#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y1q h ASP 2005N 0.00 0.00 -2.64 6.43 3.32 -1.12 -3.46 116.42 118.95 1y1q h ASP 2005Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1y1q h ASP 2005Cb 0.00 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.46 1y1q h ASP 2005CO 0.00 0.88 -0.62 0.68 -1.72 0.00 0.00 179.24 178.46 1y1q s VAL 2006N -2.74 3.93 -0.37 -1.35 -7.23 -1.23 -5.05 120.40 106.36 1y1q s VAL 2006Ca -0.00 -1.43 0.21 0.00 -1.81 0.00 0.00 61.98 58.94 1y1q s VAL 2006Cb 0.09 -3.02 0.26 0.00 0.56 0.00 0.00 36.38 34.27 1y1q s VAL 2006CO 0.81 -0.19 1.54 0.15 -0.31 0.00 0.00 175.10 177.10 1y1q h PHE 2007N 2.35 0.00 0.00 2.82 3.57 -1.95 -3.39 116.94 120.34 1y1q h PHE 2007Ca -0.47 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 60.88 1y1q h PHE 2007Cb 1.21 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.93 1y1q h PHE 2007CO 0.62 0.12 -1.58 0.72 -2.23 0.00 0.00 178.31 175.96 1y1q n HIS 2008N -3.11 0.00 1.29 0.41 8.25 -1.26 -4.75 115.22 116.05 1y1q n HIS 2008Ca 0.03 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.64 1y1q n HIS 2008Cb 0.58 -0.39 0.69 0.00 1.12 0.00 0.00 29.99 31.99 1y1q n HIS 2008CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1y1q n LEU 2009N -2.83 0.06 -3.50 2.41 4.77 -1.26 -4.79 117.00 111.85 1y1q n LEU 2009Ca -0.18 0.31 -0.19 0.00 -0.03 0.00 0.00 56.01 55.92 1y1q n LEU 2009Cb 0.69 -0.34 0.06 0.00 -2.33 0.00 0.00 43.42 41.50 1y1q n LEU 2009CO 0.10 0.01 0.02 0.61 -1.33 0.00 0.00 177.39 176.79 1y1q n GLY 2010N 1.35 -0.58 3.17 -0.72 0.00 -1.26 -4.70 105.19 102.45 1y1q n GLY 2010Ca 0.12 0.25 -0.10 0.00 0.00 0.00 0.00 46.02 46.29 1y1q n GLY 2010CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y1q s LEU 2011N -6.25 1.94 0.10 0.99 1.43 -1.26 -4.79 118.68 110.83 1y1q s LEU 2011Ca 0.15 -1.18 0.06 0.00 -1.03 0.00 0.00 54.13 52.13 1y1q s LEU 2011Cb -0.03 0.19 -0.03 0.00 0.03 0.00 0.00 46.19 46.35 1y1q s LEU 2011CO 0.77 -0.67 -0.15 0.42 0.23 0.00 0.00 176.35 176.95 1y1q s THR 2012N -3.93 1.27 0.50 5.49 -4.23 -1.26 -0.41 115.64 113.06 1y1q s THR 2012Ca 0.22 -1.50 0.27 0.00 -1.18 0.00 0.00 61.69 59.51 1y1q s THR 2012Cb 0.07 -1.31 0.46 0.00 1.34 0.00 0.00 72.50 73.05 1y1q s THR 2012CO 0.01 -0.29 1.86 0.50 -0.54 0.00 0.00 174.62 176.17 1y1q h LYS 2013N 3.95 0.13 -0.72 3.99 3.64 -1.95 0.46 116.57 126.08 1y1q h LYS 2013Ca -0.41 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 58.97 1y1q h LYS 2013Cb 1.19 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.95 1y1q h LYS 2013CO 0.44 0.09 0.47 -0.97 -2.27 0.00 0.00 179.45 177.21 1y1q h ASN 2014N 0.14 0.83 -0.32 4.20 -1.24 -1.94 -2.70 115.58 114.55 1y1q h ASN 2014Ca 0.47 -0.03 0.09 0.00 0.71 0.00 0.00 56.30 57.54 1y1q h ASN 2014Cb 1.61 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 40.44 1y1q h ASN 2014CO -0.08 0.61 0.23 0.44 -1.29 0.00 0.00 177.43 177.34 1y1q h ASP 2015N 0.97 0.00 1.15 1.15 3.32 -0.46 -1.98 116.42 120.58 1y1q h ASP 2015Ca 0.26 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 1y1q h ASP 2015Cb -0.10 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1y1q h ASP 2015CO -0.06 0.00 -0.28 -0.07 -1.72 0.00 0.00 179.24 177.11 1y1q h LEU 2016N 0.00 0.00 1.64 1.55 4.07 -1.49 -3.47 115.31 117.61 1y1q h LEU 2016Ca 0.15 0.00 -0.34 0.00 0.08 0.00 0.00 57.88 57.77 1y1q h LEU 2016Cb 0.61 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.36 1y1q h LEU 2016CO -0.00 0.28 -0.47 0.00 -1.08 0.00 0.00 178.44 177.17 1y1q n GLN 2017N -3.33 -2.64 -0.38 1.13 1.13 -0.75 -2.11 117.38 110.45 1y1q n GLN 2017Ca 0.01 0.80 0.00 0.00 -1.94 0.00 0.00 57.00 55.86 1y1q n GLN 2017Cb 0.52 -5.29 0.00 0.00 0.11 0.00 0.00 30.24 25.58 1y1q n GLN 2017CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1y1q n GLY 2018N -1.19 1.31 3.53 1.08 0.00 -1.26 -4.70 105.19 103.96 1y1q n GLY 2018Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1y1q n GLY 2018CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y1q n ALA 2019N -0.32 -0.63 -0.45 4.61 0.00 -0.90 -4.90 120.51 117.92 1y1q n ALA 2019Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1y1q n ALA 2019Cb 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1y1q n ALA 2019CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1y1q n GLN 2020N 0.18 -0.08 -4.54 0.00 6.02 -1.26 -4.40 117.38 113.31 1y1q n GLN 2020Ca 0.11 -0.22 -0.22 0.00 -0.01 0.00 0.00 57.00 56.66 1y1q n GLN 2020Cb 0.41 -0.70 -0.14 0.00 1.02 0.00 0.00 30.24 30.83 1y1q n GLN 2020CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1y1q s LEU 2021N -0.11 2.09 -0.01 1.08 0.20 -1.26 0.21 118.68 120.89 1y1q s LEU 2021Ca 0.00 -0.36 0.00 0.00 0.69 0.00 0.00 54.13 54.47 1y1q s LEU 2021Cb 0.00 -0.70 0.01 0.00 -0.43 0.00 0.00 46.19 45.07 1y1q s LEU 2021CO 0.00 0.12 -0.01 0.00 -0.29 0.00 0.00 176.35 176.17 1y1q s ALA 2022N -0.57 0.18 -0.18 5.97 0.00 -0.20 -1.90 121.76 125.05 1y1q s ALA 2022Ca 0.04 0.04 -0.15 0.00 0.00 0.00 0.00 51.96 51.89 1y1q s ALA 2022Cb -0.07 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 1y1q s ALA 2022CO 0.00 -0.01 0.36 0.42 0.00 0.00 0.00 175.76 176.53 1y1q s ILE 2023N 0.36 5.24 -0.39 0.00 1.01 -0.09 -1.38 121.20 125.95 1y1q s ILE 2023Ca -0.03 0.64 0.03 0.00 0.00 0.00 0.00 60.65 61.29 1y1q s ILE 2023Cb -0.06 -3.69 0.11 0.00 0.01 0.00 0.00 42.46 38.84 1y1q s ILE 2023CO -0.01 0.31 0.13 0.68 0.00 0.00 0.00 174.94 176.05 1y1q s VAL 2024N 0.98 1.98 0.87 2.92 -7.23 0.40 -1.60 120.40 118.72 1y1q s VAL 2024Ca 0.18 -2.43 -0.10 0.00 -1.81 0.00 0.00 61.98 57.82 1y1q s VAL 2024Cb -0.14 -2.44 0.17 0.00 0.56 0.00 0.00 36.38 34.53 1y1q s VAL 2024CO 0.07 -0.70 1.20 -2.16 -0.31 0.00 0.00 175.10 173.20 1y1q s PRO 2025N 0.68 1.04 -0.14 4.82 0.04 -1.21 -3.86 135.00 136.38 1y1q s PRO 2025Ca 0.13 -0.68 -0.09 0.00 0.04 0.00 0.00 61.00 60.41 1y1q s PRO 2025Cb -0.21 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.27 1y1q s PRO 2025CO -0.08 -2.04 -0.16 0.78 0.04 0.00 0.00 177.00 175.54 1y1q h GLY 2026N -1.22 0.00 -5.01 0.56 0.00 -1.83 -0.48 103.07 95.10 1y1q h GLY 2026Ca -0.41 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.36 1y1q h GLY 2026CO 0.39 0.00 0.89 -0.35 0.00 0.00 0.00 176.54 177.47 1y1q s ASP 2027N -5.73 6.87 0.42 0.19 3.68 -1.26 -1.70 116.67 119.14 1y1q s ASP 2027Ca -0.14 1.97 0.15 0.00 2.13 0.00 0.00 52.55 56.67 1y1q s ASP 2027Cb 0.02 -2.55 1.04 0.00 -1.45 0.00 0.00 42.92 39.98 1y1q s ASP 2027CO 0.20 -0.75 1.91 -0.65 0.13 0.00 0.00 175.17 176.01 1y1q h PRO 2028N 8.23 0.42 -0.46 4.34 0.11 -1.90 -1.01 132.00 141.72 1y1q h PRO 2028Ca -0.34 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.78 1y1q h PRO 2028Cb 1.15 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1y1q h PRO 2028CO 0.93 0.28 0.31 0.93 -0.21 0.00 0.00 178.00 180.23 1y1q h GLU 2029N 0.43 0.49 0.00 1.05 4.39 -1.96 -0.75 114.58 118.23 1y1q h GLU 2029Ca 0.38 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1y1q h GLU 2029Cb 0.87 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 1y1q h GLU 2029CO -0.13 0.32 0.00 0.54 -1.16 0.00 0.00 179.01 178.58 1y1q n ARG 2030N -4.48 0.04 0.22 2.33 3.00 -0.38 -4.11 116.66 113.28 1y1q n ARG 2030Ca 0.05 0.05 -0.15 0.00 -0.01 0.00 0.00 57.85 57.79 1y1q n ARG 2030Cb 0.15 -1.54 -0.07 0.00 0.00 0.00 0.00 32.46 31.00 1y1q n ARG 2030CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1y1q h VAL 2031N 0.00 0.39 -0.59 1.55 2.07 -1.17 -2.86 116.25 115.64 1y1q h VAL 2031Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1y1q h VAL 2031Cb 0.51 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1y1q h VAL 2031CO 0.00 0.00 0.29 -0.08 0.02 0.00 0.00 177.57 177.80 1y1q h GLU 2032N -0.66 0.84 -0.71 1.57 4.81 -1.74 -2.40 114.58 116.29 1y1q h GLU 2032Ca -0.03 -0.12 0.11 0.00 -0.13 0.00 0.00 59.36 59.20 1y1q h GLU 2032Cb 0.57 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.75 1y1q h GLU 2032CO -0.02 0.67 0.47 0.87 -0.73 0.00 0.00 179.01 180.28 1y1q h LYS 2033N 0.80 0.50 -0.06 1.92 1.57 -1.75 0.45 116.57 120.00 1y1q h LYS 2033Ca 0.20 -0.03 -0.25 0.00 -1.87 0.00 0.00 60.65 58.70 1y1q h LYS 2033Cb 0.10 -0.11 0.02 0.00 0.08 0.00 0.00 32.23 32.32 1y1q h LYS 2033CO -0.03 0.33 -0.94 0.82 -0.57 0.00 0.00 179.45 179.07 1y1q h ILE 2034N 0.52 1.28 0.00 1.86 2.04 -1.21 -3.19 117.51 118.81 1y1q h ILE 2034Ca 0.34 -2.14 -0.06 0.00 1.00 0.00 0.00 64.86 64.00 1y1q h ILE 2034Cb 0.61 2.22 -0.01 0.00 -0.74 0.00 0.00 36.82 38.89 1y1q h ILE 2034CO -0.11 0.67 -0.31 0.00 0.00 0.00 0.00 178.15 178.40 1y1q h ALA 2035N 0.47 1.00 0.00 1.87 0.00 -0.90 -2.84 119.26 118.86 1y1q h ALA 2035Ca -0.10 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1y1q h ALA 2035Cb 1.58 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.32 1y1q h ALA 2035CO 0.19 0.38 -0.01 0.00 0.00 0.00 0.00 179.25 179.81 1y1q h ALA 2036N 1.69 1.02 -0.04 0.00 0.00 -0.92 -1.59 119.26 119.42 1y1q h ALA 2036Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1y1q h ALA 2036Cb 0.84 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1y1q h ALA 2036CO 0.04 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.59 1y1q n LEU 2037N -3.13 0.72 0.00 0.00 4.77 -1.07 -4.85 117.00 113.44 1y1q n LEU 2037Ca -0.01 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 1y1q n LEU 2037Cb 0.22 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1y1q n LEU 2037CO 0.25 0.14 0.00 0.23 -1.33 0.00 0.00 177.39 176.67 1y1q n MET 2038N -0.38 3.88 -4.25 3.23 2.81 -0.60 -5.13 117.12 116.68 1y1q n MET 2038Ca 0.19 0.00 -0.33 0.00 -1.81 0.00 0.00 57.70 55.75 1y1q n MET 2038Cb 0.21 0.00 -0.08 0.00 -0.71 0.00 0.00 33.22 32.63 1y1q n MET 2038CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1y1q s ASP 2039N 0.62 5.23 -1.09 7.83 1.01 0.48 -4.71 116.67 126.04 1y1q s ASP 2039Ca 0.00 0.03 -0.23 0.00 0.71 0.00 0.00 52.55 53.05 1y1q s ASP 2039Cb 0.00 -1.40 0.03 0.00 1.01 0.00 0.00 42.92 42.56 1y1q s ASP 2039CO 0.00 0.28 0.68 0.29 0.21 0.00 0.00 175.17 176.63 1y1q n LYS 2040N 1.37 -0.72 -2.65 8.23 4.76 -1.26 0.89 118.16 128.79 1y1q n LYS 2040Ca -0.14 0.33 -0.42 0.00 -2.87 0.00 0.00 58.31 55.21 1y1q n LYS 2040Cb 0.53 -2.74 -0.03 0.00 -1.84 0.00 0.00 35.03 30.95 1y1q n LYS 2040CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1y1q s PRO 2041N -6.50 4.45 -0.01 1.97 0.04 -1.26 -4.32 135.00 129.37 1y1q s PRO 2041Ca 0.35 1.46 0.01 0.00 0.04 0.00 0.00 61.00 62.87 1y1q s PRO 2041Cb -0.18 -3.51 0.00 0.00 0.04 0.00 0.00 34.50 30.85 1y1q s PRO 2041CO 0.93 -0.25 -0.04 0.08 0.04 0.00 0.00 177.00 177.76 1y1q s VAL 2042N 1.69 0.35 0.26 -0.36 1.01 -0.53 -4.98 120.40 117.84 1y1q s VAL 2042Ca 0.51 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 1y1q s VAL 2042Cb -0.21 -0.32 -0.10 0.00 0.00 0.00 0.00 36.38 35.75 1y1q s VAL 2042CO 0.22 0.12 1.35 -0.75 0.00 0.00 0.00 175.10 176.04 1y1q s LYS 2043N 0.16 4.34 -0.13 2.72 2.47 -1.26 -1.27 119.74 126.77 1y1q s LYS 2043Ca -0.01 2.19 -0.11 0.00 -1.56 0.00 0.00 55.97 56.48 1y1q s LYS 2043Cb -0.05 -3.12 -0.06 0.00 -1.46 0.00 0.00 37.83 33.14 1y1q s LYS 2043CO -0.00 -0.28 -0.23 1.28 0.16 0.00 0.00 175.35 176.27 1y1q n LEU 2044N 1.86 1.49 -3.81 5.43 4.77 -0.10 -4.88 117.00 121.76 1y1q n LEU 2044Ca 0.04 0.25 -0.05 0.00 -0.03 0.00 0.00 56.01 56.22 1y1q n LEU 2044Cb 0.42 -0.58 -0.01 0.00 -2.33 0.00 0.00 43.42 40.92 1y1q n LEU 2044CO 0.59 -0.05 0.61 0.00 -1.33 0.00 0.00 177.39 177.21 1y1q s ALA 2045N -2.48 -1.42 -0.30 -1.18 0.00 -0.96 -4.98 121.76 110.44 1y1q s ALA 2045Ca -0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 51.96 51.60 1y1q s ALA 2045Cb 0.06 0.74 0.18 0.00 0.00 0.00 0.00 23.12 24.10 1y1q s ALA 2045CO 0.30 -1.04 0.59 0.45 0.00 0.00 0.00 175.76 176.06 1y1q s SER 2046N -2.95 -1.26 -0.13 0.00 0.15 -1.26 -1.09 113.70 107.15 1y1q s SER 2046Ca 0.12 0.89 -0.04 0.00 0.70 0.00 0.00 55.95 57.62 1y1q s SER 2046Cb -0.04 2.11 0.05 0.00 -1.71 0.00 0.00 66.02 66.44 1y1q s SER 2046CO 0.05 -0.26 0.10 -1.00 1.20 0.00 0.00 173.24 173.33 1y1q s HIS 2047N 2.84 0.09 0.00 3.44 3.76 -0.88 -4.97 115.29 119.56 1y1q s HIS 2047Ca 0.18 -0.05 0.00 0.00 -0.15 0.00 0.00 55.06 55.05 1y1q s HIS 2047Cb -0.15 -0.57 0.00 0.00 1.11 0.00 0.00 32.58 32.97 1y1q s HIS 2047CO -0.20 -0.42 0.00 0.54 -0.85 0.00 0.00 174.74 173.81 1y1q n ARG 2048N 5.29 0.00 0.00 1.40 1.74 -1.26 -1.78 116.66 122.05 1y1q n ARG 2048Ca -0.06 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.06 1y1q n ARG 2048Cb 0.49 0.00 0.20 0.00 -1.02 0.00 0.00 32.46 32.13 1y1q n ARG 2048CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1y1q n GLU 2049N 2.87 0.75 -3.34 5.56 -0.58 -1.26 -4.47 120.64 120.17 1y1q n GLU 2049Ca 0.00 0.00 -0.46 0.00 -0.42 0.00 0.00 57.16 56.28 1y1q n GLU 2049Cb 0.00 -1.14 -0.02 0.00 -0.57 0.00 0.00 31.44 29.72 1y1q n GLU 2049CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1y1q s PHE 2050N -2.00 3.91 -0.23 -0.32 2.99 -0.73 -4.19 117.98 117.40 1y1q s PHE 2050Ca 0.10 -2.22 -0.05 0.00 0.00 0.00 0.00 56.93 54.77 1y1q s PHE 2050Cb 0.05 -3.81 -0.01 0.00 0.00 0.00 0.00 43.02 39.24 1y1q s PHE 2050CO 0.08 -0.98 -0.01 0.95 -0.00 0.00 0.00 175.22 175.26 1y1q s THR 2051N -0.27 3.55 0.00 0.64 -4.23 -1.26 -2.08 115.64 112.00 1y1q s THR 2051Ca 0.22 -0.48 0.03 0.00 -1.18 0.00 0.00 61.69 60.27 1y1q s THR 2051Cb -0.10 -2.65 -0.03 0.00 1.34 0.00 0.00 72.50 71.05 1y1q s THR 2051CO -0.09 0.37 -0.06 -0.94 -0.54 0.00 0.00 174.62 173.36 1y1q s SER 2052N 1.50 4.69 0.17 3.99 1.04 -0.25 -2.99 113.70 121.84 1y1q s SER 2052Ca 0.05 -0.12 0.07 0.00 0.48 0.00 0.00 55.95 56.43 1y1q s SER 2052Cb -0.15 -1.11 -0.04 0.00 0.10 0.00 0.00 66.02 64.82 1y1q s SER 2052CO -0.02 0.28 -0.15 0.26 0.98 0.00 0.00 173.24 174.60 1y1q s TRP 2053N -1.00 1.61 -0.07 5.02 0.52 -0.08 -0.92 118.94 124.01 1y1q s TRP 2053Ca 0.17 -0.57 0.01 0.00 0.02 0.00 0.00 56.10 55.74 1y1q s TRP 2053Cb -0.11 -0.79 0.02 0.00 -1.15 0.00 0.00 33.47 31.44 1y1q s TRP 2053CO 0.08 0.27 -0.08 0.50 0.02 0.00 0.00 176.95 177.74 1y1q s ARG 2054N -3.24 1.39 0.30 4.98 3.52 -0.39 -1.26 118.95 124.24 1y1q s ARG 2054Ca 0.17 -0.27 0.03 0.00 -0.13 0.00 0.00 55.73 55.54 1y1q s ARG 2054Cb -0.02 -1.31 -0.01 0.00 -1.56 0.00 0.00 34.95 32.05 1y1q s ARG 2054CO 0.05 -0.10 0.11 0.00 -0.81 0.00 0.00 175.30 174.55 1y1q n ALA 2055N 4.27 0.43 -2.41 6.12 0.00 -0.02 -1.45 120.51 127.46 1y1q n ALA 2055Ca -0.19 -1.53 -0.28 0.00 0.00 0.00 0.00 53.44 51.44 1y1q n ALA 2055Cb 0.51 1.04 -0.16 0.00 0.00 0.00 0.00 19.45 20.85 1y1q n ALA 2055CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1y1q s GLU 2056N -3.14 1.75 -0.21 0.00 2.02 0.26 -0.06 118.70 119.31 1y1q s GLU 2056Ca 0.16 -0.77 -0.02 0.00 0.02 0.00 0.00 54.97 54.36 1y1q s GLU 2056Cb 0.01 -1.69 0.06 0.00 0.10 0.00 0.00 34.13 32.61 1y1q s GLU 2056CO 0.11 0.46 0.02 -1.17 0.02 0.00 0.00 175.26 174.71 1y1q s LEU 2057N -0.52 1.61 -1.41 1.80 2.96 0.24 -0.38 118.68 122.97 1y1q s LEU 2057Ca 0.08 -0.97 -0.07 0.00 -0.22 0.00 0.00 54.13 52.95 1y1q s LEU 2057Cb -0.08 -0.76 0.04 0.00 0.50 0.00 0.00 46.19 45.88 1y1q s LEU 2057CO -0.01 -0.30 0.87 0.47 -1.32 0.00 0.00 176.35 176.06 1y1q n ASP 2058N 4.94 -3.17 0.00 3.68 10.43 -1.26 -2.22 116.55 128.95 1y1q n ASP 2058Ca -0.09 -0.78 0.00 0.00 2.57 0.00 0.00 54.79 56.49 1y1q n ASP 2058Cb 0.46 -4.08 0.00 0.00 1.84 0.00 0.00 41.12 39.34 1y1q n ASP 2058CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1y1q n GLY 2059N -1.65 2.10 3.59 0.44 0.00 -1.26 -5.03 105.19 103.38 1y1q n GLY 2059Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 1y1q n GLY 2059CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y1q s LYS 2060N -0.42 3.08 0.22 1.61 1.02 -0.94 -5.08 119.74 119.23 1y1q s LYS 2060Ca 0.00 -0.49 -0.30 0.00 0.02 0.00 0.00 55.97 55.20 1y1q s LYS 2060Cb 0.00 -2.75 -0.08 0.00 -0.52 0.00 0.00 37.83 34.48 1y1q s LYS 2060CO 0.00 0.56 1.15 0.00 -0.92 0.00 0.00 175.35 176.14 1y1q s ALA 2061N -0.52 3.41 0.03 5.17 0.00 -1.26 -0.60 121.76 128.00 1y1q s ALA 2061Ca 0.08 0.92 0.03 0.00 0.00 0.00 0.00 51.96 52.99 1y1q s ALA 2061Cb -0.12 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 1y1q s ALA 2061CO 0.02 -0.28 -0.10 0.14 0.00 0.00 0.00 175.76 175.54 1y1q s VAL 2062N -0.48 0.78 -0.07 0.00 -7.23 0.91 -4.11 120.40 110.20 1y1q s VAL 2062Ca 0.49 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 59.76 1y1q s VAL 2062Cb -0.32 -0.75 -0.03 0.00 0.56 0.00 0.00 36.38 35.84 1y1q s VAL 2062CO 0.38 -0.12 -0.04 -0.63 -0.31 0.00 0.00 175.10 174.38 1y1q s ILE 2063N -0.93 3.96 -0.21 -0.62 1.09 -0.80 -0.84 121.20 122.86 1y1q s ILE 2063Ca -0.03 -0.42 0.01 0.00 -1.10 0.00 0.00 60.65 59.12 1y1q s ILE 2063Cb -0.08 -2.66 0.03 0.00 -1.06 0.00 0.00 42.46 38.70 1y1q s ILE 2063CO 0.01 0.57 -0.17 -0.69 -0.10 0.00 0.00 174.94 174.57 1y1q s VAL 2064N -0.87 2.14 -0.03 2.92 1.01 -0.39 -0.91 120.40 124.27 1y1q s VAL 2064Ca 0.14 -1.15 0.01 0.00 0.00 0.00 0.00 61.98 60.98 1y1q s VAL 2064Cb -0.11 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 34.26 1y1q s VAL 2064CO 0.03 0.35 -0.05 0.00 0.00 0.00 0.00 175.10 175.43 1y1q s SER 2066N 0.59 6.32 -0.09 0.00 1.04 -1.16 -3.31 113.70 117.08 1y1q s SER 2066Ca -0.07 1.70 0.05 0.00 0.48 0.00 0.00 55.95 58.11 1y1q s SER 2066Cb -0.11 -2.52 -0.09 0.00 0.10 0.00 0.00 66.02 63.39 1y1q s SER 2066CO -0.00 -0.80 -0.02 0.35 0.98 0.00 0.00 173.24 173.76 1y1q n THR 2067N -1.62 0.60 0.00 2.02 -2.24 -0.19 -4.47 114.28 108.39 1y1q n THR 2067Ca 0.08 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1y1q n THR 2067Cb 0.53 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 1y1q n THR 2067CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y1q n GLY 2068N 2.66 -1.31 3.73 3.38 0.00 -0.69 -4.00 105.19 108.96 1y1q n GLY 2068Ca -0.16 -2.09 -0.35 0.00 0.00 0.00 0.00 46.02 43.42 1y1q n GLY 2068CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y1q s ILE 2069N 0.00 5.40 0.00 -0.61 1.01 -1.26 -4.65 121.20 121.08 1y1q s ILE 2069Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.88 1y1q s ILE 2069Cb 0.00 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.98 1y1q s ILE 2069CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 174.94 175.98 1y1q n GLY 2070N 3.54 1.10 0.20 6.18 0.00 -1.26 -4.51 105.19 110.45 1y1q n GLY 2070Ca -0.15 -1.84 -0.14 0.00 0.00 0.00 0.00 46.02 43.88 1y1q n GLY 2070CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1y1q h GLY 2071N 0.00 0.71 0.49 -0.02 0.00 -1.87 -2.07 103.07 100.32 1y1q h GLY 2071Ca 0.00 -0.81 0.11 0.00 0.00 0.00 0.00 47.33 46.63 1y1q h GLY 2071CO 0.00 0.73 0.59 -2.55 0.00 0.00 0.00 176.54 175.31 1y1q h PRO 2072N 0.36 0.92 -0.20 4.80 0.11 -1.94 0.89 132.00 136.94 1y1q h PRO 2072Ca 0.02 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.99 1y1q h PRO 2072Cb 0.96 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.86 1y1q h PRO 2072CO 0.09 0.61 -0.21 1.03 -0.21 0.00 0.00 178.00 179.30 1y1q h SER 2073N 0.95 0.54 -0.69 -2.05 0.87 -1.79 -3.09 113.55 108.29 1y1q h SER 2073Ca 0.47 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1y1q h SER 2073Cb 0.44 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 1y1q h SER 2073CO -0.26 0.91 0.44 0.74 -0.53 0.00 0.00 176.83 178.13 1y1q h THR 2074N 0.17 1.19 -0.16 2.23 2.02 -0.47 -2.86 112.91 115.03 1y1q h THR 2074Ca 0.03 -0.39 0.05 0.00 0.77 0.00 0.00 66.41 66.87 1y1q h THR 2074Cb 0.76 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1y1q h THR 2074CO 0.05 0.19 0.13 0.77 0.37 0.00 0.00 175.52 177.04 1y1q h SER 2075N 0.94 0.00 0.17 4.18 4.64 0.83 -1.96 113.55 122.35 1y1q h SER 2075Ca 0.25 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.26 1y1q h SER 2075Cb -0.07 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1y1q h SER 2075CO -0.05 0.00 -1.34 0.40 -0.87 0.00 0.00 176.83 174.97 1y1q h ILE 2076N 0.00 1.28 -0.13 0.95 2.04 -1.46 -3.00 117.51 117.19 1y1q h ILE 2076Ca 0.08 -2.54 -0.04 0.00 1.00 0.00 0.00 64.86 63.35 1y1q h ILE 2076Cb 0.35 2.82 -0.00 0.00 -0.74 0.00 0.00 36.82 39.24 1y1q h ILE 2076CO -0.00 0.77 -0.08 0.00 0.00 0.00 0.00 178.15 178.84 1y1q h ALA 2077N 0.24 0.18 0.73 1.87 0.00 -1.46 -2.03 119.26 118.79 1y1q h ALA 2077Ca -0.21 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1y1q h ALA 2077Cb 2.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1y1q h ALA 2077CO 0.25 -0.01 -0.40 0.28 0.00 0.00 0.00 179.25 179.37 1y1q h VAL 2078N -0.07 0.18 -0.17 0.00 2.07 -1.50 0.45 116.25 117.21 1y1q h VAL 2078Ca 0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.58 1y1q h VAL 2078Cb 0.55 0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 1y1q h VAL 2078CO 0.02 0.00 -0.50 -0.08 0.02 0.00 0.00 177.57 177.03 1y1q h GLU 2079N -1.05 -0.48 -0.51 1.57 4.57 -1.61 0.38 114.58 117.44 1y1q h GLU 2079Ca -0.10 0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 1y1q h GLU 2079Cb 0.83 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.51 1y1q h GLU 2079CO 0.13 -0.32 0.27 0.93 -1.18 0.00 0.00 179.01 178.83 1y1q h GLU 2080N -0.50 0.70 -0.22 1.92 5.08 -1.32 -0.00 114.58 120.24 1y1q h GLU 2080Ca 0.04 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.20 1y1q h GLU 2080Cb 0.61 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1y1q h GLU 2080CO -0.43 0.53 -0.37 -0.07 -1.00 0.00 0.00 179.01 177.68 1y1q h LEU 2081N 0.71 0.51 -0.93 1.33 3.38 0.56 -2.39 115.31 118.49 1y1q h LEU 2081Ca 0.18 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1y1q h LEU 2081Cb 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1y1q h LEU 2081CO -0.03 0.84 -0.31 0.00 0.09 0.00 0.00 178.44 179.03 1y1q h ALA 2082N 1.19 0.98 -0.02 1.53 0.00 0.89 0.05 119.26 123.88 1y1q h ALA 2082Ca 0.04 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1y1q h ALA 2082Cb 0.83 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1y1q h ALA 2082CO 0.07 0.39 -0.69 1.96 0.00 0.00 0.00 179.25 180.98 1y1q h GLN 2083N 0.00 0.11 -0.00 0.00 4.20 -0.58 -2.56 115.11 116.27 1y1q h GLN 2083Ca -0.00 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1y1q h GLN 2083Cb 0.87 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1y1q h GLN 2083CO 0.04 0.76 -0.02 1.28 -0.67 0.00 0.00 178.83 180.22 1y1q n LEU 2084N -3.76 0.06 0.00 1.46 4.77 -0.94 -4.89 117.00 113.70 1y1q n LEU 2084Ca -0.02 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1y1q n LEU 2084Cb 0.68 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1y1q n LEU 2084CO 0.44 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1y1q n GLY 2085N 1.29 1.38 3.70 -0.72 0.00 -0.96 -4.78 105.19 105.10 1y1q n GLY 2085Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1y1q n GLY 2085CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y1q s ILE 2086N -2.00 2.70 -0.09 -0.61 -1.09 -0.03 -4.59 121.20 115.50 1y1q s ILE 2086Ca 0.00 0.29 0.02 0.00 -2.23 0.00 0.00 60.65 58.72 1y1q s ILE 2086Cb 0.00 -3.19 -0.01 0.00 -1.58 0.00 0.00 42.46 37.68 1y1q s ILE 2086CO 0.00 0.01 0.12 0.54 -1.23 0.00 0.00 174.94 174.37 1y1q n ARG 2087N 5.21 5.74 -4.32 2.79 5.12 0.13 -4.14 116.66 127.19 1y1q n ARG 2087Ca 0.16 -0.06 -0.21 0.00 -1.93 0.00 0.00 57.85 55.81 1y1q n ARG 2087Cb 0.39 -0.62 -0.16 0.00 -1.16 0.00 0.00 32.46 30.91 1y1q n ARG 2087CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1y1q s THR 2088N -1.04 0.73 -0.05 0.55 2.01 -0.55 -1.07 115.64 116.22 1y1q s THR 2088Ca 0.01 -0.26 0.05 0.00 0.31 0.00 0.00 61.69 61.79 1y1q s THR 2088Cb 0.01 -0.70 -0.01 0.00 0.01 0.00 0.00 72.50 71.82 1y1q s THR 2088CO 0.06 0.26 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.69 1y1q s PHE 2089N 0.65 1.90 -0.23 4.92 0.40 0.14 -1.04 117.98 124.73 1y1q s PHE 2089Ca -0.10 -0.54 -0.01 0.00 -0.60 0.00 0.00 56.93 55.68 1y1q s PHE 2089Cb -0.13 -1.27 0.06 0.00 0.51 0.00 0.00 43.02 42.20 1y1q s PHE 2089CO 0.01 -0.17 -0.00 -0.51 0.70 0.00 0.00 175.22 175.25 1y1q s LEU 2090N -0.04 2.03 -0.14 -0.37 1.43 -0.48 -1.63 118.68 119.49 1y1q s LEU 2090Ca -0.03 -1.09 -0.21 0.00 -1.03 0.00 0.00 54.13 51.76 1y1q s LEU 2090Cb -0.12 -0.93 -0.03 0.00 0.03 0.00 0.00 46.19 45.14 1y1q s LEU 2090CO 0.02 -0.28 0.64 -0.60 0.23 0.00 0.00 176.35 176.36 1y1q s ARG 2091N 1.59 4.32 -0.03 1.70 3.52 -0.43 -0.45 118.95 129.16 1y1q s ARG 2091Ca -0.02 0.70 0.04 0.00 -0.13 0.00 0.00 55.73 56.31 1y1q s ARG 2091Cb -0.18 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.68 1y1q s ARG 2091CO -0.08 -0.06 -0.13 -1.50 -0.81 0.00 0.00 175.30 172.71 1y1q s ILE 2092N 1.30 3.17 0.24 4.11 -1.16 -1.25 -0.50 121.20 127.12 1y1q s ILE 2092Ca 0.32 -0.75 -0.21 0.00 -0.51 0.00 0.00 60.65 59.50 1y1q s ILE 2092Cb -0.16 -2.28 0.06 0.00 0.61 0.00 0.00 42.46 40.69 1y1q s ILE 2092CO 0.13 0.54 0.94 -0.83 -2.81 0.00 0.00 174.94 172.91 1y1q s GLY 2093N -0.90 0.11 0.16 1.50 0.00 -0.38 -4.40 107.32 103.41 1y1q s GLY 2093Ca 0.13 -0.37 0.10 0.00 0.00 0.00 0.00 44.72 44.58 1y1q s GLY 2093CO 0.02 1.07 -0.22 -0.51 0.00 0.00 0.00 173.10 173.46 1y1q s THR 2094N -2.51 2.07 0.36 0.90 -4.23 -1.26 -0.63 115.64 110.35 1y1q s THR 2094Ca 0.18 -1.90 -0.14 0.00 -1.18 0.00 0.00 61.69 58.65 1y1q s THR 2094Cb -0.03 -1.94 0.04 0.00 1.34 0.00 0.00 72.50 71.91 1y1q s THR 2094CO 0.07 -0.15 0.71 0.28 -0.54 0.00 0.00 174.62 174.98 1y1q s THR 2095N -1.66 0.00 0.00 3.99 -1.32 0.27 -4.82 115.64 112.10 1y1q s THR 2095Ca 0.16 -1.13 0.00 0.00 -1.21 0.00 0.00 61.69 59.51 1y1q s THR 2095Cb -0.08 -2.70 0.00 0.00 -1.51 0.00 0.00 72.50 68.21 1y1q s THR 2095CO 0.08 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.10 1y1q n GLY 2096N -0.52 1.68 3.64 6.08 0.00 -1.26 -0.57 105.19 114.23 1y1q n GLY 2096Ca -0.06 -1.75 -0.05 0.00 0.00 0.00 0.00 46.02 44.16 1y1q n GLY 2096CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y1q s ALA 2097N -3.23 -2.12 -1.73 4.61 0.00 -1.07 -4.76 121.76 113.47 1y1q s ALA 2097Ca 0.00 1.75 0.15 0.00 0.00 0.00 0.00 51.96 53.87 1y1q s ALA 2097Cb 0.00 -1.55 0.22 0.00 0.00 0.00 0.00 23.12 21.78 1y1q s ALA 2097CO 0.00 -0.17 1.11 0.44 0.00 0.00 0.00 175.76 177.13 1y1q n ILE 2098N 1.47 0.32 -4.18 0.00 -5.35 -0.33 -2.02 119.36 109.27 1y1q n ILE 2098Ca -0.09 -0.66 -0.36 0.00 -0.27 0.00 0.00 62.75 61.37 1y1q n ILE 2098Cb 0.57 1.06 -0.08 0.00 -1.74 0.00 0.00 39.64 39.45 1y1q n ILE 2098CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1y1q s GLN 2099N -1.20 3.19 0.49 6.28 -1.52 -1.24 -4.73 119.66 120.94 1y1q s GLN 2099Ca 0.23 -0.31 0.28 0.00 -1.95 0.00 0.00 55.36 53.61 1y1q s GLN 2099Cb 0.14 -2.95 1.12 0.00 -0.22 0.00 0.00 33.01 31.10 1y1q s GLN 2099CO 0.20 0.71 1.90 -1.00 -0.25 0.00 0.00 175.29 176.85 1y1q h PRO 2100N 5.16 0.00 -0.16 2.91 0.13 -1.92 -3.11 132.00 135.02 1y1q h PRO 2100Ca -0.52 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1y1q h PRO 2100Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1y1q h PRO 2100CO 0.56 0.11 0.00 -2.39 -0.23 0.00 0.00 178.00 176.06 1y1q n HIS 2101N -3.26 0.20 -3.77 1.56 1.44 -1.26 -4.74 115.22 105.40 1y1q n HIS 2101Ca 0.00 -0.10 -0.36 0.00 -2.01 0.00 0.00 57.72 55.25 1y1q n HIS 2101Cb 0.37 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.36 1y1q n HIS 2101CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1y1q s ILE 2102N -1.80 4.25 0.21 0.61 -1.09 -1.18 -5.10 121.20 117.12 1y1q s ILE 2102Ca 0.25 -0.19 0.08 0.00 -2.23 0.00 0.00 60.65 58.56 1y1q s ILE 2102Cb 0.13 -2.99 -0.04 0.00 -1.58 0.00 0.00 42.46 37.98 1y1q s ILE 2102CO 0.19 0.35 -0.01 0.20 -1.23 0.00 0.00 174.94 174.44 1y1q s ASN 2103N 1.58 4.63 0.37 3.58 0.01 -1.26 -4.92 114.94 118.94 1y1q s ASN 2103Ca 0.06 -0.51 -0.26 0.00 -0.71 0.00 0.00 52.86 51.44 1y1q s ASN 2103Cb -0.15 -0.92 -0.12 0.00 0.41 0.00 0.00 41.25 40.47 1y1q s ASN 2103CO 0.03 0.05 0.96 0.55 -1.51 0.00 0.00 177.10 177.18 1y1q n VAL 2104N -0.43 2.18 0.00 1.60 3.14 -1.26 -1.39 118.33 122.16 1y1q n VAL 2104Ca -0.09 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.79 1y1q n VAL 2104Cb 0.57 -1.03 0.00 0.00 -1.06 0.00 0.00 33.84 32.32 1y1q n VAL 2104CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1y1q n GLY 2105N 1.26 1.55 3.81 7.55 0.00 0.46 -4.99 105.19 114.84 1y1q n GLY 2105Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1y1q n GLY 2105CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1y1q s ASP 2106N -2.27 5.80 -0.08 1.61 -0.00 -0.48 -4.79 116.67 116.45 1y1q s ASP 2106Ca 0.00 1.75 -0.00 0.00 -0.00 0.00 0.00 52.55 54.30 1y1q s ASP 2106Cb 0.00 -2.52 -0.03 0.00 -0.00 0.00 0.00 42.92 40.37 1y1q s ASP 2106CO 0.00 -1.16 -0.05 -0.69 -0.00 0.00 0.00 175.17 173.27 1y1q s VAL 2107N -2.59 3.83 -0.12 -1.27 1.01 -0.81 -0.47 120.40 119.99 1y1q s VAL 2107Ca 0.62 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 62.20 1y1q s VAL 2107Cb -0.15 -2.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.64 1y1q s VAL 2107CO 0.40 0.59 -0.21 -0.76 0.00 0.00 0.00 175.10 175.12 1y1q s LEU 2108N -0.65 2.26 -0.23 3.92 1.43 0.21 -1.40 118.68 124.23 1y1q s LEU 2108Ca 0.10 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1y1q s LEU 2108Cb -0.12 -1.47 0.05 0.00 0.03 0.00 0.00 46.19 44.68 1y1q s LEU 2108CO 0.02 0.15 -0.13 -0.69 0.23 0.00 0.00 176.35 175.92 1y1q s VAL 2109N 0.44 2.02 -0.22 -1.59 1.01 -0.79 -0.96 120.40 120.31 1y1q s VAL 2109Ca -0.15 -1.32 -0.25 0.00 0.00 0.00 0.00 61.98 60.27 1y1q s VAL 2109Cb -0.17 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 1y1q s VAL 2109CO 0.06 0.15 0.82 -0.89 0.00 0.00 0.00 175.10 175.25 1y1q s THR 2110N 1.22 4.86 -0.08 3.92 2.01 -1.13 -1.68 115.64 124.76 1y1q s THR 2110Ca -0.04 1.57 0.13 0.00 0.31 0.00 0.00 61.69 63.67 1y1q s THR 2110Cb -0.17 -4.12 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 1y1q s THR 2110CO -0.08 -0.03 1.28 0.71 -0.69 0.00 0.00 174.62 175.81 1y1q h THR 2111N 5.34 1.01 -1.28 -0.82 1.35 -1.40 -3.42 112.91 113.70 1y1q h THR 2111Ca -0.25 -2.50 0.35 0.00 -0.55 0.00 0.00 66.41 63.46 1y1q h THR 2111Cb 1.11 2.47 -0.13 0.00 -1.73 0.00 0.00 68.15 69.86 1y1q h THR 2111CO 0.86 0.58 0.89 0.00 -0.25 0.00 0.00 175.52 177.60 1y1q s ALA 2112N -2.88 -2.33 0.05 6.62 0.00 -1.26 -0.55 121.76 121.42 1y1q s ALA 2112Ca 0.02 0.88 -0.04 0.00 0.00 0.00 0.00 51.96 52.82 1y1q s ALA 2112Cb 0.08 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 1y1q s ALA 2112CO 0.78 -1.02 0.05 -1.54 0.00 0.00 0.00 175.76 174.03 1y1q s SER 2113N -2.92 0.32 0.19 0.00 1.04 -0.39 -2.53 113.70 109.41 1y1q s SER 2113Ca 0.14 -0.79 -0.30 0.00 0.48 0.00 0.00 55.95 55.48 1y1q s SER 2113Cb 0.05 0.23 -0.08 0.00 0.10 0.00 0.00 66.02 66.33 1y1q s SER 2113CO -0.05 -0.59 1.17 -0.69 0.98 0.00 0.00 173.24 174.06 1y1q s VAL 2114N -3.49 3.63 -0.98 5.02 1.01 0.75 -4.42 120.40 121.93 1y1q s VAL 2114Ca 0.03 1.39 -0.16 0.00 0.00 0.00 0.00 61.98 63.24 1y1q s VAL 2114Cb 0.04 -3.89 0.17 0.00 0.00 0.00 0.00 36.38 32.71 1y1q s VAL 2114CO -0.09 0.23 1.10 -0.13 0.00 0.00 0.00 175.10 176.22 1y1q s ARG 2115N -0.33 3.75 -0.47 2.72 0.52 -1.26 -2.28 118.95 121.60 1y1q s ARG 2115Ca 0.52 -2.21 0.03 0.00 -0.52 0.00 0.00 55.73 53.55 1y1q s ARG 2115Cb -0.32 -4.80 0.53 0.00 0.52 0.00 0.00 34.95 30.88 1y1q s ARG 2115CO 0.37 -1.61 1.77 1.28 0.02 0.00 0.00 175.30 177.12 1y1q n LEU 2116N 5.44 6.29 0.00 2.53 4.77 -0.52 -4.93 117.00 130.58 1y1q n LEU 2116Ca 0.24 -4.04 0.00 0.00 -0.03 0.00 0.00 56.01 52.18 1y1q n LEU 2116Cb 0.47 -0.78 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 1y1q n LEU 2116CO 0.48 1.39 0.00 -0.90 -1.33 0.00 0.00 177.39 177.03 1y1q n ASP 2117N -1.01 1.92 0.00 -1.43 3.85 -1.22 -2.04 116.55 116.63 1y1q n ASP 2117Ca 0.53 -0.48 0.00 0.00 -0.71 0.00 0.00 54.79 54.13 1y1q n ASP 2117Cb 1.09 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.86 1y1q n ASP 2117CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1y1q n GLY 2118N 5.00 0.00 0.28 6.12 0.00 -1.26 -4.80 105.19 110.53 1y1q n GLY 2118Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1y1q n GLY 2118CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y1q h ALA 2119N 0.00 1.40 -0.66 4.61 0.00 -1.99 -2.29 119.26 120.34 1y1q h ALA 2119Ca 0.00 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1y1q h ALA 2119Cb 0.15 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1y1q h ALA 2119CO 0.00 0.42 0.43 0.66 0.00 0.00 0.00 179.25 180.77 1y1q h SER 2120N 0.52 0.63 0.18 0.00 4.64 -1.87 -0.14 113.55 117.51 1y1q h SER 2120Ca 0.12 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1y1q h SER 2120Cb 0.29 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1y1q h SER 2120CO 0.01 0.42 0.00 0.18 -0.87 0.00 0.00 176.83 176.57 1y1q n LEU 2121N -4.47 0.00 -0.32 5.97 4.77 -0.86 -2.16 117.00 119.93 1y1q n LEU 2121Ca 0.09 0.20 0.13 0.00 -0.03 0.00 0.00 56.01 56.39 1y1q n LEU 2121Cb 0.18 -0.20 0.31 0.00 -2.33 0.00 0.00 43.42 41.38 1y1q n LEU 2121CO 0.34 -0.11 0.60 1.41 -1.33 0.00 0.00 177.39 178.31 1y1q n HIS 2122N -1.20 0.00 -0.01 -1.77 8.25 -0.06 -4.23 115.22 116.19 1y1q n HIS 2122Ca 0.08 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.52 1y1q n HIS 2122Cb 0.09 -0.09 -0.02 0.00 1.12 0.00 0.00 29.99 31.10 1y1q n HIS 2122CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1y1q n PHE 2123N -0.45 0.00 -3.73 4.41 3.01 -0.92 -5.09 117.46 114.70 1y1q n PHE 2123Ca 0.12 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.45 1y1q n PHE 2123Cb 0.37 -0.11 -0.08 0.00 -0.01 0.00 0.00 39.48 39.66 1y1q n PHE 2123CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1y1q s ALA 2124N -2.05 -0.85 0.72 4.37 0.00 -1.07 -5.01 121.76 117.86 1y1q s ALA 2124Ca -0.02 0.29 -0.15 0.00 0.00 0.00 0.00 51.96 52.08 1y1q s ALA 2124Cb 0.01 0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.35 1y1q s ALA 2124CO 0.08 -0.34 1.19 -2.14 0.00 0.00 0.00 175.76 174.55 1y1q s PRO 2125N -1.86 2.23 0.63 0.00 0.02 -1.26 -4.15 135.00 130.61 1y1q s PRO 2125Ca -0.10 1.71 0.30 0.00 0.02 0.00 0.00 61.00 62.94 1y1q s PRO 2125Cb -0.03 -1.85 1.65 0.00 0.02 0.00 0.00 34.50 34.30 1y1q s PRO 2125CO 0.01 -1.75 1.98 1.98 -0.33 0.00 0.00 177.00 178.90 1y1q h MET 2126N -0.24 0.00 0.00 5.54 4.05 -1.94 0.32 114.93 122.66 1y1q h MET 2126Ca -0.48 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 1y1q h MET 2126Cb 1.29 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.09 1y1q h MET 2126CO 0.50 0.00 0.00 -0.85 0.23 0.00 0.00 176.91 176.79 1y1q n GLU 2127N -3.30 0.20 -2.52 0.39 0.00 -1.26 -4.74 120.64 109.40 1y1q n GLU 2127Ca 0.01 0.24 -0.41 0.00 0.00 0.00 0.00 57.16 57.00 1y1q n GLU 2127Cb 0.42 -1.77 -0.04 0.00 0.00 0.00 0.00 31.44 30.06 1y1q n GLU 2127CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 1y1q s PHE 2128N -3.13 3.57 0.01 -1.84 2.19 0.11 -4.99 117.98 113.90 1y1q s PHE 2128Ca 0.09 1.54 -0.30 0.00 0.33 0.00 0.00 56.93 58.59 1y1q s PHE 2128Cb 0.12 -3.29 -0.05 0.00 -1.31 0.00 0.00 43.02 38.50 1y1q s PHE 2128CO 0.52 -0.69 1.20 -1.25 1.83 0.00 0.00 175.22 176.84 1y1q s PRO 2129N 0.15 4.40 -1.47 10.12 0.04 -1.26 -4.92 135.00 142.05 1y1q s PRO 2129Ca 0.52 1.73 -0.12 0.00 0.04 0.00 0.00 61.00 63.17 1y1q s PRO 2129Cb -0.28 -3.45 0.03 0.00 0.04 0.00 0.00 34.50 30.84 1y1q s PRO 2129CO 0.33 -0.34 2.38 0.00 0.04 0.00 0.00 177.00 179.40 1y1q n ALA 2130N 4.52 6.12 -2.64 8.56 0.00 -1.26 -4.75 120.51 131.06 1y1q n ALA 2130Ca 0.10 -3.86 -0.36 0.00 0.00 0.00 0.00 53.44 49.32 1y1q n ALA 2130Cb 0.46 -3.39 -0.06 0.00 0.00 0.00 0.00 19.45 16.47 1y1q n ALA 2130CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1y1q s VAL 2131N 2.34 5.18 0.78 0.00 0.11 -1.26 -1.27 120.40 126.28 1y1q s VAL 2131Ca 0.52 0.48 -0.11 0.00 -2.93 0.00 0.00 61.98 59.93 1y1q s VAL 2131Cb 0.15 -3.61 0.06 0.00 -1.53 0.00 0.00 36.38 31.44 1y1q s VAL 2131CO -0.07 0.44 1.10 0.00 -3.33 0.00 0.00 175.10 173.24 1y1q s ALA 2132N -1.22 2.37 0.15 1.54 0.00 0.29 -4.67 121.76 120.22 1y1q s ALA 2132Ca 0.26 -0.23 -0.29 0.00 0.00 0.00 0.00 51.96 51.71 1y1q s ALA 2132Cb -0.14 -3.09 -0.07 0.00 0.00 0.00 0.00 23.12 19.81 1y1q s ALA 2132CO 0.14 -1.62 0.90 0.34 0.00 0.00 0.00 175.76 175.52 1y1q s ASP 2133N -3.99 7.49 0.22 0.00 -1.08 0.45 -4.96 116.67 114.79 1y1q s ASP 2133Ca 0.60 1.78 -0.09 0.00 -0.52 0.00 0.00 52.55 54.32 1y1q s ASP 2133Cb -0.14 -2.56 0.18 0.00 -1.46 0.00 0.00 42.92 38.94 1y1q s ASP 2133CO 0.54 0.07 1.89 0.15 0.52 0.00 0.00 175.17 178.34 1y1q h PHE 2134N 4.90 1.02 -0.64 -5.34 3.57 -1.95 -1.74 116.94 116.77 1y1q h PHE 2134Ca -0.44 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.00 1y1q h PHE 2134Cb 1.21 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 1y1q h PHE 2134CO 0.63 0.64 0.07 0.00 -2.23 0.00 0.00 178.31 177.42 1y1q h ALA 2135N 1.30 0.85 -0.50 2.41 0.00 -1.94 -0.96 119.26 120.42 1y1q h ALA 2135Ca 0.30 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1y1q h ALA 2135Cb -0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1y1q h ALA 2135CO -0.07 0.64 -0.06 0.00 0.00 0.00 0.00 179.25 179.76 1y1q h THR 2137N 0.78 1.28 0.09 0.00 2.02 -1.16 -1.86 112.91 114.06 1y1q h THR 2137Ca 0.13 -1.37 -0.00 0.00 0.77 0.00 0.00 66.41 65.94 1y1q h THR 2137Cb 0.60 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 1y1q h THR 2137CO 0.04 0.42 -0.04 0.74 0.37 0.00 0.00 175.52 177.05 1y1q h THR 2138N 0.33 1.13 -0.71 3.16 2.02 -1.01 -2.10 112.91 115.74 1y1q h THR 2138Ca 0.04 -0.93 0.12 0.00 0.77 0.00 0.00 66.41 66.40 1y1q h THR 2138Cb 0.74 1.72 -0.05 0.00 -1.74 0.00 0.00 68.15 68.82 1y1q h THR 2138CO 0.06 0.22 0.47 0.00 0.37 0.00 0.00 175.52 176.64 1y1q h ALA 2139N 0.28 1.98 -0.15 6.16 0.00 -1.10 0.40 119.26 126.83 1y1q h ALA 2139Ca -0.01 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1y1q h ALA 2139Cb 0.46 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1y1q h ALA 2139CO 0.02 -0.15 -0.42 -0.07 0.00 0.00 0.00 179.25 178.63 1y1q h LEU 2140N 0.50 0.64 -0.44 0.00 3.38 -1.25 -1.88 115.31 116.26 1y1q h LEU 2140Ca 0.33 -0.59 -0.09 0.00 0.09 0.00 0.00 57.88 57.63 1y1q h LEU 2140Cb 0.62 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1y1q h LEU 2140CO -0.11 1.11 -0.07 0.58 0.09 0.00 0.00 178.44 180.04 1y1q h VAL 2141N 0.20 1.27 -0.73 1.22 2.07 -0.66 0.20 116.25 119.82 1y1q h VAL 2141Ca -0.01 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.29 1y1q h VAL 2141Cb 1.04 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 1y1q h VAL 2141CO 0.09 0.40 0.21 -0.33 0.02 0.00 0.00 177.57 177.96 1y1q h GLU 2142N 0.65 1.14 -0.29 1.57 4.39 -1.00 -0.46 114.58 120.58 1y1q h GLU 2142Ca 0.12 -0.25 -0.09 0.00 0.34 0.00 0.00 59.36 59.47 1y1q h GLU 2142Cb 0.60 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1y1q h GLU 2142CO 0.04 0.98 -0.16 0.00 -1.16 0.00 0.00 179.01 178.71 1y1q h ALA 2143N 1.13 0.41 0.00 3.43 0.00 -1.10 -0.77 119.26 122.36 1y1q h ALA 2143Ca 0.23 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1y1q h ALA 2143Cb 0.33 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1y1q h ALA 2143CO -0.00 0.32 -0.16 0.00 0.00 0.00 0.00 179.25 179.40 1y1q h ALA 2144N 0.74 1.29 0.01 0.00 0.00 -0.41 -2.25 119.26 118.65 1y1q h ALA 2144Ca 0.06 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.60 1y1q h ALA 2144Cb 0.69 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1y1q h ALA 2144CO 0.05 0.20 -1.09 -0.22 0.00 0.00 0.00 179.25 178.18 1y1q h LYS 2145N 0.00 0.03 0.00 0.00 1.63 -0.73 -2.19 116.57 115.31 1y1q h LYS 2145Ca -0.00 -0.05 -0.04 0.00 -0.85 0.00 0.00 60.65 59.71 1y1q h LYS 2145Cb 0.41 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.05 1y1q h LYS 2145CO 0.02 0.98 -0.21 0.66 -3.45 0.00 0.00 179.45 177.45 1y1q h SER 2146N 0.01 0.00 -0.02 4.20 4.64 -0.52 -2.72 113.55 119.14 1y1q h SER 2146Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1y1q h SER 2146Cb 1.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 1y1q h SER 2146CO 0.13 0.21 -0.32 2.30 -0.87 0.00 0.00 176.83 178.28 1y1q n ILE 2147N -3.93 0.00 -0.57 0.95 -0.00 -1.20 -4.98 119.36 109.63 1y1q n ILE 2147Ca -0.02 -0.34 0.00 0.00 -0.00 0.00 0.00 62.75 62.39 1y1q n ILE 2147Cb 0.29 1.27 0.00 0.00 -0.00 0.00 0.00 39.64 41.20 1y1q n ILE 2147CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1y1q n GLY 2148N 1.26 0.75 3.68 3.28 0.00 -1.03 -5.02 105.19 108.12 1y1q n GLY 2148Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1y1q n GLY 2148CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y1q s ALA 2149N -2.64 3.69 -0.27 4.61 0.00 -0.83 -4.88 121.76 121.43 1y1q s ALA 2149Ca 0.00 1.25 -0.28 0.00 0.00 0.00 0.00 51.96 52.93 1y1q s ALA 2149Cb 0.00 -3.73 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 1y1q s ALA 2149CO 0.00 -1.20 2.10 0.95 0.00 0.00 0.00 175.76 177.61 1y1q s THR 2150N 2.95 3.15 -0.03 0.00 -4.23 -1.26 -4.63 115.64 111.59 1y1q s THR 2150Ca 0.77 0.15 -0.02 0.00 -1.18 0.00 0.00 61.69 61.41 1y1q s THR 2150Cb -0.41 -3.21 -0.04 0.00 1.34 0.00 0.00 72.50 70.18 1y1q s THR 2150CO 0.34 -0.14 0.10 -0.89 -0.54 0.00 0.00 174.62 173.48 1y1q s THR 2151N 8.09 4.91 -0.24 3.99 2.01 -1.26 -1.92 115.64 131.22 1y1q s THR 2151Ca 0.94 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 62.69 1y1q s THR 2151Cb -0.29 -3.22 0.05 0.00 0.01 0.00 0.00 72.50 69.05 1y1q s THR 2151CO 0.34 0.41 -0.13 -1.00 -0.69 0.00 0.00 174.62 173.55 1y1q s HIS 2152N -1.16 3.07 -0.31 4.92 3.76 -0.49 -4.99 115.29 120.09 1y1q s HIS 2152Ca 0.22 -2.11 -0.10 0.00 -0.15 0.00 0.00 55.06 52.92 1y1q s HIS 2152Cb -0.12 -1.89 -0.01 0.00 1.11 0.00 0.00 32.58 31.67 1y1q s HIS 2152CO 0.12 -0.85 0.16 0.08 -0.85 0.00 0.00 174.74 173.40 1y1q s VAL 2153N 1.17 4.71 0.00 -0.90 1.01 -1.26 -1.88 120.40 123.25 1y1q s VAL 2153Ca -0.05 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1y1q s VAL 2153Cb -0.18 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1y1q s VAL 2153CO -0.07 0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.72 1y1q n GLY 2154N 5.00 1.51 3.81 4.51 0.00 -0.67 -4.93 105.19 114.41 1y1q n GLY 2154Ca -0.14 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 1y1q n GLY 2154CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y1q s VAL 2155N -1.67 4.60 0.09 1.61 1.01 -1.26 -0.94 120.40 123.84 1y1q s VAL 2155Ca 0.00 1.29 0.09 0.00 0.00 0.00 0.00 61.98 63.36 1y1q s VAL 2155Cb 0.00 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 1y1q s VAL 2155CO 0.00 0.32 -0.24 -0.89 0.00 0.00 0.00 175.10 174.29 1y1q s THR 2156N -1.39 1.95 -0.35 3.92 2.01 -1.05 -0.37 115.64 120.37 1y1q s THR 2156Ca 0.39 -1.51 -0.15 0.00 0.31 0.00 0.00 61.69 60.73 1y1q s THR 2156Cb -0.18 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.60 1y1q s THR 2156CO 0.21 0.12 0.35 0.00 -0.69 0.00 0.00 174.62 174.62 1y1q s ALA 2157N -0.98 3.49 -0.40 7.40 0.00 0.99 -0.18 121.76 132.09 1y1q s ALA 2157Ca 0.10 -1.25 -0.14 0.00 0.00 0.00 0.00 51.96 50.67 1y1q s ALA 2157Cb -0.10 -2.82 0.02 0.00 0.00 0.00 0.00 23.12 20.22 1y1q s ALA 2157CO 0.04 -1.10 0.27 0.45 0.00 0.00 0.00 175.76 175.42 1y1q s SER 2158N 1.74 5.99 -0.02 0.00 0.15 -0.96 -1.25 113.70 119.35 1y1q s SER 2158Ca 0.11 -0.91 0.01 0.00 0.70 0.00 0.00 55.95 55.86 1y1q s SER 2158Cb -0.17 -2.12 -0.03 0.00 -1.71 0.00 0.00 66.02 61.99 1y1q s SER 2158CO 0.12 -0.42 -0.01 -0.55 1.20 0.00 0.00 173.24 173.57 1y1q s SER 2159N 1.64 5.03 0.36 5.45 0.15 0.68 -1.44 113.70 125.58 1y1q s SER 2159Ca 0.04 -0.01 0.19 0.00 0.70 0.00 0.00 55.95 56.87 1y1q s SER 2159Cb -0.19 -1.30 0.57 0.00 -1.71 0.00 0.00 66.02 63.38 1y1q s SER 2159CO 0.09 0.30 1.68 0.44 1.20 0.00 0.00 173.24 176.94 1y1q h ASP 2160N 4.53 0.00 -3.05 5.45 5.19 -1.69 -3.37 116.42 123.48 1y1q h ASP 2160Ca -0.49 0.00 -0.63 0.00 -0.62 0.00 0.00 57.03 55.29 1y1q h ASP 2160Cb 1.18 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.54 1y1q h ASP 2160CO 0.56 0.38 -0.74 0.42 -3.12 0.00 0.00 179.24 176.74 1y1q s THR 2161N -3.45 3.08 -0.16 0.35 -4.23 -1.26 -4.96 115.64 105.01 1y1q s THR 2161Ca 0.01 -1.70 0.19 0.00 -1.18 0.00 0.00 61.69 59.01 1y1q s THR 2161Cb 0.10 -2.52 -0.10 0.00 1.34 0.00 0.00 72.50 71.33 1y1q s THR 2161CO 0.69 -0.10 0.88 0.33 -0.54 0.00 0.00 174.62 175.88 1y1q n PHE 2162N 0.09 0.95 0.00 3.99 -0.00 -1.26 -4.32 117.46 116.91 1y1q n PHE 2162Ca -0.11 0.30 0.00 0.00 -0.00 0.00 0.00 57.45 57.64 1y1q n PHE 2162Cb 0.55 -1.03 0.00 0.00 -0.00 0.00 0.00 39.48 39.00 1y1q n PHE 2162CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1y1q n TYR 2163N -2.80 0.00 -0.24 -5.13 4.02 -1.26 -4.45 117.16 107.30 1y1q n TYR 2163Ca -0.07 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.81 1y1q n TYR 2163Cb 0.74 0.00 0.18 0.00 -0.02 0.00 0.00 39.34 40.23 1y1q n TYR 2163CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1y1q h PRO 2164N 0.00 1.06 0.00 -0.72 0.13 -1.87 -0.99 132.00 129.61 1y1q h PRO 2164Ca 0.00 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 1y1q h PRO 2164Cb 0.00 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 30.92 1y1q h PRO 2164CO 0.00 0.77 0.00 0.78 -0.23 0.00 0.00 178.00 179.32 1y1q h GLY 2165N 1.10 0.00 -1.66 1.56 0.00 -1.86 0.38 103.07 102.59 1y1q h GLY 2165Ca 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.59 1y1q h GLY 2165CO -0.04 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.44 1y1q n GLN 2166N -2.91 2.93 -3.97 4.80 6.02 -0.91 -4.91 117.38 118.43 1y1q n GLN 2166Ca -0.03 -2.86 -0.33 0.00 -0.01 0.00 0.00 57.00 53.77 1y1q n GLN 2166Cb 0.07 -1.86 -0.01 0.00 1.02 0.00 0.00 30.24 29.46 1y1q n GLN 2166CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1y1q n GLU 2167N -0.51 -1.66 -3.61 -1.09 2.13 0.13 -4.92 120.64 111.11 1y1q n GLU 2167Ca 0.22 0.29 -0.36 0.00 0.66 0.00 0.00 57.16 57.97 1y1q n GLU 2167Cb 0.91 -3.81 -0.07 0.00 0.27 0.00 0.00 31.44 28.74 1y1q n GLU 2167CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1y1q s ARG 2168N -6.75 4.23 -0.02 5.31 0.52 -0.43 -4.97 118.95 116.86 1y1q s ARG 2168Ca 0.24 -0.03 0.20 0.00 -0.52 0.00 0.00 55.73 55.62 1y1q s ARG 2168Cb -0.11 -3.43 -0.27 0.00 0.52 0.00 0.00 34.95 31.67 1y1q s ARG 2168CO 0.92 0.26 0.63 0.66 0.02 0.00 0.00 175.30 177.78 1y1q n TYR 2169N 3.58 0.00 -1.68 -0.53 4.02 -1.26 -4.43 117.16 116.86 1y1q n TYR 2169Ca -0.13 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.35 1y1q n TYR 2169Cb 0.52 -0.25 -0.03 0.00 -0.02 0.00 0.00 39.34 39.56 1y1q n TYR 2169CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1y1q n ASP 2170N -1.86 3.35 -3.08 7.72 5.68 -1.26 -3.86 116.55 123.24 1y1q n ASP 2170Ca -0.00 -2.76 -0.18 0.00 -0.50 0.00 0.00 54.79 51.34 1y1q n ASP 2170Cb 0.43 -1.47 -0.07 0.00 -1.14 0.00 0.00 41.12 38.87 1y1q n ASP 2170CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1y1q n THR 2171N 6.10 0.00 -0.31 2.12 -2.24 -1.26 -4.99 114.28 113.71 1y1q n THR 2171Ca 0.49 -2.26 0.01 0.00 -2.27 0.00 0.00 64.05 60.02 1y1q n THR 2171Cb 0.42 1.13 0.20 0.00 -2.10 0.00 0.00 70.33 69.98 1y1q n THR 2171CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1y1q h TYR 2172N 2.00 1.10 0.00 4.78 5.03 -1.99 -3.02 116.97 124.87 1y1q h TYR 2172Ca -0.22 0.03 -0.23 0.00 2.58 0.00 0.00 58.73 60.88 1y1q h TYR 2172Cb 1.12 -0.37 -0.04 0.00 1.55 0.00 0.00 36.73 38.98 1y1q h TYR 2172CO 0.00 0.64 -2.18 -1.13 -1.32 0.00 0.00 178.16 174.18 1y1q n SER 2173N -4.44 0.08 -1.77 -2.11 3.41 -1.26 -4.97 113.62 102.56 1y1q n SER 2173Ca 0.12 0.04 -0.18 0.00 -0.26 0.00 0.00 58.87 58.58 1y1q n SER 2173Cb 0.10 1.24 -0.04 0.00 -0.26 0.00 0.00 64.21 65.24 1y1q n SER 2173CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y1q n GLY 2174N 1.56 0.61 3.46 5.00 0.00 -1.14 -4.97 105.19 109.70 1y1q n GLY 2174Ca -0.22 -0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1y1q n GLY 2174CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y1q s ARG 2175N -4.29 1.78 -0.15 1.61 3.52 -1.26 -4.92 118.95 115.24 1y1q s ARG 2175Ca 0.00 -1.16 -0.02 0.00 -0.13 0.00 0.00 55.73 54.41 1y1q s ARG 2175Cb 0.00 -2.09 0.05 0.00 -1.56 0.00 0.00 34.95 31.35 1y1q s ARG 2175CO 0.00 0.49 0.02 0.08 -0.81 0.00 0.00 175.30 175.08 1y1q s VAL 2176N -1.07 0.46 0.54 7.11 1.01 -1.26 -4.89 120.40 122.31 1y1q s VAL 2176Ca 0.16 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 61.67 1y1q s VAL 2176Cb -0.10 -0.83 -0.11 0.00 0.00 0.00 0.00 36.38 35.33 1y1q s VAL 2176CO 0.08 -0.03 0.29 0.55 0.00 0.00 0.00 175.10 175.99 1y1q n VAL 2177N 5.09 1.44 -0.25 2.92 3.14 -1.26 -4.44 118.33 124.98 1y1q n VAL 2177Ca -0.08 -0.50 0.01 0.00 -2.96 0.00 0.00 64.34 60.81 1y1q n VAL 2177Cb 0.48 -0.43 0.09 0.00 -1.06 0.00 0.00 33.84 32.92 1y1q n VAL 2177CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 1y1q h ARG 2178N 0.16 0.01 -0.93 1.45 2.43 -2.00 -1.11 114.38 114.39 1y1q h ARG 2178Ca -0.44 -0.00 0.24 0.00 -0.81 0.00 0.00 59.98 58.97 1y1q h ARG 2178Cb 1.42 -0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 30.84 1y1q h ARG 2178CO 0.45 0.01 0.44 -0.09 -1.51 0.00 0.00 179.97 179.27 1y1q h ARG 2179N 0.01 0.40 -0.21 0.20 2.43 -2.03 -1.75 114.38 113.44 1y1q h ARG 2179Ca 0.35 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 1y1q h ARG 2179Cb 0.54 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1y1q h ARG 2179CO -0.72 0.27 0.00 1.19 -1.51 0.00 0.00 179.97 179.19 1y1q n PHE 2180N -5.03 0.26 -2.32 2.20 3.01 -0.48 -4.79 117.46 110.32 1y1q n PHE 2180Ca 0.24 -0.13 -0.42 0.00 1.01 0.00 0.00 57.45 58.15 1y1q n PHE 2180Cb 0.70 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.15 1y1q n PHE 2180CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1y1q s LYS 2181N -1.74 4.33 -1.20 -1.08 1.02 -0.66 -2.72 119.74 117.70 1y1q s LYS 2181Ca 0.34 1.86 0.00 0.00 0.02 0.00 0.00 55.97 58.20 1y1q s LYS 2181Cb 0.21 -3.49 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 1y1q s LYS 2181CO 0.31 -0.46 0.00 0.41 -0.92 0.00 0.00 175.35 174.68 1y1q n GLY 2182N 3.47 1.16 0.15 -3.33 0.00 -1.26 -4.93 105.19 100.45 1y1q n GLY 2182Ca 0.12 -0.49 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 1y1q n GLY 2182CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1y1q h SER 2183N 0.00 0.81 -0.21 1.61 4.64 -1.82 -3.30 113.55 115.28 1y1q h SER 2183Ca -0.24 -0.92 0.06 0.00 -0.47 0.00 0.00 61.79 60.22 1y1q h SER 2183Cb 0.78 -0.26 -0.07 0.00 -0.31 0.00 0.00 62.40 62.54 1y1q h SER 2183CO 0.34 1.74 -0.26 -0.03 -0.87 0.00 0.00 176.83 177.75 1y1q h MET 2184N 0.14 -0.27 -0.67 4.77 -1.53 -1.91 0.99 114.93 116.44 1y1q h MET 2184Ca -0.28 0.02 0.11 0.00 -3.44 0.00 0.00 59.70 56.11 1y1q h MET 2184Cb 2.16 0.06 -0.04 0.00 -0.55 0.00 0.00 31.60 33.23 1y1q h MET 2184CO 0.26 -0.18 0.45 1.05 0.14 0.00 0.00 176.91 178.62 1y1q h GLU 2185N -0.28 0.47 0.25 0.39 -0.00 -1.99 0.13 114.58 113.55 1y1q h GLU 2185Ca 0.12 -0.03 -0.01 0.00 -0.00 0.00 0.00 59.36 59.44 1y1q h GLU 2185Cb 0.47 -0.11 0.00 0.00 -0.00 0.00 0.00 28.75 29.12 1y1q h GLU 2185CO -0.37 0.31 -0.12 0.93 -0.00 0.00 0.00 179.01 179.76 1y1q h GLU 2186N 0.49 -0.33 -0.68 1.06 5.08 -0.97 0.47 114.58 119.71 1y1q h GLU 2186Ca 0.31 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.74 1y1q h GLU 2186Cb 0.57 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.86 1y1q h GLU 2186CO -0.10 -0.15 0.45 -1.49 -1.00 0.00 0.00 179.01 176.72 1y1q h TRP 2187N -0.43 0.76 -0.10 4.33 -0.00 0.27 -1.50 115.95 119.29 1y1q h TRP 2187Ca -0.03 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 58.85 1y1q h TRP 2187Cb 0.33 -0.25 -0.00 0.00 -0.00 0.00 0.00 29.16 29.23 1y1q h TRP 2187CO -0.03 0.44 -0.02 1.96 -0.00 0.00 0.00 178.44 180.78 1y1q h GLN 2188N 0.78 0.19 -0.81 0.49 4.20 -0.44 0.83 115.11 120.36 1y1q h GLN 2188Ca 0.28 -0.07 0.08 0.00 0.06 0.00 0.00 58.65 59.00 1y1q h GLN 2188Cb 0.12 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 1y1q h GLN 2188CO -0.08 0.49 0.53 0.00 -0.67 0.00 0.00 178.83 179.10 1y1q h ALA 2189N 0.69 1.67 -0.00 3.87 0.00 -0.36 0.47 119.26 125.60 1y1q h ALA 2189Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1y1q h ALA 2189Cb 0.42 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1y1q h ALA 2189CO 0.01 0.18 0.00 -1.33 0.00 0.00 0.00 179.25 178.11 1y1q n MET 2190N -4.50 1.02 -0.97 0.00 2.81 -0.61 -4.89 117.12 109.98 1y1q n MET 2190Ca 0.13 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1y1q n MET 2190Cb 0.26 -1.27 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 1y1q n MET 2190CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1y1q n GLY 2191N 0.78 0.52 3.77 3.03 0.00 0.16 -5.01 105.19 108.43 1y1q n GLY 2191Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1y1q n GLY 2191CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y1q s VAL 2192N -2.01 2.02 -0.17 1.61 1.01 0.26 -4.64 120.40 118.48 1y1q s VAL 2192Ca 0.00 0.01 -0.24 0.00 0.00 0.00 0.00 61.98 61.75 1y1q s VAL 2192Cb 0.00 -3.01 -0.23 0.00 0.00 0.00 0.00 36.38 33.14 1y1q s VAL 2192CO 0.00 0.00 0.48 0.24 0.00 0.00 0.00 175.10 175.82 1y1q h MET 2193N 2.52 0.02 -3.65 2.72 0.00 -1.02 -3.42 114.93 112.10 1y1q h MET 2193Ca -0.51 -0.03 -0.17 0.00 0.00 0.00 0.00 59.70 58.99 1y1q h MET 2193Cb 1.26 0.01 -0.04 0.00 0.00 0.00 0.00 31.60 32.83 1y1q h MET 2193CO 0.62 1.02 0.01 0.54 0.00 0.00 0.00 176.91 179.09 1y1q s ASN 2194N -6.60 0.56 0.03 1.22 4.22 -1.26 -1.18 114.94 111.93 1y1q s ASN 2194Ca -0.24 -1.36 0.05 0.00 -2.14 0.00 0.00 52.86 49.17 1y1q s ASN 2194Cb 0.02 0.75 -0.03 0.00 1.28 0.00 0.00 41.25 43.26 1y1q s ASN 2194CO 0.65 -1.47 -0.10 -0.31 -2.04 0.00 0.00 177.10 173.82 1y1q s TYR 2195N -2.70 2.79 0.36 1.54 2.02 -1.26 -0.01 117.35 120.09 1y1q s TYR 2195Ca 0.24 -0.11 -0.13 0.00 -0.37 0.00 0.00 57.07 56.70 1y1q s TYR 2195Cb -0.02 -1.54 0.05 0.00 -0.40 0.00 0.00 41.96 40.04 1y1q s TYR 2195CO 0.17 0.35 0.71 -0.85 -1.57 0.00 0.00 175.55 174.36 1y1q n GLU 2196N 1.39 1.02 0.00 -0.62 -0.00 -0.38 -4.46 120.64 117.59 1y1q n GLU 2196Ca -0.15 -2.04 0.00 0.00 -0.00 0.00 0.00 57.16 54.97 1y1q n GLU 2196Cb 0.52 2.52 0.00 0.00 -0.00 0.00 0.00 31.44 34.48 1y1q n GLU 2196CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1y1q n MET 2197N -0.49 -0.30 0.00 3.44 2.81 -1.26 -0.23 117.12 121.10 1y1q n MET 2197Ca -0.08 -0.43 0.00 0.00 -1.81 0.00 0.00 57.70 55.38 1y1q n MET 2197Cb 0.54 -0.82 0.00 0.00 -0.71 0.00 0.00 33.22 32.23 1y1q n MET 2197CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1y1q n GLU 2198N -0.04 1.85 -0.10 0.03 4.71 -1.26 -3.43 120.64 122.39 1y1q n GLU 2198Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.16 57.10 1y1q n GLU 2198Cb 0.12 -0.83 0.01 0.00 -1.01 0.00 0.00 31.44 29.73 1y1q n GLU 2198CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1y1q h SER 2199N 0.00 -0.22 -0.80 1.62 4.64 -1.96 -1.29 113.55 115.54 1y1q h SER 2199Ca 0.00 0.09 0.14 0.00 -0.47 0.00 0.00 61.79 61.55 1y1q h SER 2199Cb 0.00 0.18 -0.09 0.00 -0.31 0.00 0.00 62.40 62.18 1y1q h SER 2199CO 0.00 -0.07 0.39 0.00 -0.87 0.00 0.00 176.83 176.28 1y1q h ALA 2200N 1.33 1.17 -0.05 5.18 0.00 -1.88 0.31 119.26 125.33 1y1q h ALA 2200Ca 0.17 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1y1q h ALA 2200Cb 0.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1y1q h ALA 2200CO -0.32 -0.11 -0.02 1.15 0.00 0.00 0.00 179.25 179.94 1y1q h THR 2201N 0.58 1.33 -0.24 0.00 2.02 -1.78 -2.27 112.91 112.55 1y1q h THR 2201Ca 0.43 -1.04 0.03 0.00 0.77 0.00 0.00 66.41 66.60 1y1q h THR 2201Cb 0.60 1.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.92 1y1q h THR 2201CO -0.36 0.28 0.07 0.25 0.37 0.00 0.00 175.52 176.14 1y1q h LEU 2202N -0.30 0.07 -0.40 2.58 5.85 -0.58 -2.20 115.31 120.33 1y1q h LEU 2202Ca 0.01 0.03 -0.15 0.00 0.84 0.00 0.00 57.88 58.61 1y1q h LEU 2202Cb 0.47 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1y1q h LEU 2202CO 0.01 0.07 -0.33 -0.07 -0.34 0.00 0.00 178.44 177.78 1y1q h LEU 2203N 0.18 0.98 -0.41 2.25 4.07 -0.48 -2.77 115.31 119.13 1y1q h LEU 2203Ca 0.11 -0.45 -0.12 0.00 0.08 0.00 0.00 57.88 57.50 1y1q h LEU 2203Cb 0.09 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.54 1y1q h LEU 2203CO -0.12 1.22 -0.22 0.74 -1.08 0.00 0.00 178.44 178.98 1y1q h THR 2204N 0.74 1.28 0.00 0.22 2.02 -1.37 -2.03 112.91 113.78 1y1q h THR 2204Ca 0.07 -1.37 -0.04 0.00 0.77 0.00 0.00 66.41 65.85 1y1q h THR 2204Cb 0.92 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 1y1q h THR 2204CO 0.09 0.46 -0.17 0.00 0.37 0.00 0.00 175.52 176.26 1y1q h MET 2205N 0.69 0.00 0.06 6.66 -0.00 -1.45 -2.74 114.93 118.15 1y1q h MET 2205Ca 0.09 0.00 -0.20 0.00 -0.00 0.00 0.00 59.70 59.59 1y1q h MET 2205Cb 0.79 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.38 1y1q h MET 2205CO 0.06 0.17 -1.02 0.00 -0.00 0.00 0.00 176.91 176.12 1y1q h ALA 2207N -0.14 1.00 -0.14 0.00 0.00 -1.40 -1.20 119.26 117.38 1y1q h ALA 2207Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1y1q h ALA 2207Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1y1q h ALA 2207CO -0.02 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.10 1y1q n SER 2208N -2.33 2.44 -0.64 0.00 3.41 -1.03 -4.57 113.62 110.91 1y1q n SER 2208Ca -0.00 -1.70 0.04 0.00 -0.26 0.00 0.00 58.87 56.95 1y1q n SER 2208Cb 0.12 -0.08 0.07 0.00 -0.26 0.00 0.00 64.21 64.06 1y1q n SER 2208CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1y1q n GLN 2209N 0.78 0.52 -1.44 4.33 6.02 -0.69 -5.00 117.38 121.90 1y1q n GLN 2209Ca 0.10 -1.92 -0.12 0.00 -0.01 0.00 0.00 57.00 55.05 1y1q n GLN 2209Cb 0.38 -0.78 -0.05 0.00 1.02 0.00 0.00 30.24 30.82 1y1q n GLN 2209CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y1q n GLY 2210N -0.38 1.19 3.72 1.08 0.00 -1.09 -5.01 105.19 104.71 1y1q n GLY 2210Ca 0.08 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1y1q n GLY 2210CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y1q s LEU 2211N -2.88 3.64 -0.08 0.99 1.43 -0.54 -5.04 118.68 116.19 1y1q s LEU 2211Ca 0.00 -0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 1y1q s LEU 2211Cb 0.00 -2.20 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 1y1q s LEU 2211CO 0.00 0.23 0.29 -0.13 0.23 0.00 0.00 176.35 176.97 1y1q s ARG 2212N -1.92 3.84 0.03 1.70 0.52 -0.24 -3.92 118.95 118.97 1y1q s ARG 2212Ca 0.23 0.15 -0.02 0.00 -0.52 0.00 0.00 55.73 55.57 1y1q s ARG 2212Cb -0.12 -3.26 -0.02 0.00 0.52 0.00 0.00 34.95 32.07 1y1q s ARG 2212CO 0.15 0.61 -0.00 0.00 0.02 0.00 0.00 175.30 176.08 1y1q s ALA 2213N -0.67 0.21 0.21 2.13 0.00 -1.26 0.26 121.76 122.65 1y1q s ALA 2213Ca 0.19 -0.79 -0.17 0.00 0.00 0.00 0.00 51.96 51.19 1y1q s ALA 2213Cb -0.14 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.21 1y1q s ALA 2213CO 0.08 -0.27 0.54 0.20 0.00 0.00 0.00 175.76 176.31 1y1q s GLY 2214N -2.10 0.00 -0.22 0.00 0.00 -0.64 -0.42 107.32 103.95 1y1q s GLY 2214Ca -0.06 -0.33 -0.16 0.00 0.00 0.00 0.00 44.72 44.17 1y1q s GLY 2214CO -0.05 -0.29 0.56 -0.29 0.00 0.00 0.00 173.10 173.02 1y1q s MET 2215N -3.90 0.60 0.04 2.90 1.75 -1.26 -1.32 119.30 118.12 1y1q s MET 2215Ca 0.11 0.90 0.04 0.00 -1.25 0.00 0.00 55.69 55.49 1y1q s MET 2215Cb -0.02 0.19 -0.02 0.00 2.84 0.00 0.00 34.83 37.82 1y1q s MET 2215CO 0.00 -0.12 -0.12 0.54 -0.65 0.00 0.00 175.02 174.67 1y1q s VAL 2216N 0.91 0.96 -0.10 10.11 0.11 0.35 -2.83 120.40 129.91 1y1q s VAL 2216Ca -0.05 -1.02 -0.14 0.00 -2.93 0.00 0.00 61.98 57.83 1y1q s VAL 2216Cb -0.05 -0.91 0.03 0.00 -1.53 0.00 0.00 36.38 33.92 1y1q s VAL 2216CO -0.08 -0.10 0.37 0.00 -3.33 0.00 0.00 175.10 171.96 1y1q s ALA 2217N -0.98 -0.92 -0.12 1.54 0.00 -0.13 -1.25 121.76 119.89 1y1q s ALA 2217Ca -0.01 0.87 -0.09 0.00 0.00 0.00 0.00 51.96 52.73 1y1q s ALA 2217Cb -0.08 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 1y1q s ALA 2217CO 0.01 -0.21 0.19 0.20 0.00 0.00 0.00 175.76 175.95 1y1q s GLY 2218N -0.26 2.19 -0.19 0.00 0.00 0.20 0.67 107.32 109.94 1y1q s GLY 2218Ca -0.04 -0.58 -0.29 0.00 0.00 0.00 0.00 44.72 43.81 1y1q s GLY 2218CO 0.02 -0.17 1.11 0.14 0.00 0.00 0.00 173.10 174.20 1y1q s VAL 2219N -0.72 4.56 -0.60 1.40 1.01 0.39 -0.56 120.40 125.87 1y1q s VAL 2219Ca 0.15 1.87 0.05 0.00 0.00 0.00 0.00 61.98 64.06 1y1q s VAL 2219Cb -0.13 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 32.07 1y1q s VAL 2219CO 0.04 -0.14 0.59 2.30 0.00 0.00 0.00 175.10 177.90 1y1q n ILE 2220N 5.20 0.00 -3.55 2.22 -5.35 0.26 -0.40 119.36 117.74 1y1q n ILE 2220Ca 0.12 -0.48 -0.13 0.00 -0.27 0.00 0.00 62.75 61.99 1y1q n ILE 2220Cb 0.46 1.09 -0.05 0.00 -1.74 0.00 0.00 39.64 39.40 1y1q n ILE 2220CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1y1q s VAL 2221N -0.62 0.00 -0.21 7.28 0.11 -1.22 -4.96 120.40 120.78 1y1q s VAL 2221Ca 0.06 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.09 1y1q s VAL 2221Cb 0.04 -1.00 0.06 0.00 -1.53 0.00 0.00 36.38 33.95 1y1q s VAL 2221CO 0.09 0.00 0.01 0.21 -3.33 0.00 0.00 175.10 172.08 1y1q s ASN 2222N -1.31 3.17 0.15 3.54 3.84 -1.26 -2.59 114.94 120.47 1y1q s ASN 2222Ca -0.04 -0.92 -0.17 0.00 0.21 0.00 0.00 52.86 51.94 1y1q s ASN 2222Cb -0.00 -0.76 0.04 0.00 -0.55 0.00 0.00 41.25 39.98 1y1q s ASN 2222CO 0.03 -0.29 1.72 0.03 -2.79 0.00 0.00 177.10 175.80 1y1q h ARG 2223N 8.16 0.12 0.00 0.43 3.08 -1.79 -1.07 114.38 123.32 1y1q h ARG 2223Ca -0.17 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1y1q h ARG 2223Cb 1.11 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1y1q h ARG 2223CO 0.36 0.08 0.00 0.25 -1.07 0.00 0.00 179.97 179.58 1y1q n THR 2224N -5.14 0.00 0.00 2.04 -2.24 -1.26 -5.10 114.28 102.59 1y1q n THR 2224Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1y1q n THR 2224Cb 0.15 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.98 1y1q n THR 2224CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y1q n GLN 2225N -0.79 0.00 0.00 -0.78 6.02 -0.41 -4.87 117.38 116.55 1y1q n GLN 2225Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1y1q n GLN 2225Cb 0.05 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.31 1y1q n GLN 2225CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 1y1q n THR 2237N 0.00 0.00 -0.23 5.09 5.66 -1.26 -5.06 114.28 118.47 1y1q n THR 2237Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 1y1q n THR 2237Cb 0.00 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 68.81 1y1q n THR 2237CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 1y1q h GLU 2238N 0.00 1.09 -0.32 1.09 4.57 -1.94 -2.41 114.58 116.66 1y1q h GLU 2238Ca 0.00 -0.30 -0.05 0.00 -1.18 0.00 0.00 59.36 57.83 1y1q h GLU 2238Cb 0.00 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1y1q h GLU 2238CO 0.00 1.01 -0.01 0.77 -1.18 0.00 0.00 179.01 179.59 1y1q h SER 2239N 1.00 0.57 0.03 1.04 0.02 -2.00 -2.30 113.55 111.91 1y1q h SER 2239Ca 0.20 -0.32 0.03 0.00 -0.84 0.00 0.00 61.79 60.86 1y1q h SER 2239Cb 0.45 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.79 1y1q h SER 2239CO 0.02 0.75 -0.36 0.45 -1.14 0.00 0.00 176.83 176.54 1y1q h HIS 2240N 0.37 -1.00 -0.49 3.45 3.86 -1.96 0.15 115.15 119.53 1y1q h HIS 2240Ca 0.09 0.03 0.08 0.00 -1.16 0.00 0.00 60.37 59.41 1y1q h HIS 2240Cb 0.46 0.44 -0.10 0.00 1.06 0.00 0.00 27.41 29.27 1y1q h HIS 2240CO 0.04 -0.45 -0.40 0.00 0.86 0.00 0.00 177.93 177.97 1y1q h ALA 2241N 0.10 -0.30 -0.73 2.45 0.00 -1.36 -0.02 119.26 119.40 1y1q h ALA 2241Ca 0.05 0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.16 1y1q h ALA 2241Cb 0.61 0.88 -0.07 0.00 0.00 0.00 0.00 17.79 19.20 1y1q h ALA 2241CO -0.27 -0.81 0.36 0.28 0.00 0.00 0.00 179.25 178.82 1y1q h VAL 2242N -0.26 0.83 -0.33 0.00 2.07 -0.77 -0.72 116.25 117.07 1y1q h VAL 2242Ca 0.17 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.51 1y1q h VAL 2242Cb 0.57 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1y1q h VAL 2242CO -0.63 0.11 0.14 0.11 0.02 0.00 0.00 177.57 177.33 1y1q h LYS 2243N 0.61 0.30 -0.47 1.57 1.57 0.79 -2.38 116.57 118.56 1y1q h LYS 2243Ca 0.36 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 59.10 1y1q h LYS 2243Cb 0.40 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1y1q h LYS 2243CO -0.28 0.20 0.17 0.82 -0.57 0.00 0.00 179.45 179.78 1y1q h ILE 2244N 0.31 1.19 -0.05 1.86 2.04 0.29 -0.88 117.51 122.27 1y1q h ILE 2244Ca 0.14 -0.61 -0.19 0.00 1.00 0.00 0.00 64.86 65.20 1y1q h ILE 2244Cb 0.08 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1y1q h ILE 2244CO -0.12 0.23 -0.79 1.62 0.00 0.00 0.00 178.15 179.09 1y1q h VAL 2245N 0.68 1.40 -0.18 1.67 3.04 -0.86 -1.40 116.25 120.60 1y1q h VAL 2245Ca 0.16 -2.26 -0.14 0.00 -1.01 0.00 0.00 66.70 63.45 1y1q h VAL 2245Cb 0.18 2.22 0.00 0.00 -2.01 0.00 0.00 31.29 31.68 1y1q h VAL 2245CO -0.01 0.68 -0.43 0.58 -1.01 0.00 0.00 177.57 177.37 1y1q h VAL 2246N 0.25 1.33 -0.72 1.51 2.07 -1.23 0.54 116.25 120.01 1y1q h VAL 2246Ca -0.04 -1.68 0.04 0.00 0.82 0.00 0.00 66.70 65.84 1y1q h VAL 2246Cb 1.39 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 33.04 1y1q h VAL 2246CO 0.13 0.52 0.44 -0.33 0.02 0.00 0.00 177.57 178.35 1y1q h GLU 2247N 0.27 0.81 -0.25 1.57 4.39 -1.16 -0.69 114.58 119.52 1y1q h GLU 2247Ca -0.00 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.59 1y1q h GLU 2247Cb 1.04 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 1y1q h GLU 2247CO 0.09 0.54 -0.09 0.00 -1.16 0.00 0.00 179.01 178.39 1y1q h ALA 2248N 1.32 0.34 -0.62 3.43 0.00 -1.16 -2.68 119.26 119.90 1y1q h ALA 2248Ca 0.30 -0.29 0.11 0.00 0.00 0.00 0.00 54.91 55.04 1y1q h ALA 2248Cb 0.08 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1y1q h ALA 2248CO -0.13 0.17 0.42 0.00 0.00 0.00 0.00 179.25 179.71 1y1q h ALA 2249N 0.74 2.09 -0.43 0.00 0.00 -0.44 -1.92 119.26 119.30 1y1q h ALA 2249Ca 0.06 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.03 1y1q h ALA 2249Cb 0.57 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 1y1q h ALA 2249CO 0.03 -0.24 0.07 -0.09 0.00 0.00 0.00 179.25 179.02 1y1q h ARG 2250N 0.36 0.20 -0.19 0.00 9.65 -0.78 -2.56 114.38 121.06 1y1q h ARG 2250Ca 0.29 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.16 1y1q h ARG 2250Cb 0.66 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.19 1y1q h ARG 2250CO -0.08 0.13 0.00 2.89 2.80 0.00 0.00 179.97 185.71 1y1q n ARG 2251N -5.12 1.44 -0.05 0.20 1.85 -0.73 -3.70 116.66 110.55 1y1q n ARG 2251Ca 0.04 -0.69 0.05 0.00 -1.00 0.00 0.00 57.85 56.25 1y1q n ARG 2251Cb 0.21 -1.17 0.07 0.00 -1.05 0.00 0.00 32.46 30.52 1y1q n ARG 2251CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1y1q n LEU 2252N 0.05 2.02 -0.39 2.89 4.77 -0.97 -5.05 117.00 120.32 1y1q n LEU 2252Ca 0.07 -2.41 0.14 0.00 -0.03 0.00 0.00 56.01 53.78 1y1q n LEU 2252Cb 0.17 -0.21 0.60 0.00 -2.33 0.00 0.00 43.42 41.66 1y1q n LEU 2252CO 0.05 0.57 0.91 0.18 -1.33 0.00 0.00 177.39 177.78