 52.30 1nd6 n ASN 2271Cb 0.46 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 38.02 1nd6 n ASN 2271CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1nd6 n GLY 2272N 1.05 2.89 3.83 4.83 0.00 -1.26 -5.01 105.19 111.52 1nd6 n GLY 2272Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1nd6 n GLY 2272CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nd6 s LEU 2273N 0.00 3.09 -0.01 0.99 1.43 -1.26 -4.82 118.68 118.10 1nd6 s LEU 2273Ca 0.00 1.55 -0.30 0.00 -1.03 0.00 0.00 54.13 54.35 1nd6 s LEU 2273Cb 0.00 -4.43 -0.05 0.00 0.03 0.00 0.00 46.19 41.74 1nd6 s LEU 2273CO 0.00 -1.42 1.32 -0.76 0.23 0.00 0.00 176.35 175.73 1nd6 s LEU 2274N -5.52 4.31 -0.28 1.79 1.43 -1.26 -4.92 118.68 114.23 1nd6 s LEU 2274Ca 0.58 2.01 -0.29 0.00 -1.03 0.00 0.00 54.13 55.40 1nd6 s LEU 2274Cb -0.14 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.46 1nd6 s LEU 2274CO 0.55 -0.66 2.25 -2.65 0.23 0.00 0.00 176.35 176.07 1nd6 n PRO 2275N 5.20 1.69 -0.62 1.29 -0.02 -1.26 -4.93 135.00 136.35 1nd6 n PRO 2275Ca 0.12 0.42 -0.30 0.00 -2.02 0.00 0.00 63.50 61.72 1nd6 n PRO 2275Cb 0.45 -3.14 0.20 0.00 -0.02 0.00 0.00 33.50 30.98 1nd6 n PRO 2275CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1nd6 n PRO 2276N 8.72 -1.15 -1.71 0.52 -0.02 -1.26 -4.79 135.00 135.31 1nd6 n PRO 2276Ca 0.33 -0.28 -0.39 0.00 -2.02 0.00 0.00 63.50 61.14 1nd6 n PRO 2276Cb 0.43 -2.25 0.04 0.00 -0.02 0.00 0.00 33.50 31.70 1nd6 n PRO 2276CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1nd6 n TYR 2277N -4.46 1.92 -0.70 6.00 0.53 -1.26 -1.94 117.16 117.25 1nd6 n TYR 2277Ca 0.08 0.44 0.00 0.00 -1.02 0.00 0.00 57.90 57.41 1nd6 n TYR 2277Cb 0.53 -2.31 0.00 0.00 -1.03 0.00 0.00 39.34 36.54 1nd6 n TYR 2277CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1nd6 n ALA 2278N -1.18 0.00 -1.77 -0.72 0.00 -0.39 -4.92 120.51 111.52 1nd6 n ALA 2278Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.15 1nd6 n ALA 2278Cb 0.45 -1.14 -0.00 0.00 0.00 0.00 0.00 19.45 18.76 1nd6 n ALA 2278CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nd6 s SER 2279N -1.78 6.32 -0.02 0.00 1.04 -0.82 -4.66 113.70 113.78 1nd6 s SER 2279Ca 0.00 2.94 0.04 0.00 0.48 0.00 0.00 55.95 59.41 1nd6 s SER 2279Cb 0.00 -2.66 -0.01 0.00 0.10 0.00 0.00 66.02 63.45 1nd6 s SER 2279CO 0.00 -0.88 -0.15 0.00 0.98 0.00 0.00 173.24 173.19 1nd6 s HIS 2281N -0.17 3.19 -0.22 0.00 2.46 0.38 -0.91 115.29 120.02 1nd6 s HIS 2281Ca 0.02 -0.33 -0.09 0.00 0.47 0.00 0.00 55.06 55.12 1nd6 s HIS 2281Cb -0.08 -2.37 -0.04 0.00 -0.13 0.00 0.00 32.58 29.95 1nd6 s HIS 2281CO 0.00 -0.36 0.11 -0.51 -2.47 0.00 0.00 174.74 171.51 1nd6 s LEU 2282N 1.67 3.93 -0.27 8.88 2.01 0.49 -1.83 118.68 133.57 1nd6 s LEU 2282Ca 0.06 0.07 0.02 0.00 0.01 0.00 0.00 54.13 54.29 1nd6 s LEU 2282Cb -0.17 -2.03 0.07 0.00 0.01 0.00 0.00 46.19 44.07 1nd6 s LEU 2282CO 0.08 0.10 -0.05 -0.89 1.01 0.00 0.00 176.35 176.60 1nd6 s THR 2283N 0.84 1.87 0.06 5.49 2.01 -0.28 -0.82 115.64 124.82 1nd6 s THR 2283Ca 0.06 -1.59 0.03 0.00 0.31 0.00 0.00 61.69 60.50 1nd6 s THR 2283Cb -0.13 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.21 1nd6 s THR 2283CO 0.03 -0.19 0.05 -1.61 -0.69 0.00 0.00 174.62 172.20 1nd6 s GLU 2284N 1.21 2.81 -0.14 4.92 2.02 0.13 -1.34 118.70 128.31 1nd6 s GLU 2284Ca -0.03 -0.69 0.00 0.00 0.02 0.00 0.00 54.97 54.27 1nd6 s GLU 2284Cb -0.19 -2.69 0.02 0.00 0.10 0.00 0.00 34.13 31.37 1nd6 s GLU 2284CO -0.07 0.58 -0.14 -1.17 0.02 0.00 0.00 175.26 174.48 1nd6 s LEU 2285N -2.19 1.63 0.15 1.80 2.96 0.73 -1.06 118.68 122.69 1nd6 s LEU 2285Ca 0.26 -0.45 0.10 0.00 -0.22 0.00 0.00 54.13 53.82 1nd6 s LEU 2285Cb -0.12 -1.12 -0.04 0.00 0.50 0.00 0.00 46.19 45.41 1nd6 s LEU 2285CO 0.19 -0.05 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.66 1nd6 s TYR 2286N 1.42 2.45 -0.15 5.38 1.51 -0.81 -0.41 117.35 126.74 1nd6 s TYR 2286Ca 0.03 -0.30 -0.10 0.00 -1.01 0.00 0.00 57.07 55.69 1nd6 s TYR 2286Cb -0.13 -1.27 -0.05 0.00 -0.11 0.00 0.00 41.96 40.41 1nd6 s TYR 2286CO -0.09 0.43 0.18 0.12 -1.11 0.00 0.00 175.55 175.08 1nd6 s PHE 2287N -1.36 3.51 0.00 2.71 5.36 0.12 -1.75 117.98 126.58 1nd6 s PHE 2287Ca 0.19 0.49 0.00 0.00 -0.96 0.00 0.00 56.93 56.65 1nd6 s PHE 2287Cb -0.09 -2.11 0.00 0.00 -0.34 0.00 0.00 43.02 40.47 1nd6 s PHE 2287CO 0.10 0.48 0.00 -1.91 -1.46 0.00 0.00 175.22 172.43 1nd6 n GLU 2288N 2.83 3.90 0.00 10.12 4.07 0.21 -1.84 120.64 139.94 1nd6 n GLU 2288Ca -0.17 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.93 1nd6 n GLU 2288Cb 0.53 -0.58 0.00 0.00 -0.06 0.00 0.00 31.44 31.33 1nd6 n GLU 2288CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1nd6 n LYS 2289N -0.93 0.00 -0.97 5.31 5.02 -1.26 -4.78 118.16 120.55 1nd6 n LYS 2289Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1nd6 n LYS 2289Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1nd6 n LYS 2289CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nd6 n GLY 2290N 0.00 0.74 2.93 0.72 0.00 -1.26 -5.00 105.19 103.32 1nd6 n GLY 2290Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1nd6 n GLY 2290CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nd6 s GLU 2291N -0.03 0.52 0.11 1.61 2.02 -1.26 -5.15 118.70 116.51 1nd6 s GLU 2291Ca 0.00 -0.14 0.02 0.00 0.02 0.00 0.00 54.97 54.86 1nd6 s GLU 2291Cb 0.00 -0.53 -0.04 0.00 0.10 0.00 0.00 34.13 33.66 1nd6 s GLU 2291CO 0.00 0.04 0.23 0.71 0.02 0.00 0.00 175.26 176.26 1nd6 s TYR 2292N 0.26 3.46 0.05 1.61 1.51 -1.26 -0.61 117.35 122.36 1nd6 s TYR 2292Ca -0.03 0.16 0.02 0.00 -1.01 0.00 0.00 57.07 56.22 1nd6 s TYR 2292Cb -0.07 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 40.06 1nd6 s TYR 2292CO -0.00 0.55 -0.08 -0.06 -1.11 0.00 0.00 175.55 174.85 1nd6 s PHE 2293N -1.62 0.72 -0.10 2.71 0.40 -0.72 -2.02 117.98 117.35 1nd6 s PHE 2293Ca 0.34 -0.57 0.02 0.00 -0.60 0.00 0.00 56.93 56.12 1nd6 s PHE 2293Cb -0.12 -0.43 -0.01 0.00 0.51 0.00 0.00 43.02 42.97 1nd6 s PHE 2293CO 0.28 -0.09 -0.17 0.08 0.70 0.00 0.00 175.22 176.01 1nd6 s VAL 2294N -1.78 2.69 -0.08 -0.44 1.01 0.68 -1.93 120.40 120.55 1nd6 s VAL 2294Ca -0.06 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1nd6 s VAL 2294Cb -0.07 -2.08 0.01 0.00 0.00 0.00 0.00 36.38 34.23 1nd6 s VAL 2294CO -0.00 0.55 -0.15 -1.61 0.00 0.00 0.00 175.10 173.88 1nd6 s GLU 2295N 0.13 2.02 0.02 2.72 2.02 -0.23 -1.06 118.70 124.33 1nd6 s GLU 2295Ca -0.09 -0.52 0.06 0.00 0.02 0.00 0.00 54.97 54.43 1nd6 s GLU 2295Cb -0.15 -1.63 -0.03 0.00 0.10 0.00 0.00 34.13 32.42 1nd6 s GLU 2295CO 0.06 0.05 -0.15 -1.64 0.02 0.00 0.00 175.26 173.60 1nd6 s MET 2296N 0.62 2.26 0.07 1.61 -1.94 -1.26 0.20 119.30 120.86 1nd6 s MET 2296Ca -0.15 -0.87 0.00 0.00 -1.71 0.00 0.00 55.69 52.96 1nd6 s MET 2296Cb -0.16 -2.30 -0.04 0.00 2.01 0.00 0.00 34.83 34.34 1nd6 s MET 2296CO 0.05 0.57 -0.05 0.71 -0.01 0.00 0.00 175.02 176.29 1nd6 s TYR 2297N -0.91 0.68 -0.22 -0.03 1.51 -0.00 -1.02 117.35 117.35 1nd6 s TYR 2297Ca 0.15 -0.98 -0.02 0.00 -1.01 0.00 0.00 57.07 55.20 1nd6 s TYR 2297Cb -0.11 -0.44 0.07 0.00 -0.11 0.00 0.00 41.96 41.37 1nd6 s TYR 2297CO 0.05 -0.27 0.04 -0.47 -1.11 0.00 0.00 175.55 173.79 1nd6 s TYR 2298N -3.71 1.33 -0.94 2.71 5.04 0.01 -0.38 117.35 121.41 1nd6 s TYR 2298Ca 0.08 -1.14 -0.16 0.00 -2.44 0.00 0.00 57.07 53.41 1nd6 s TYR 2298Cb 0.06 -1.22 0.17 0.00 0.35 0.00 0.00 41.96 41.32 1nd6 s TYR 2298CO -0.07 -0.69 1.06 0.50 -1.34 0.00 0.00 175.55 175.01 1nd6 s ARG 2299N 1.75 3.70 0.00 4.97 3.52 -0.09 -1.35 118.95 131.45 1nd6 s ARG 2299Ca 0.00 -2.16 0.20 0.00 -0.13 0.00 0.00 55.73 53.64 1nd6 s ARG 2299Cb -0.17 -4.77 0.35 0.00 -1.56 0.00 0.00 34.95 28.79 1nd6 s ARG 2299CO -0.11 -1.60 1.29 0.27 -0.81 0.00 0.00 175.30 174.35 1nd6 n ASN 2300N 5.43 3.16 -3.60 -2.12 0.23 -1.26 -1.06 115.26 116.04 1nd6 n ASN 2300Ca 0.22 -1.92 -0.01 0.00 -0.53 0.00 0.00 54.58 52.34 1nd6 n ASN 2300Cb 0.47 -0.20 -0.04 0.00 -2.08 0.00 0.00 39.78 37.93 1nd6 n ASN 2300CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 1nd6 s GLU 2301N -1.38 0.53 0.56 -3.83 -1.05 -1.26 -4.78 118.70 107.49 1nd6 s GLU 2301Ca 0.32 1.27 0.37 0.00 -0.15 0.00 0.00 54.97 56.78 1nd6 s GLU 2301Cb 0.19 0.69 1.87 0.00 -0.44 0.00 0.00 34.13 36.44 1nd6 s GLU 2301CO 0.27 -0.17 2.12 1.79 0.95 0.00 0.00 175.26 180.22 1nd6 h THR 2302N 5.76 0.00 0.00 1.83 1.35 -1.98 -2.66 112.91 117.22 1nd6 h THR 2302Ca -0.19 -0.15 -0.03 0.00 -0.55 0.00 0.00 66.41 65.49 1nd6 h THR 2302Cb 1.12 1.05 -0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1nd6 h THR 2302CO 0.11 0.00 -0.15 -0.61 -0.25 0.00 0.00 175.52 174.61 1nd6 h GLN 2303N 0.00 0.00 -5.32 4.72 4.15 -2.02 -3.45 115.11 113.19 1nd6 h GLN 2303Ca 0.00 0.00 -0.39 0.00 0.77 0.00 0.00 58.65 59.03 1nd6 h GLN 2303Cb 0.16 0.00 -0.18 0.00 0.21 0.00 0.00 27.48 27.67 1nd6 h GLN 2303CO 0.00 0.15 -0.75 -1.01 -1.93 0.00 0.00 178.83 175.30 1nd6 s HIS 2304N -3.64 1.35 0.73 3.99 3.76 -1.00 -5.14 115.29 115.35 1nd6 s HIS 2304Ca 0.01 -0.59 -0.14 0.00 -0.15 0.00 0.00 55.06 54.19 1nd6 s HIS 2304Cb 0.10 -0.70 0.04 0.00 1.11 0.00 0.00 32.58 33.12 1nd6 s HIS 2304CO 0.61 0.13 1.15 -1.83 -0.85 0.00 0.00 174.74 173.95 1nd6 s GLU 2305N -2.87 2.26 0.04 1.40 -1.05 -1.26 -4.73 118.70 112.48 1nd6 s GLU 2305Ca 0.10 1.52 -0.36 0.00 -0.15 0.00 0.00 54.97 56.08 1nd6 s GLU 2305Cb -0.03 -1.87 -0.15 0.00 -0.44 0.00 0.00 34.13 31.63 1nd6 s GLU 2305CO 0.03 -1.70 1.54 -2.30 0.95 0.00 0.00 175.26 173.77 1nd6 n PRO 2306N -2.90 1.58 -2.20 -4.83 -0.02 -1.26 -4.91 135.00 120.47 1nd6 n PRO 2306Ca 0.12 0.57 -0.42 0.00 -2.02 0.00 0.00 63.50 61.75 1nd6 n PRO 2306Cb 0.51 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 1nd6 n PRO 2306CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1nd6 s TYR 2307N 1.47 2.90 0.32 6.00 1.51 -0.46 -4.63 117.35 124.46 1nd6 s TYR 2307Ca 0.86 0.82 -0.29 0.00 -1.01 0.00 0.00 57.07 57.44 1nd6 s TYR 2307Cb -0.85 -3.68 -0.11 0.00 -0.11 0.00 0.00 41.96 37.21 1nd6 s TYR 2307CO 0.47 -2.51 1.41 -2.14 -1.11 0.00 0.00 175.55 171.68 1nd6 s PRO 2308N 2.18 4.24 -0.02 -1.71 0.02 -1.26 -0.81 135.00 137.64 1nd6 s PRO 2308Ca 0.65 2.37 0.05 0.00 0.02 0.00 0.00 61.00 64.09 1nd6 s PRO 2308Cb -0.33 -3.05 -0.03 0.00 0.02 0.00 0.00 34.50 31.12 1nd6 s PRO 2308CO 0.28 -0.38 -0.17 -0.51 -0.33 0.00 0.00 177.00 175.89 1nd6 s LEU 2309N -1.44 2.62 -0.09 -5.54 1.43 -0.19 -4.89 118.68 110.58 1nd6 s LEU 2309Ca 0.54 -0.29 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 1nd6 s LEU 2309Cb -0.43 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.28 1nd6 s LEU 2309CO 0.53 0.32 -0.17 -0.32 0.23 0.00 0.00 176.35 176.94 1nd6 s MET 2310N -0.92 2.30 -0.17 1.70 -2.45 -1.26 -4.24 119.30 114.25 1nd6 s MET 2310Ca 0.12 -0.61 -0.29 0.00 -1.25 0.00 0.00 55.69 53.66 1nd6 s MET 2310Cb -0.10 -1.85 -0.03 0.00 1.25 0.00 0.00 34.83 34.10 1nd6 s MET 2310CO 0.02 0.05 1.46 -1.17 1.05 0.00 0.00 175.02 176.42 1nd6 s LEU 2311N 0.66 4.10 -0.14 4.11 2.96 -1.26 -4.82 118.68 124.29 1nd6 s LEU 2311Ca -0.13 1.74 -0.33 0.00 -0.22 0.00 0.00 54.13 55.18 1nd6 s LEU 2311Cb -0.16 -3.54 -0.11 0.00 0.50 0.00 0.00 46.19 42.89 1nd6 s LEU 2311CO 0.04 -0.97 1.98 -0.81 -1.32 0.00 0.00 176.35 175.26 1nd6 n PRO 2312N 7.11 2.01 0.00 0.98 -0.04 -1.26 -0.64 135.00 143.16 1nd6 n PRO 2312Ca 0.16 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.32 1nd6 n PRO 2312Cb 0.45 -2.71 0.00 0.00 -0.04 0.00 0.00 33.50 31.19 1nd6 n PRO 2312CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nd6 n GLY 2313N 4.92 1.63 0.00 0.55 0.00 -1.26 -5.07 105.19 105.96 1nd6 n GLY 2313Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1nd6 n GLY 2313CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd6 s SER 2315N -0.16 3.90 0.48 0.00 1.04 -1.26 -4.71 113.70 113.00 1nd6 s SER 2315Ca 0.00 -1.22 0.29 0.00 0.48 0.00 0.00 55.95 55.49 1nd6 s SER 2315Cb 0.00 -0.40 1.36 0.00 0.10 0.00 0.00 66.02 67.07 1nd6 s SER 2315CO 0.00 -0.32 1.78 -0.65 0.98 0.00 0.00 173.24 175.03 1nd6 h PRO 2316N 1.86 0.16 -3.48 4.02 0.11 -1.92 -2.72 132.00 130.02 1nd6 h PRO 2316Ca -0.43 -0.01 -0.71 0.00 0.11 0.00 0.00 66.00 64.96 1nd6 h PRO 2316Cb 1.25 -0.04 -0.34 0.00 0.11 0.00 0.00 31.00 31.98 1nd6 h PRO 2316CO 0.74 0.11 -0.21 0.45 -0.21 0.00 0.00 178.00 178.88 1nd6 s SER 2317N -5.18 5.69 -0.24 -2.05 0.15 -1.26 -4.35 113.70 106.45 1nd6 s SER 2317Ca -0.07 -3.22 -0.21 0.00 0.70 0.00 0.00 55.95 53.15 1nd6 s SER 2317Cb 0.24 -1.91 -0.02 0.00 -1.71 0.00 0.00 66.02 62.63 1nd6 s SER 2317CO 0.80 -0.31 0.67 0.00 1.20 0.00 0.00 173.24 175.61 1nd6 s PRO 2319N 2.47 4.17 0.16 0.00 0.04 -1.26 0.25 135.00 140.83 1nd6 s PRO 2319Ca 0.28 2.49 -0.19 0.00 0.04 0.00 0.00 61.00 63.62 1nd6 s PRO 2319Cb -0.16 -3.18 0.09 0.00 0.04 0.00 0.00 34.50 31.29 1nd6 s PRO 2319CO 0.09 -0.70 1.27 -0.11 0.04 0.00 0.00 177.00 177.58 1nd6 n LEU 2320N 4.23 -0.68 -0.30 -3.56 7.94 -0.86 0.15 117.00 123.92 1nd6 n LEU 2320Ca 0.15 1.44 0.11 0.00 -1.11 0.00 0.00 56.01 56.60 1nd6 n LEU 2320Cb 0.37 -0.27 0.28 0.00 0.53 0.00 0.00 43.42 44.33 1nd6 n LEU 2320CO 0.63 -1.24 1.07 -0.33 -1.11 0.00 0.00 177.39 176.41 1nd6 h GLU 2321N 0.00 0.48 -0.25 1.96 5.08 -1.90 0.42 114.58 120.37 1nd6 h GLU 2321Ca 0.22 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.42 1nd6 h GLU 2321Cb 0.42 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1nd6 h GLU 2321CO -0.80 0.32 -0.35 -0.09 -1.00 0.00 0.00 179.01 177.09 1nd6 h ARG 2322N 0.49 0.68 -0.06 2.33 9.65 -0.66 -2.41 114.38 124.41 1nd6 h ARG 2322Ca 0.52 -0.40 0.03 0.00 -1.10 0.00 0.00 59.98 59.04 1nd6 h ARG 2322Cb 0.90 0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.47 1nd6 h ARG 2322CO -0.46 1.01 -0.18 0.35 2.80 0.00 0.00 179.97 183.49 1nd6 h PHE 2323N 0.40 -0.46 -0.54 2.20 3.57 0.65 -0.44 116.94 122.32 1nd6 h PHE 2323Ca 0.03 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.65 1nd6 h PHE 2323Cb 0.93 0.21 -0.08 0.00 2.79 0.00 0.00 35.95 39.81 1nd6 h PHE 2323CO 0.08 -0.25 0.09 0.00 -2.23 0.00 0.00 178.31 175.99 1nd6 h ALA 2324N 0.71 0.60 0.14 2.41 0.00 -0.21 -1.92 119.26 120.98 1nd6 h ALA 2324Ca 0.07 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1nd6 h ALA 2324Cb 0.36 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1nd6 h ALA 2324CO -0.21 -0.32 -0.10 0.93 0.00 0.00 0.00 179.25 179.55 1nd6 h GLU 2325N 0.22 -0.23 0.00 0.00 5.08 -0.82 -0.97 114.58 117.87 1nd6 h GLU 2325Ca 0.28 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.64 1nd6 h GLU 2325Cb 0.40 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1nd6 h GLU 2325CO -0.38 -0.15 -0.05 -0.07 -1.00 0.00 0.00 179.01 177.36 1nd6 h LEU 2326N -0.23 0.00 0.00 1.33 3.38 -0.79 -2.25 115.31 116.75 1nd6 h LEU 2326Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1nd6 h LEU 2326Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1nd6 h LEU 2326CO 0.00 0.05 -0.80 0.58 0.09 0.00 0.00 178.44 178.37 1nd6 h VAL 2327N 0.00 0.00 -0.88 1.22 2.07 -1.14 -3.39 116.25 114.13 1nd6 h VAL 2327Ca -0.00 -0.84 0.21 0.00 0.82 0.00 0.00 66.70 66.89 1nd6 h VAL 2327Cb 0.10 1.41 -0.16 0.00 -1.52 0.00 0.00 31.29 31.12 1nd6 h VAL 2327CO 0.01 0.00 -0.04 1.23 0.02 0.00 0.00 177.57 178.79 1nd6 h GLY 2328N 4.16 0.95 2.00 2.17 0.00 -0.54 -1.22 103.07 110.59 1nd6 h GLY 2328Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1nd6 h GLY 2328CO 0.00 -0.38 0.00 -1.55 0.00 0.00 0.00 176.54 174.61 1nd6 n PRO 2329N -5.45 0.16 -0.13 4.80 -0.04 -1.26 -2.46 135.00 130.63 1nd6 n PRO 2329Ca 0.17 0.56 0.10 0.00 -0.04 0.00 0.00 63.50 64.29 1nd6 n PRO 2329Cb 0.57 -1.92 0.16 0.00 -0.04 0.00 0.00 33.50 32.27 1nd6 n PRO 2329CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1nd6 n VAL 2330N -2.25 0.39 -3.84 0.52 0.24 -0.46 -4.73 118.33 108.19 1nd6 n VAL 2330Ca -0.00 -0.69 -0.35 0.00 -2.04 0.00 0.00 64.34 61.25 1nd6 n VAL 2330Cb 0.11 1.07 -0.10 0.00 -1.47 0.00 0.00 33.84 33.45 1nd6 n VAL 2330CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1nd6 s ILE 2331N -1.44 4.94 0.51 1.34 1.01 -1.03 -3.09 121.20 123.45 1nd6 s ILE 2331Ca 0.31 0.03 -0.19 0.00 0.00 0.00 0.00 60.65 60.80 1nd6 s ILE 2331Cb 0.19 -3.27 -0.07 0.00 0.01 0.00 0.00 42.46 39.32 1nd6 s ILE 2331CO 0.27 0.40 1.04 -2.16 0.00 0.00 0.00 174.94 174.49 1nd6 s PRO 2332N 0.77 3.68 0.00 2.79 0.04 -1.26 -4.97 135.00 136.07 1nd6 s PRO 2332Ca 0.05 1.30 0.19 0.00 0.04 0.00 0.00 61.00 62.58 1nd6 s PRO 2332Cb -0.13 -2.08 -0.15 0.00 0.04 0.00 0.00 34.50 32.17 1nd6 s PRO 2332CO 0.02 -0.52 0.84 1.04 0.04 0.00 0.00 177.00 178.42 1nd6 n GLN 2333N -1.27 0.97 -2.69 4.56 1.13 -1.26 -4.74 117.38 114.08 1nd6 n GLN 2333Ca 0.09 -0.23 -0.02 0.00 -1.94 0.00 0.00 57.00 54.91 1nd6 n GLN 2333Cb 0.53 -1.38 0.03 0.00 0.11 0.00 0.00 30.24 29.52 1nd6 n GLN 2333CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1nd6 s ASP 2334N -2.63 -0.23 0.23 1.08 3.68 -1.26 -5.06 116.67 112.48 1nd6 s ASP 2334Ca 0.09 -0.23 -0.11 0.00 2.13 0.00 0.00 52.55 54.44 1nd6 s ASP 2334Cb 0.15 0.30 0.33 0.00 -1.45 0.00 0.00 42.92 42.25 1nd6 s ASP 2334CO 0.70 -0.01 1.62 -0.25 0.13 0.00 0.00 175.17 177.36 1nd6 h TRP 2335N 4.52 -0.27 0.01 -5.34 7.01 -1.91 -0.32 115.95 119.65 1nd6 h TRP 2335Ca -0.02 0.06 0.03 0.00 2.11 0.00 0.00 58.89 61.07 1nd6 h TRP 2335Cb 1.19 0.23 -0.05 0.00 -2.10 0.00 0.00 29.16 28.43 1nd6 h TRP 2335CO -0.10 -0.29 -0.44 1.03 -2.79 0.00 0.00 178.44 175.86 1nd6 h SER 2336N 0.03 -1.32 -0.29 2.65 0.87 -1.98 -0.68 113.55 112.82 1nd6 h SER 2336Ca 0.36 0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 61.06 1nd6 h SER 2336Cb 0.58 0.51 -0.01 0.00 -0.44 0.00 0.00 62.40 63.04 1nd6 h SER 2336CO -0.71 -0.47 0.11 0.74 -0.53 0.00 0.00 176.83 175.97 1nd6 h THR 2337N -0.60 1.19 0.00 2.23 2.02 -1.82 -2.19 112.91 113.74 1nd6 h THR 2337Ca 0.04 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1nd6 h THR 2337Cb 0.67 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 1nd6 h THR 2337CO -0.32 0.20 0.00 -0.62 0.37 0.00 0.00 175.52 175.15 1nd6 n GLU 2338N -4.73 0.00 0.00 6.66 1.02 -0.19 -1.02 120.64 122.39 1nd6 n GLU 2338Ca -0.02 0.40 0.13 0.00 -0.02 0.00 0.00 57.16 57.65 1nd6 n GLU 2338Cb 0.15 -1.50 0.37 0.00 -0.02 0.00 0.00 31.44 30.44 1nd6 n GLU 2338CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nd6 s MET 2340N -2.26 3.63 0.00 0.00 -1.94 -0.19 -1.11 119.30 117.43 1nd6 s MET 2340Ca 0.29 1.73 0.00 0.00 -1.71 0.00 0.00 55.69 56.00 1nd6 s MET 2340Cb 0.20 -2.28 0.00 0.00 2.01 0.00 0.00 34.83 34.76 1nd6 s MET 2340CO 0.43 -0.65 0.32 0.25 -0.01 0.00 0.00 175.02 175.37