#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pdw n SER 2003N 0.00 0.61 -4.78 0.00 7.64 -1.26 -4.91 113.62 110.92 1pdw n SER 2003Ca 0.00 1.14 -0.34 0.00 1.01 0.00 0.00 58.87 60.69 1pdw n SER 2003Cb 0.00 -1.05 0.02 0.00 -1.01 0.00 0.00 64.21 62.18 1pdw n SER 2003CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1pdw s LYS 2004N 0.04 3.10 -0.08 1.43 3.01 -1.26 -4.79 119.74 121.19 1pdw s LYS 2004Ca 0.85 1.43 0.04 0.00 -1.01 0.00 0.00 55.97 57.27 1pdw s LYS 2004Cb -1.09 -1.99 -0.01 0.00 -1.01 0.00 0.00 37.83 33.73 1pdw s LYS 2004CO 0.53 -1.01 -0.20 1.03 0.51 0.00 0.00 175.35 176.20 1pdw s ARG 2005N -3.80 2.80 -0.00 1.68 0.52 -1.26 -1.11 118.95 117.77 1pdw s ARG 2005Ca 0.68 -0.81 0.08 0.00 -0.52 0.00 0.00 55.73 55.16 1pdw s ARG 2005Cb -0.21 -2.33 -0.02 0.00 0.52 0.00 0.00 34.95 32.92 1pdw s ARG 2005CO 0.35 0.36 -0.26 0.00 0.02 0.00 0.00 175.30 175.78 1pdw s ALA 2006N -0.09 2.13 -0.22 2.13 0.00 0.05 -1.18 121.76 124.59 1pdw s ALA 2006Ca -0.04 -1.13 -0.03 0.00 0.00 0.00 0.00 51.96 50.76 1pdw s ALA 2006Cb -0.14 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.46 1pdw s ALA 2006CO 0.04 0.52 -0.07 -1.17 0.00 0.00 0.00 175.76 175.08 1pdw s LEU 2007N -0.74 2.84 -0.33 0.00 2.96 -0.40 -0.56 118.68 122.45 1pdw s LEU 2007Ca 0.10 -0.51 -0.05 0.00 -0.22 0.00 0.00 54.13 53.44 1pdw s LEU 2007Cb -0.10 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 44.94 1pdw s LEU 2007CO -0.00 -0.04 0.08 -0.69 -1.32 0.00 0.00 176.35 174.38 1pdw s VAL 2008N 1.43 3.62 -0.43 1.68 1.01 -0.68 -0.20 120.40 126.83 1pdw s VAL 2008Ca 0.05 -1.15 -0.29 0.00 0.00 0.00 0.00 61.98 60.59 1pdw s VAL 2008Cb -0.14 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.22 1pdw s VAL 2008CO -0.05 -0.14 1.12 -0.63 0.00 0.00 0.00 175.10 175.40 1pdw s ILE 2009N 1.38 4.30 -0.33 2.22 1.01 -0.97 -0.85 121.20 127.95 1pdw s ILE 2009Ca -0.02 1.39 -0.10 0.00 0.00 0.00 0.00 60.65 61.91 1pdw s ILE 2009Cb -0.19 -4.55 0.00 0.00 0.01 0.00 0.00 42.46 37.73 1pdw s ILE 2009CO 0.02 -0.84 0.18 -0.22 0.00 0.00 0.00 174.94 174.07 1pdw s LEU 2010N 4.20 4.33 0.26 2.97 2.96 0.30 -4.45 118.68 129.26 1pdw s LEU 2010Ca 0.47 -0.65 0.10 0.00 -0.22 0.00 0.00 54.13 53.83 1pdw s LEU 2010Cb -0.09 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 1pdw s LEU 2010CO 0.27 -0.26 -0.08 0.00 -1.32 0.00 0.00 176.35 174.96 1pdw s ALA 2011N 1.61 3.00 0.29 5.97 0.00 -1.26 -0.83 121.76 130.53 1pdw s ALA 2011Ca 0.04 -1.71 -0.30 0.00 0.00 0.00 0.00 51.96 49.99 1pdw s ALA 2011Cb -0.18 -0.60 -0.11 0.00 0.00 0.00 0.00 23.12 22.23 1pdw s ALA 2011CO 0.07 0.29 1.58 0.21 0.00 0.00 0.00 175.76 177.91 1pdw s LYS 2012N -3.53 4.14 0.00 0.00 2.20 -1.26 -1.76 119.74 119.52 1pdw s LYS 2012Ca 0.30 2.54 0.00 0.00 -0.36 0.00 0.00 55.97 58.46 1pdw s LYS 2012Cb -0.06 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.22 1pdw s LYS 2012CO 0.18 -0.61 0.00 0.41 -0.36 0.00 0.00 175.35 174.97 1pdw n GLY 2013N 2.20 0.75 3.77 5.54 0.00 -0.55 -2.98 105.19 113.92 1pdw n GLY 2013Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1pdw n GLY 2013CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pdw s ALA 2014N -2.39 2.61 -0.35 4.61 0.00 -0.73 -1.54 121.76 123.97 1pdw s ALA 2014Ca 0.00 0.76 -0.29 0.00 0.00 0.00 0.00 51.96 52.43 1pdw s ALA 2014Cb 0.00 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1pdw s ALA 2014CO 0.00 -0.97 1.07 -2.00 0.00 0.00 0.00 175.76 173.86 1pdw s GLU 2015N -3.54 3.99 0.00 0.00 -6.30 -0.78 0.94 118.70 113.00 1pdw s GLU 2015Ca 0.71 0.94 0.00 0.00 -2.50 0.00 0.00 54.97 54.12 1pdw s GLU 2015Cb -0.23 -3.77 0.00 0.00 0.00 0.00 0.00 34.13 30.12 1pdw s GLU 2015CO 0.32 -0.99 0.15 -0.85 0.02 0.00 0.00 175.26 173.91 1pdw n GLU 2016N 7.03 0.12 0.00 4.30 0.00 -1.26 -1.95 120.64 128.89 1pdw n GLU 2016Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.28 1pdw n GLU 2016Cb 0.48 -1.44 0.00 0.00 0.00 0.00 0.00 31.44 30.48 1pdw n GLU 2016CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1pdw n GLU 2018N 1.19 0.00 -0.13 3.44 1.02 -1.26 -1.02 120.64 123.88 1pdw n GLU 2018Ca 0.00 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.87 1pdw n GLU 2018Cb 0.06 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.38 1pdw n GLU 2018CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1pdw n THR 2019N 0.00 1.53 -0.10 2.62 -1.04 -0.82 -4.49 114.28 111.97 1pdw n THR 2019Ca 0.00 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.05 61.61 1pdw n THR 2019Cb 0.00 -1.94 -0.04 0.00 -1.82 0.00 0.00 70.33 66.53 1pdw n THR 2019CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1pdw h VAL 2020N -1.00 1.30 -0.32 12.58 2.07 -1.36 -2.94 116.25 126.58 1pdw h VAL 2020Ca -0.59 -1.41 0.04 0.00 0.82 0.00 0.00 66.70 65.56 1pdw h VAL 2020Cb 1.51 1.52 -0.04 0.00 -1.52 0.00 0.00 31.29 32.76 1pdw h VAL 2020CO -0.36 0.45 0.08 0.40 0.02 0.00 0.00 177.57 178.17 1pdw h ILE 2021N 0.47 0.86 -0.47 4.57 2.04 -1.83 0.16 117.51 123.31 1pdw h ILE 2021Ca 0.05 -0.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 1pdw h ILE 2021Cb 0.82 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1pdw h ILE 2021CO 0.07 0.04 0.11 -0.65 0.00 0.00 0.00 178.15 177.71 1pdw h PRO 2022N 0.20 0.76 -0.07 2.37 0.11 -1.79 0.89 132.00 134.48 1pdw h PRO 2022Ca 0.15 -0.19 0.01 0.00 0.11 0.00 0.00 66.00 66.08 1pdw h PRO 2022Cb 0.15 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1pdw h PRO 2022CO -0.18 0.75 -0.01 0.28 -0.21 0.00 0.00 178.00 178.63 1pdw h VAL 2023N 0.64 0.94 0.51 3.15 2.07 -1.28 -3.04 116.25 119.24 1pdw h VAL 2023Ca 0.15 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.64 1pdw h VAL 2023Cb 0.34 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1pdw h VAL 2023CO 0.00 0.00 -0.26 -0.78 0.02 0.00 0.00 177.57 176.56 1pdw h ASP 2024N 0.02 -0.62 0.00 0.57 1.82 -0.56 -1.28 116.42 116.38 1pdw h ASP 2024Ca 0.03 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.70 1pdw h ASP 2024Cb 0.04 0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.22 1pdw h ASP 2024CO -0.06 -0.43 0.00 0.52 -1.61 0.00 0.00 179.24 177.66 1pdw n VAL 2025N -5.40 0.00 0.00 2.25 0.31 0.30 -1.63 118.33 114.16 1pdw n VAL 2025Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 1pdw n VAL 2025Cb 0.30 -0.19 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 1pdw n VAL 2025CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1pdw n ARG 2027N 0.67 0.00 0.20 5.55 1.74 -0.48 -1.84 116.66 122.50 1pdw n ARG 2027Ca 0.00 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.15 1pdw n ARG 2027Cb 0.00 0.00 0.35 0.00 -1.02 0.00 0.00 32.46 31.79 1pdw n ARG 2027CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pdw h ARG 2028N 0.00 0.00 -0.00 5.56 3.08 -1.56 -2.68 114.38 118.78 1pdw h ARG 2028Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1pdw h ARG 2028Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1pdw h ARG 2028CO 0.00 0.31 -0.00 0.00 -1.07 0.00 0.00 179.97 179.21 1pdw n ALA 2029N -2.25 2.69 -1.05 0.04 0.00 -0.76 -4.86 120.51 114.32 1pdw n ALA 2029Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1pdw n ALA 2029Cb 0.50 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1pdw n ALA 2029CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdw n GLY 2030N 1.00 0.48 3.76 0.00 0.00 -1.01 -5.04 105.19 104.39 1pdw n GLY 2030Ca 0.24 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 1pdw n GLY 2030CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pdw s ILE 2031N -2.00 5.34 -0.44 -0.61 1.01 -1.26 -4.54 121.20 118.70 1pdw s ILE 2031Ca 0.00 0.42 -0.29 0.00 0.00 0.00 0.00 60.65 60.78 1pdw s ILE 2031Cb 0.00 -3.56 0.03 0.00 0.01 0.00 0.00 42.46 38.94 1pdw s ILE 2031CO 0.00 0.45 1.11 -0.54 0.00 0.00 0.00 174.94 175.97 1pdw s LYS 2032N 0.08 3.80 -0.05 2.79 1.02 -0.27 -4.12 119.74 122.99 1pdw s LYS 2032Ca 0.15 0.67 -0.02 0.00 0.02 0.00 0.00 55.97 56.79 1pdw s LYS 2032Cb -0.13 -3.87 -0.04 0.00 -0.52 0.00 0.00 37.83 33.28 1pdw s LYS 2032CO 0.03 -1.26 0.05 0.08 -0.92 0.00 0.00 175.35 173.33 1pdw s VAL 2033N 4.22 4.59 -0.29 3.17 1.01 -1.26 -0.77 120.40 131.08 1pdw s VAL 2033Ca 0.47 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.18 1pdw s VAL 2033Cb -0.08 -3.02 0.08 0.00 0.00 0.00 0.00 36.38 33.36 1pdw s VAL 2033CO 0.27 0.49 -0.00 -0.89 0.00 0.00 0.00 175.10 174.97 1pdw s THR 2034N -1.04 1.81 -0.62 3.92 2.01 0.27 -4.94 115.64 117.06 1pdw s THR 2034Ca 0.18 -1.72 -0.28 0.00 0.31 0.00 0.00 61.69 60.18 1pdw s THR 2034Cb -0.12 -2.18 0.03 0.00 0.01 0.00 0.00 72.50 70.25 1pdw s THR 2034CO 0.08 -0.35 1.23 -0.69 -0.69 0.00 0.00 174.62 174.20 1pdw s VAL 2035N 1.20 3.92 -0.28 3.82 1.01 -1.26 -1.68 120.40 127.14 1pdw s VAL 2035Ca 0.02 0.77 -0.12 0.00 0.00 0.00 0.00 61.98 62.64 1pdw s VAL 2035Cb -0.19 -4.75 -0.05 0.00 0.00 0.00 0.00 36.38 31.40 1pdw s VAL 2035CO -0.09 -1.45 0.25 0.00 0.00 0.00 0.00 175.10 173.81 1pdw s ALA 2036N 5.25 3.54 -0.07 5.51 0.00 -0.03 -0.72 121.76 135.24 1pdw s ALA 2036Ca 0.42 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 51.09 1pdw s ALA 2036Cb -0.08 -2.56 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 1pdw s ALA 2036CO 0.23 -0.58 1.28 0.20 0.00 0.00 0.00 175.76 176.89 1pdw s GLY 2037N 1.71 1.90 0.06 0.00 0.00 0.12 -0.54 107.32 110.57 1pdw s GLY 2037Ca 0.10 0.65 -0.24 0.00 0.00 0.00 0.00 44.72 45.23 1pdw s GLY 2037CO 0.11 2.39 1.60 -2.00 0.00 0.00 0.00 173.10 175.20 1pdw h LEU 2038N 8.72 -0.05 -0.13 0.66 5.85 -1.32 0.43 115.31 129.46 1pdw h LEU 2038Ca -0.33 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1pdw h LEU 2038Cb 1.15 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1pdw h LEU 2038CO 0.91 0.09 0.00 0.00 -0.34 0.00 0.00 178.44 179.10 1pdw n ALA 2039N -2.18 2.07 0.00 1.25 0.00 -1.26 -4.63 120.51 115.75 1pdw n ALA 2039Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1pdw n ALA 2039Cb 0.11 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1pdw n ALA 2039CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdw n GLY 2040N 0.89 -0.14 0.54 0.00 0.00 -1.09 -4.93 105.19 100.46 1pdw n GLY 2040Ca 0.05 -0.79 0.05 0.00 0.00 0.00 0.00 46.02 45.32 1pdw n GLY 2040CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1pdw n LYS 2041N 0.00 2.89 -3.69 1.61 2.85 -1.26 -3.54 118.16 117.02 1pdw n LYS 2041Ca 0.00 -1.97 -0.27 0.00 -1.05 0.00 0.00 58.31 55.02 1pdw n LYS 2041Cb 0.00 -1.23 -0.03 0.00 -0.65 0.00 0.00 35.03 33.12 1pdw n LYS 2041CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1pdw s ASP 2042N -1.00 6.38 0.17 -5.58 1.01 -1.26 -4.69 116.67 111.71 1pdw s ASP 2042Ca 0.20 0.39 -0.30 0.00 0.71 0.00 0.00 52.55 53.54 1pdw s ASP 2042Cb 0.10 -2.00 -0.17 0.00 1.01 0.00 0.00 42.92 41.86 1pdw s ASP 2042CO 0.13 -0.05 0.69 -2.65 0.21 0.00 0.00 175.17 173.50 1pdw n PRO 2043N -0.72 0.18 -4.18 8.23 -0.02 -1.26 -4.63 135.00 132.60 1pdw n PRO 2043Ca -0.05 0.06 -0.34 0.00 -2.02 0.00 0.00 63.50 61.15 1pdw n PRO 2043Cb 0.54 -1.20 -0.11 0.00 -0.02 0.00 0.00 33.50 32.71 1pdw n PRO 2043CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pdw s VAL 2044N -0.80 4.34 -0.53 -1.45 1.01 0.11 -4.90 120.40 118.18 1pdw s VAL 2044Ca 0.68 -0.19 -0.24 0.00 0.00 0.00 0.00 61.98 62.23 1pdw s VAL 2044Cb -0.96 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 32.52 1pdw s VAL 2044CO 0.56 0.47 0.90 -1.58 0.00 0.00 0.00 175.10 175.45 1pdw s GLN 2045N 0.40 3.32 0.93 2.72 0.74 -1.26 -1.39 119.66 125.13 1pdw s GLN 2045Ca -0.00 -0.30 -0.13 0.00 0.05 0.00 0.00 55.36 54.98 1pdw s GLN 2045Cb -0.13 -4.04 0.15 0.00 1.10 0.00 0.00 33.01 30.09 1pdw s GLN 2045CO 0.02 -1.42 1.16 0.00 -0.55 0.00 0.00 175.29 174.49 1pdw h SER 2047N -1.57 0.20 -0.48 0.00 4.64 0.47 0.71 113.55 117.51 1pdw h SER 2047Ca -0.49 0.04 -0.27 0.00 -0.47 0.00 0.00 61.79 60.60 1pdw h SER 2047Cb 1.32 0.01 -0.16 0.00 -0.31 0.00 0.00 62.40 63.25 1pdw h SER 2047CO 0.57 0.03 -0.02 0.54 -0.87 0.00 0.00 176.83 177.08 1pdw n ARG 2048N -4.39 2.05 -0.84 4.77 3.00 -1.26 -4.95 116.66 115.04 1pdw n ARG 2048Ca 0.25 -3.27 0.00 0.00 -0.01 0.00 0.00 57.85 54.83 1pdw n ARG 2048Cb 1.07 -1.91 0.00 0.00 0.00 0.00 0.00 32.46 31.62 1pdw n ARG 2048CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1pdw n ASP 2049N -1.09 -2.26 -4.73 0.55 8.00 0.24 -4.98 116.55 112.30 1pdw n ASP 2049Ca 0.38 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.47 1pdw n ASP 2049Cb 1.07 -1.89 -0.03 0.00 -0.02 0.00 0.00 41.12 40.26 1pdw n ASP 2049CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pdw s VAL 2050N -1.82 3.31 -0.34 2.53 1.01 -1.26 -4.69 120.40 119.14 1pdw s VAL 2050Ca 0.00 1.00 -0.12 0.00 0.00 0.00 0.00 61.98 62.87 1pdw s VAL 2050Cb 0.00 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 1pdw s VAL 2050CO 0.00 0.11 0.22 -0.69 0.00 0.00 0.00 175.10 174.74 1pdw s VAL 2051N 0.61 5.01 -0.11 2.92 1.01 -1.26 -1.25 120.40 127.33 1pdw s VAL 2051Ca 0.60 -0.39 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 1pdw s VAL 2051Cb -0.36 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1pdw s VAL 2051CO 0.34 -0.04 -0.09 -0.63 0.00 0.00 0.00 175.10 174.68 1pdw s ILE 2052N 1.67 3.44 -0.39 2.22 1.01 -0.49 -4.88 121.20 123.78 1pdw s ILE 2052Ca 0.05 -0.55 -0.20 0.00 0.00 0.00 0.00 60.65 59.95 1pdw s ILE 2052Cb -0.18 -2.44 0.01 0.00 0.01 0.00 0.00 42.46 39.87 1pdw s ILE 2052CO 0.09 0.55 0.62 0.00 0.00 0.00 0.00 174.94 176.19 1pdw s PRO 2054N 2.70 3.08 0.34 0.00 0.04 -1.26 -4.91 135.00 134.98 1pdw s PRO 2054Ca 0.23 1.86 0.15 0.00 0.04 0.00 0.00 61.00 63.27 1pdw s PRO 2054Cb -0.14 -2.01 0.58 0.00 0.04 0.00 0.00 34.50 32.96 1pdw s PRO 2054CO 0.16 -1.13 1.71 -0.44 0.04 0.00 0.00 177.00 177.34 1pdw h ASP 2055N 1.07 0.00 -5.02 6.66 3.32 -1.30 -3.47 116.42 117.67 1pdw h ASP 2055Ca -0.50 0.00 0.06 0.00 0.02 0.00 0.00 57.03 56.61 1pdw h ASP 2055Cb 1.29 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.76 1pdw h ASP 2055CO 0.56 0.47 0.28 0.00 -1.72 0.00 0.00 179.24 178.82 1pdw s ALA 2056N -3.72 -1.42 0.45 3.45 0.00 -1.09 -5.01 121.76 114.41 1pdw s ALA 2056Ca -0.01 0.05 -0.13 0.00 0.00 0.00 0.00 51.96 51.87 1pdw s ALA 2056Cb 0.12 0.80 -0.07 0.00 0.00 0.00 0.00 23.12 23.98 1pdw s ALA 2056CO 0.72 -0.94 0.87 -1.54 0.00 0.00 0.00 175.76 174.86 1pdw s SER 2057N -2.85 6.57 0.29 0.00 1.04 -1.25 0.12 113.70 117.61 1pdw s SER 2057Ca 0.08 1.33 -0.03 0.00 0.48 0.00 0.00 55.95 57.81 1pdw s SER 2057Cb -0.04 -2.41 0.39 0.00 0.10 0.00 0.00 66.02 64.07 1pdw s SER 2057CO -0.00 -0.48 1.96 0.25 0.98 0.00 0.00 173.24 175.94 1pdw h LEU 2058N 1.10 1.00 -0.45 2.42 5.85 -0.31 -0.28 115.31 124.65 1pdw h LEU 2058Ca -0.47 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.31 1pdw h LEU 2058Cb 1.19 -0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.88 1pdw h LEU 2058CO 0.63 0.73 -0.08 -0.08 -0.34 0.00 0.00 178.44 179.30 1pdw h GLU 2059N 1.18 0.03 -0.07 1.25 4.81 -1.88 1.14 114.58 121.04 1pdw h GLU 2059Ca 0.32 -0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.34 1pdw h GLU 2059Cb -0.13 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.26 1pdw h GLU 2059CO -0.07 0.02 -0.75 -0.44 -0.73 0.00 0.00 179.01 177.04 1pdw h ASP 2060N 0.03 0.79 -0.75 1.04 3.32 -1.86 -3.27 116.42 115.72 1pdw h ASP 2060Ca 0.22 -0.68 -0.04 0.00 0.02 0.00 0.00 57.03 56.55 1pdw h ASP 2060Cb 0.33 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 1pdw h ASP 2060CO -0.44 1.35 0.33 0.00 -1.72 0.00 0.00 179.24 178.77 1pdw h ALA 2061N 0.45 1.14 -0.78 3.45 0.00 -0.48 -2.88 119.26 120.17 1pdw h ALA 2061Ca -0.07 -0.17 0.16 0.00 0.00 0.00 0.00 54.91 54.83 1pdw h ALA 2061Cb 1.40 -0.30 -0.11 0.00 0.00 0.00 0.00 17.79 18.79 1pdw h ALA 2061CO 0.15 0.63 0.27 -0.22 0.00 0.00 0.00 179.25 180.08 1pdw h LYS 2062N 1.09 0.36 0.00 0.00 3.64 0.13 -0.82 116.57 120.97 1pdw h LYS 2062Ca 0.26 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.54 1pdw h LYS 2062Cb 0.17 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1pdw h LYS 2062CO -0.03 0.24 -0.38 0.87 -2.27 0.00 0.00 179.45 177.88 1pdw h LYS 2063N 0.37 0.00 -5.02 1.90 1.57 -1.60 -3.40 116.57 110.39 1pdw h LYS 2063Ca 0.44 0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.78 1pdw h LYS 2063Cb 0.74 0.00 0.11 0.00 0.08 0.00 0.00 32.23 33.16 1pdw h LYS 2063CO -0.47 0.38 1.04 0.39 -0.57 0.00 0.00 179.45 180.22 1pdw n GLU 2064N -4.04 0.03 0.00 3.15 -0.58 -0.32 -4.85 120.64 114.04 1pdw n GLU 2064Ca -0.02 -1.18 0.00 0.00 -0.42 0.00 0.00 57.16 55.54 1pdw n GLU 2064Cb 0.42 -2.87 0.00 0.00 -0.57 0.00 0.00 31.44 28.42 1pdw n GLU 2064CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1pdw n GLY 2065N 5.28 0.44 3.87 0.62 0.00 -1.26 -4.72 105.19 109.42 1pdw n GLY 2065Ca 0.46 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 1pdw n GLY 2065CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pdw s PRO 2066N 0.00 3.80 -0.10 1.61 0.04 -1.26 -4.98 135.00 134.12 1pdw s PRO 2066Ca 0.00 0.24 -0.01 0.00 0.04 0.00 0.00 61.00 61.27 1pdw s PRO 2066Cb 0.00 -2.85 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 1pdw s PRO 2066CO 0.00 0.45 -0.07 0.71 0.04 0.00 0.00 177.00 178.14 1pdw s TYR 2067N -1.58 2.95 0.25 0.56 1.51 -1.26 -4.93 117.35 114.84 1pdw s TYR 2067Ca 0.40 -0.13 0.32 0.00 -1.01 0.00 0.00 57.07 56.65 1pdw s TYR 2067Cb -0.13 -1.79 1.72 0.00 -0.11 0.00 0.00 41.96 41.65 1pdw s TYR 2067CO 0.20 0.18 1.97 -0.44 -1.11 0.00 0.00 175.55 176.35 1pdw h ASP 2068N 5.78 0.00 -3.69 2.29 3.32 -1.52 -3.42 116.42 119.18 1pdw h ASP 2068Ca -0.42 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.63 1pdw h ASP 2068Cb 1.18 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.50 1pdw h ASP 2068CO 0.56 0.00 0.26 0.54 -1.72 0.00 0.00 179.24 178.87 1pdw s VAL 2069N -3.83 0.00 -0.24 -1.35 0.11 -1.20 -3.59 120.40 110.30 1pdw s VAL 2069Ca -0.04 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.00 1pdw s VAL 2069Cb 0.09 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.96 1pdw s VAL 2069CO 0.29 0.00 -0.07 -0.69 -3.33 0.00 0.00 175.10 171.30 1pdw s VAL 2070N 0.32 2.85 -0.23 2.04 1.01 -1.04 -1.27 120.40 124.08 1pdw s VAL 2070Ca 0.01 -0.95 -0.12 0.00 0.00 0.00 0.00 61.98 60.92 1pdw s VAL 2070Cb -0.05 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.87 1pdw s VAL 2070CO -0.02 0.26 0.24 -0.69 0.00 0.00 0.00 175.10 174.89 1pdw s VAL 2071N 1.34 5.31 -0.36 2.92 1.01 0.72 -1.10 120.40 130.25 1pdw s VAL 2071Ca 0.01 0.36 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 1pdw s VAL 2071Cb -0.16 -3.57 0.07 0.00 0.00 0.00 0.00 36.38 32.71 1pdw s VAL 2071CO -0.05 0.32 0.12 -0.76 0.00 0.00 0.00 175.10 174.73 1pdw s LEU 2072N 1.11 4.55 0.89 3.92 1.43 0.15 -2.30 118.68 128.43 1pdw s LEU 2072Ca 0.11 -1.46 -0.12 0.00 -1.03 0.00 0.00 54.13 51.64 1pdw s LEU 2072Cb -0.14 -1.83 0.12 0.00 0.03 0.00 0.00 46.19 44.38 1pdw s LEU 2072CO 0.05 -0.39 1.10 -2.84 0.23 0.00 0.00 176.35 174.50 1pdw s PRO 2073N 1.29 1.34 0.00 1.29 0.02 -1.26 -1.58 135.00 136.09 1pdw s PRO 2073Ca 0.00 0.73 0.00 0.00 0.02 0.00 0.00 61.00 61.75 1pdw s PRO 2073Cb -0.21 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1pdw s PRO 2073CO -0.00 -2.16 0.00 0.41 -0.33 0.00 0.00 177.00 174.92 1pdw n GLY 2074N -1.37 1.16 0.04 0.52 0.00 -0.86 -3.68 105.19 101.00 1pdw n GLY 2074Ca 0.07 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1pdw n GLY 2074CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pdw n GLY 2075N 5.00 0.91 0.00 -0.02 0.00 -1.26 -1.87 105.19 107.96 1pdw n GLY 2075Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1pdw n GLY 2075CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pdw n ASN 2076N -0.02 0.00 -0.31 1.61 3.02 -1.26 -0.33 115.26 117.97 1pdw n ASN 2076Ca 0.00 0.91 0.06 0.00 -0.03 0.00 0.00 54.58 55.52 1pdw n ASN 2076Cb 0.00 -0.41 0.21 0.00 -0.61 0.00 0.00 39.78 38.98 1pdw n ASN 2076CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1pdw h LEU 2077N 0.00 0.66 0.01 3.41 4.07 -1.88 0.15 115.31 121.73 1pdw h LEU 2077Ca 0.00 0.07 0.01 0.00 0.08 0.00 0.00 57.88 58.04 1pdw h LEU 2077Cb 0.00 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 1pdw h LEU 2077CO 0.00 0.33 -0.06 1.23 -1.08 0.00 0.00 178.44 178.86 1pdw h GLY 2078N 0.75 -0.07 1.29 0.83 0.00 -0.94 -0.06 103.07 104.87 1pdw h GLY 2078Ca 0.45 0.07 -0.08 0.00 0.00 0.00 0.00 47.33 47.78 1pdw h GLY 2078CO -0.31 -0.07 0.02 0.00 0.00 0.00 0.00 176.54 176.18 1pdw h ALA 2079N 0.87 1.05 -0.53 3.60 0.00 -0.01 -0.80 119.26 123.44 1pdw h ALA 2079Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1pdw h ALA 2079Cb 0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1pdw h ALA 2079CO -0.06 0.59 0.35 0.37 0.00 0.00 0.00 179.25 180.50 1pdw h GLN 2080N 0.81 0.70 -0.42 0.00 4.15 -0.32 0.58 115.11 120.61 1pdw h GLN 2080Ca 0.16 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.47 1pdw h GLN 2080Cb 0.46 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 1pdw h GLN 2080CO 0.02 0.47 0.01 -0.91 -1.93 0.00 0.00 178.83 176.49 1pdw h ASN 2081N 0.72 0.62 -0.34 -0.69 -0.26 -0.65 -1.62 115.58 113.36 1pdw h ASN 2081Ca 0.19 -0.13 -0.10 0.00 -0.56 0.00 0.00 56.30 55.70 1pdw h ASN 2081Cb -0.07 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.01 1pdw h ASN 2081CO -0.04 0.68 -0.16 -0.07 -1.06 0.00 0.00 177.43 176.79 1pdw h LEU 2082N 0.63 0.80 0.00 1.61 3.38 0.09 -2.44 115.31 119.37 1pdw h LEU 2082Ca 0.13 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1pdw h LEU 2082Cb 0.37 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1pdw h LEU 2082CO 0.01 0.96 0.00 -1.20 0.09 0.00 0.00 178.44 178.30 1pdw n SER 2083N -4.14 0.00 0.00 -0.43 7.64 0.19 -2.94 113.62 113.94 1pdw n SER 2083Ca 0.01 -0.50 0.00 0.00 1.01 0.00 0.00 58.87 59.39 1pdw n SER 2083Cb 0.40 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1pdw n SER 2083CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1pdw n GLU 2084N -1.11 -0.88 -3.09 1.43 1.02 -0.82 -4.87 120.64 112.32 1pdw n GLU 2084Ca 0.16 -0.50 -0.40 0.00 -0.02 0.00 0.00 57.16 56.39 1pdw n GLU 2084Cb 0.12 -0.98 -0.06 0.00 -0.02 0.00 0.00 31.44 30.50 1pdw n GLU 2084CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1pdw s SER 2085N -0.02 6.67 0.45 1.62 0.15 -0.98 -4.93 113.70 116.66 1pdw s SER 2085Ca 0.00 0.81 0.25 0.00 0.70 0.00 0.00 55.95 57.71 1pdw s SER 2085Cb 0.00 -2.35 0.96 0.00 -1.71 0.00 0.00 66.02 62.92 1pdw s SER 2085CO 0.00 -0.33 1.84 0.00 1.20 0.00 0.00 173.24 175.96 1pdw h ALA 2086N 7.63 1.03 -0.33 5.45 0.00 -1.93 -2.33 119.26 128.79 1pdw h ALA 2086Ca -0.29 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.27 1pdw h ALA 2086Cb 1.13 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1pdw h ALA 2086CO 0.78 0.26 -0.42 0.00 0.00 0.00 0.00 179.25 179.87 1pdw h ALA 2087N 1.79 0.64 -0.07 0.00 0.00 -1.96 -2.16 119.26 117.50 1pdw h ALA 2087Ca -0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1pdw h ALA 2087Cb 0.72 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1pdw h ALA 2087CO 0.03 0.67 -0.04 0.28 0.00 0.00 0.00 179.25 180.19 1pdw h VAL 2088N 0.66 1.34 -0.48 0.00 2.07 -1.79 -1.31 116.25 116.74 1pdw h VAL 2088Ca 0.05 -1.10 0.10 0.00 0.82 0.00 0.00 66.70 66.57 1pdw h VAL 2088Cb 0.99 1.93 -0.09 0.00 -1.52 0.00 0.00 31.29 32.60 1pdw h VAL 2088CO 0.10 0.30 -0.08 0.50 0.02 0.00 0.00 177.57 178.41 1pdw h LYS 2089N -0.25 0.04 0.27 1.57 3.64 -1.41 0.33 116.57 120.75 1pdw h LYS 2089Ca 0.01 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1pdw h LYS 2089Cb 0.50 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1pdw h LYS 2089CO 0.01 0.03 -0.25 1.49 -2.27 0.00 0.00 179.45 178.46 1pdw h GLU 2090N 0.04 -0.52 -0.85 1.90 4.81 -1.33 -0.31 114.58 118.32 1pdw h GLU 2090Ca 0.24 0.04 0.10 0.00 -0.13 0.00 0.00 59.36 59.60 1pdw h GLU 2090Cb 0.36 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 29.79 1pdw h GLU 2090CO -0.47 -0.35 0.50 0.82 -0.73 0.00 0.00 179.01 178.78 1pdw h ILE 2091N -0.54 0.91 -0.29 2.32 2.04 -0.20 -1.80 117.51 119.96 1pdw h ILE 2091Ca -0.01 -0.28 -0.14 0.00 1.00 0.00 0.00 64.86 65.43 1pdw h ILE 2091Cb 0.50 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1pdw h ILE 2091CO -0.05 0.15 -0.37 -0.07 0.00 0.00 0.00 178.15 177.82 1pdw h LEU 2092N 0.83 0.82 0.52 1.44 3.38 -0.10 -1.52 115.31 120.68 1pdw h LEU 2092Ca 0.41 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1pdw h LEU 2092Cb 0.38 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1pdw h LEU 2092CO -0.25 1.15 -0.34 0.11 0.09 0.00 0.00 178.44 179.21 1pdw h LYS 2093N 0.51 -0.80 0.04 1.13 1.79 -0.67 -0.51 116.57 118.06 1pdw h LYS 2093Ca 0.04 0.05 0.03 0.00 -2.18 0.00 0.00 60.65 58.59 1pdw h LYS 2093Cb 0.95 0.18 -0.04 0.00 -1.58 0.00 0.00 32.23 31.74 1pdw h LYS 2093CO 0.09 -0.53 -0.28 0.93 -1.08 0.00 0.00 179.45 178.57 1pdw h GLU 2094N -0.83 -0.44 -0.72 3.15 5.08 -1.39 0.10 114.58 119.54 1pdw h GLU 2094Ca -0.06 0.03 0.16 0.00 -1.00 0.00 0.00 59.36 58.49 1pdw h GLU 2094Cb 0.68 0.10 -0.12 0.00 0.50 0.00 0.00 28.75 29.91 1pdw h GLU 2094CO 0.05 -0.29 0.02 0.37 -1.00 0.00 0.00 179.01 178.16 1pdw h GLN 2095N -0.46 0.12 0.86 2.33 5.75 -1.14 0.16 115.11 122.74 1pdw h GLN 2095Ca 0.05 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1pdw h GLN 2095Cb 0.52 -0.03 0.01 0.00 1.07 0.00 0.00 27.48 29.05 1pdw h GLN 2095CO -0.22 0.08 -0.41 1.49 -2.65 0.00 0.00 178.83 177.12 1pdw h GLU 2096N 0.12 -1.12 -0.91 1.69 4.81 -0.34 0.61 114.58 119.44 1pdw h GLU 2096Ca 0.39 0.08 0.22 0.00 -0.13 0.00 0.00 59.36 59.92 1pdw h GLU 2096Cb 0.68 0.25 -0.12 0.00 0.63 0.00 0.00 28.75 30.19 1pdw h GLU 2096CO -0.62 -0.74 0.43 -0.91 -0.73 0.00 0.00 179.01 176.44 1pdw h ASN 2097N -1.30 0.40 -0.03 1.04 -0.26 -0.29 0.72 115.58 115.87 1pdw h ASN 2097Ca -0.12 0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.77 1pdw h ASN 2097Cb 0.89 0.11 0.00 0.00 -1.06 0.00 0.00 38.32 38.26 1pdw h ASN 2097CO 0.19 0.03 0.00 -2.11 -1.06 0.00 0.00 177.43 174.48 1pdw n ARG 2098N -5.01 1.11 -3.51 0.81 1.85 0.51 -4.87 116.66 107.55 1pdw n ARG 2098Ca 0.23 -0.13 -0.18 0.00 -1.00 0.00 0.00 57.85 56.77 1pdw n ARG 2098Cb 0.66 -1.19 0.07 0.00 -1.05 0.00 0.00 32.46 30.95 1pdw n ARG 2098CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1pdw n LYS 2099N -0.26 -5.96 -4.55 2.89 4.76 0.25 -5.00 118.16 110.29 1pdw n LYS 2099Ca 0.01 0.78 -0.34 0.00 -2.87 0.00 0.00 58.31 55.89 1pdw n LYS 2099Cb 0.11 -5.64 -0.12 0.00 -1.84 0.00 0.00 35.03 27.55 1pdw n LYS 2099CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1pdw s GLY 2100N -4.34 1.70 0.35 0.72 0.00 0.21 -5.02 107.32 100.94 1pdw s GLY 2100Ca 0.01 -0.86 -0.28 0.00 0.00 0.00 0.00 44.72 43.59 1pdw s GLY 2100CO 0.76 -0.42 1.40 -0.10 0.00 0.00 0.00 173.10 174.73 1pdw n LEU 2101N 2.76 4.05 -3.98 0.66 7.94 -1.24 -4.34 117.00 122.86 1pdw n LEU 2101Ca -0.18 1.21 -0.26 0.00 -1.11 0.00 0.00 56.01 55.67 1pdw n LEU 2101Cb 0.53 -1.54 -0.17 0.00 0.53 0.00 0.00 43.42 42.77 1pdw n LEU 2101CO 0.29 -0.19 -0.46 -0.63 -1.11 0.00 0.00 177.39 175.29 1pdw s ILE 2102N -0.95 1.12 -0.13 1.96 1.01 0.43 -2.50 121.20 122.13 1pdw s ILE 2102Ca 0.56 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.82 1pdw s ILE 2102Cb -0.53 -1.07 0.01 0.00 0.01 0.00 0.00 42.46 40.87 1pdw s ILE 2102CO 0.61 0.37 -0.22 0.00 0.00 0.00 0.00 174.94 175.70 1pdw s ALA 2103N 1.12 2.26 0.00 9.38 0.00 -0.25 -0.45 121.76 133.82 1pdw s ALA 2103Ca -0.06 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.88 1pdw s ALA 2103Cb -0.14 -0.98 -0.01 0.00 0.00 0.00 0.00 23.12 21.99 1pdw s ALA 2103CO -0.02 0.05 -0.12 0.00 0.00 0.00 0.00 175.76 175.67 1pdw s ALA 2104N 0.70 0.95 0.01 0.00 0.00 0.35 0.30 121.76 124.08 1pdw s ALA 2104Ca -0.10 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.33 1pdw s ALA 2104Cb -0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.74 1pdw s ALA 2104CO 0.01 0.21 -0.09 -1.50 0.00 0.00 0.00 175.76 174.39 1pdw s ILE 2105N -0.44 0.73 0.00 0.00 2.07 -0.62 -1.78 121.20 121.16 1pdw s ILE 2105Ca 0.03 -0.64 0.00 0.00 -1.41 0.00 0.00 60.65 58.63 1pdw s ILE 2105Cb -0.05 -0.66 0.00 0.00 0.13 0.00 0.00 42.46 41.88 1pdw s ILE 2105CO 0.00 0.03 0.00 0.00 -1.91 0.00 0.00 174.94 173.06 1pdw n ALA 2107N 5.32 2.71 -0.34 0.00 0.00 -1.26 -1.00 120.51 125.94 1pdw n ALA 2107Ca 0.00 -0.54 0.19 0.00 0.00 0.00 0.00 53.44 53.09 1pdw n ALA 2107Cb 0.00 -0.69 0.41 0.00 0.00 0.00 0.00 19.45 19.17 1pdw n ALA 2107CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pdw h GLY 2108N 3.83 1.90 1.33 0.00 0.00 -1.40 -1.54 103.07 107.19 1pdw h GLY 2108Ca -0.03 -0.29 0.06 0.00 0.00 0.00 0.00 47.33 47.07 1pdw h GLY 2108CO 0.00 -0.28 0.28 -2.55 0.00 0.00 0.00 176.54 173.98 1pdw h PRO 2109N 0.52 0.00 0.00 4.80 0.11 -1.80 0.50 132.00 136.13 1pdw h PRO 2109Ca 0.66 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.77 1pdw h PRO 2109Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1pdw h PRO 2109CO -0.49 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.55 1pdw n THR 2110N -3.60 0.92 0.21 -1.15 -2.24 -0.58 -0.45 114.28 107.39 1pdw n THR 2110Ca 0.02 0.35 0.11 0.00 -2.27 0.00 0.00 64.05 62.26 1pdw n THR 2110Cb 0.40 -1.29 0.27 0.00 -2.10 0.00 0.00 70.33 67.61 1pdw n THR 2110CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pdw h ALA 2111N 2.21 0.94 -0.02 6.98 0.00 -1.08 -1.81 119.26 126.49 1pdw h ALA 2111Ca 0.00 -0.12 -0.25 0.00 0.00 0.00 0.00 54.91 54.55 1pdw h ALA 2111Cb 0.26 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.05 1pdw h ALA 2111CO 0.00 0.16 -0.96 -0.07 0.00 0.00 0.00 179.25 178.38 1pdw h LEU 2112N 0.00 0.87 0.13 0.00 3.38 -0.88 -2.83 115.31 115.99 1pdw h LEU 2112Ca -0.00 -0.73 -0.01 0.00 0.09 0.00 0.00 57.88 57.23 1pdw h LEU 2112Cb 0.96 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1pdw h LEU 2112CO 0.02 1.49 -0.06 0.25 0.09 0.00 0.00 178.44 180.22 1pdw h LEU 2113N 0.35 -0.15 -1.31 1.67 5.85 -1.35 0.14 115.31 120.51 1pdw h LEU 2113Ca -0.12 -0.14 0.14 0.00 0.84 0.00 0.00 57.88 58.60 1pdw h LEU 2113Cb 1.62 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 42.62 1pdw h LEU 2113CO 0.19 0.06 0.57 0.00 -0.34 0.00 0.00 178.44 178.91 1pdw h ALA 2114N 0.49 1.85 -0.67 1.25 0.00 -1.40 -0.83 119.26 119.95 1pdw h ALA 2114Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pdw h ALA 2114Cb 0.28 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1pdw h ALA 2114CO 0.03 -0.08 0.00 0.72 0.00 0.00 0.00 179.25 179.92 1pdw n HIS 2115N -4.55 1.39 -3.79 0.00 8.25 -1.07 -4.97 115.22 110.49 1pdw n HIS 2115Ca 0.17 -0.57 -0.36 0.00 -0.26 0.00 0.00 57.72 56.70 1pdw n HIS 2115Cb 0.47 -0.19 0.04 0.00 1.12 0.00 0.00 29.99 31.42 1pdw n HIS 2115CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1pdw n GLU 2116N 1.25 -0.94 -4.57 -0.41 1.02 -0.32 -4.94 120.64 111.73 1pdw n GLU 2116Ca 0.26 0.36 -0.33 0.00 -0.02 0.00 0.00 57.16 57.43 1pdw n GLU 2116Cb 0.83 -3.66 -0.11 0.00 -0.02 0.00 0.00 31.44 28.49 1pdw n GLU 2116CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1pdw s ILE 2117N -3.47 3.69 -1.30 -3.67 -1.09 0.41 -4.67 121.20 111.11 1pdw s ILE 2117Ca 0.47 -0.58 -0.05 0.00 -2.23 0.00 0.00 60.65 58.26 1pdw s ILE 2117Cb -0.20 -2.54 0.03 0.00 -1.58 0.00 0.00 42.46 38.18 1pdw s ILE 2117CO 0.89 0.53 0.35 0.61 -1.23 0.00 0.00 174.94 176.09 1pdw n GLY 2118N 1.99 -0.50 3.71 6.18 0.00 -1.26 -4.67 105.19 110.64 1pdw n GLY 2118Ca -0.17 0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1pdw n GLY 2118CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1pdw n PHE 2119N -3.91 2.55 0.00 1.61 0.99 -1.26 -1.36 117.46 116.08 1pdw n PHE 2119Ca -0.08 0.27 0.00 0.00 -0.00 0.00 0.00 57.45 57.64 1pdw n PHE 2119Cb 0.59 -2.56 0.00 0.00 -1.00 0.00 0.00 39.48 36.50 1pdw n PHE 2119CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1pdw n GLY 2120N 2.65 2.56 3.71 1.37 0.00 0.13 -5.00 105.19 110.60 1pdw n GLY 2120Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1pdw n GLY 2120CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pdw s SER 2121N -0.03 3.77 -0.20 1.61 0.01 -0.46 -4.43 113.70 113.97 1pdw s SER 2121Ca 0.00 2.34 -0.19 0.00 1.31 0.00 0.00 55.95 59.41 1pdw s SER 2121Cb 0.00 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.61 1pdw s SER 2121CO 0.00 -2.55 0.56 -0.75 0.41 0.00 0.00 173.24 170.91 1pdw s LYS 2122N -4.11 4.20 0.20 12.44 2.20 -1.26 -1.48 119.74 131.93 1pdw s LYS 2122Ca 0.73 0.49 0.01 0.00 -0.36 0.00 0.00 55.97 56.84 1pdw s LYS 2122Cb -0.28 -3.56 -0.05 0.00 -1.51 0.00 0.00 37.83 32.43 1pdw s LYS 2122CO 0.49 -0.17 0.04 0.14 -0.36 0.00 0.00 175.35 175.49 1pdw s VAL 2123N 1.71 0.54 0.19 4.02 -7.23 0.28 -4.48 120.40 115.43 1pdw s VAL 2123Ca 0.26 -1.98 0.03 0.00 -1.81 0.00 0.00 61.98 58.48 1pdw s VAL 2123Cb -0.16 -2.29 -0.05 0.00 0.56 0.00 0.00 36.38 34.45 1pdw s VAL 2123CO 0.10 -0.30 -0.03 0.28 -0.31 0.00 0.00 175.10 174.84 1pdw s THR 2124N -3.76 0.94 0.28 5.32 -1.32 -1.26 0.06 115.64 115.90 1pdw s THR 2124Ca 0.29 -2.02 -0.06 0.00 -1.21 0.00 0.00 61.69 58.69 1pdw s THR 2124Cb 0.07 -2.14 0.02 0.00 -1.51 0.00 0.00 72.50 68.94 1pdw s THR 2124CO 0.07 -0.48 0.48 0.35 -2.21 0.00 0.00 174.62 172.82 1pdw n THR 2125N -0.30 0.00 -2.26 5.08 -2.24 -1.26 -4.37 114.28 108.94 1pdw n THR 2125Ca -0.07 -1.04 -0.38 0.00 -2.27 0.00 0.00 64.05 60.29 1pdw n THR 2125Cb 0.63 0.78 -0.02 0.00 -2.10 0.00 0.00 70.33 69.62 1pdw n THR 2125CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1pdw s HIS 2126N -3.69 3.00 0.47 4.78 2.46 -0.17 -4.48 115.29 117.65 1pdw s HIS 2126Ca 0.17 1.53 0.29 0.00 0.47 0.00 0.00 55.06 57.52 1pdw s HIS 2126Cb -0.02 -3.43 1.36 0.00 -0.13 0.00 0.00 32.58 30.36 1pdw s HIS 2126CO 0.12 -1.45 1.75 -1.35 -2.47 0.00 0.00 174.74 171.34 1pdw h PRO 2127N 2.54 0.17 0.00 2.88 0.11 -1.91 0.33 132.00 136.12 1pdw h PRO 2127Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1pdw h PRO 2127Cb 1.24 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1pdw h PRO 2127CO 0.62 0.11 0.00 1.28 -0.21 0.00 0.00 178.00 179.80 1pdw n LEU 2128N -4.44 0.15 -0.97 2.35 4.77 -1.26 -3.22 117.00 114.38 1pdw n LEU 2128Ca 0.28 0.51 0.09 0.00 -0.03 0.00 0.00 56.01 56.87 1pdw n LEU 2128Cb 1.16 -0.47 0.20 0.00 -2.33 0.00 0.00 43.42 41.99 1pdw n LEU 2128CO 0.31 -0.04 0.67 0.00 -1.33 0.00 0.00 177.39 176.99 1pdw n ALA 2129N -1.55 2.34 0.23 -1.18 0.00 0.12 -4.69 120.51 115.78 1pdw n ALA 2129Ca 0.07 -1.07 -0.09 0.00 0.00 0.00 0.00 53.44 52.35 1pdw n ALA 2129Cb 0.35 -0.69 -0.04 0.00 0.00 0.00 0.00 19.45 19.06 1pdw n ALA 2129CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1pdw h LYS 2130N 3.43 -0.57 -0.73 0.00 3.64 -1.50 -3.25 116.57 117.59 1pdw h LYS 2130Ca 0.00 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.55 1pdw h LYS 2130Cb 0.85 0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 32.66 1pdw h LYS 2130CO 0.00 -0.38 -0.27 -0.44 -2.27 0.00 0.00 179.45 176.09 1pdw h ASP 2131N -0.66 -0.97 0.00 4.20 3.32 -1.83 -3.41 116.42 117.07 1pdw h ASP 2131Ca -0.06 0.24 -0.35 0.00 0.02 0.00 0.00 57.03 56.88 1pdw h ASP 2131Cb 0.45 0.55 0.09 0.00 0.22 0.00 0.00 39.33 40.64 1pdw h ASP 2131CO 0.10 -0.28 1.07 1.17 -1.72 0.00 0.00 179.24 179.58 1pdw n LYS 2132N -5.48 0.00 0.00 3.56 4.81 -1.23 -4.91 118.16 114.92 1pdw n LYS 2132Ca 0.08 -0.67 0.00 0.00 -0.87 0.00 0.00 58.31 56.85 1pdw n LYS 2132Cb 0.38 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.38 1pdw n LYS 2132CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1pdw n ASN 2135N 6.93 0.00 0.00 3.14 5.15 -1.26 -5.08 115.26 124.14 1pdw n ASN 2135Ca 0.28 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.26 1pdw n ASN 2135Cb 0.29 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.54 1pdw n ASN 2135CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1pdw n GLY 2136N 0.17 1.52 3.63 8.20 0.00 -1.26 -4.65 105.19 112.80 1pdw n GLY 2136Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1pdw n GLY 2136CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pdw n GLY 2137N -1.29 -0.41 0.58 -0.02 0.00 -1.26 -4.89 105.19 97.90 1pdw n GLY 2137Ca 0.00 0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.26 1pdw n GLY 2137CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1pdw n HIS 2138N -4.48 0.33 -4.02 1.61 8.25 -1.26 -4.89 115.22 110.76 1pdw n HIS 2138Ca -0.16 -0.17 -0.09 0.00 -0.26 0.00 0.00 57.72 57.04 1pdw n HIS 2138Cb 0.62 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.67 1pdw n HIS 2138CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1pdw s TYR 2139N -1.67 0.45 -0.21 4.41 2.02 -1.26 0.19 117.35 121.29 1pdw s TYR 2139Ca 0.28 -0.80 -0.04 0.00 -0.37 0.00 0.00 57.07 56.14 1pdw s TYR 2139Cb 0.15 0.12 -0.01 0.00 -0.40 0.00 0.00 41.96 41.81 1pdw s TYR 2139CO 0.21 -0.97 -0.05 0.99 -1.57 0.00 0.00 175.55 174.16 1pdw s THR 2140N -4.00 3.38 0.44 -0.71 2.01 -0.55 -4.95 115.64 111.26 1pdw s THR 2140Ca 0.24 -0.50 -0.23 0.00 0.31 0.00 0.00 61.69 61.52 1pdw s THR 2140Cb 0.00 -2.53 -0.08 0.00 0.01 0.00 0.00 72.50 69.90 1pdw s THR 2140CO 0.10 0.44 1.09 -0.47 -0.69 0.00 0.00 174.62 175.08 1pdw s TYR 2141N 1.31 3.07 0.04 4.92 5.04 -1.26 -0.56 117.35 129.92 1pdw s TYR 2141Ca 0.04 1.59 0.06 0.00 -2.44 0.00 0.00 57.07 56.32 1pdw s TYR 2141Cb -0.14 -3.21 -0.02 0.00 0.35 0.00 0.00 41.96 38.93 1pdw s TYR 2141CO -0.02 -0.99 -0.17 0.45 -1.34 0.00 0.00 175.55 173.49 1pdw s SER 2142N -1.56 1.97 0.08 4.32 0.15 0.11 -4.82 113.70 113.95 1pdw s SER 2142Ca 0.62 -0.49 0.23 0.00 0.70 0.00 0.00 55.95 57.00 1pdw s SER 2142Cb -0.23 -0.14 0.07 0.00 -1.71 0.00 0.00 66.02 64.00 1pdw s SER 2142CO 0.29 0.07 1.04 1.21 1.20 0.00 0.00 173.24 177.06 1pdw n GLU 2143N 1.83 0.36 -1.75 5.44 4.07 -1.26 -4.49 120.64 124.83 1pdw n GLU 2143Ca -0.18 0.02 -0.42 0.00 -0.06 0.00 0.00 57.16 56.52 1pdw n GLU 2143Cb 0.54 -1.64 -0.01 0.00 -0.06 0.00 0.00 31.44 30.28 1pdw n GLU 2143CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1pdw n ASN 2144N -2.11 3.62 -0.20 4.31 5.03 -1.26 -4.90 115.26 119.75 1pdw n ASN 2144Ca 0.01 1.21 0.05 0.00 0.87 0.00 0.00 54.58 56.72 1pdw n ASN 2144Cb 0.46 -1.59 0.32 0.00 -1.02 0.00 0.00 39.78 37.95 1pdw n ASN 2144CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 1pdw h ARG 2145N 3.31 0.81 -3.97 3.52 3.08 -1.95 -3.39 114.38 115.79 1pdw h ARG 2145Ca -0.49 -0.05 -0.47 0.00 0.07 0.00 0.00 59.98 59.05 1pdw h ARG 2145Cb 1.25 -0.18 -0.37 0.00 0.08 0.00 0.00 29.97 30.75 1pdw h ARG 2145CO 0.67 0.53 -0.78 0.08 -1.07 0.00 0.00 179.97 179.40 1pdw s VAL 2146N -5.73 0.65 -0.14 2.04 1.01 -1.26 -2.45 120.40 114.52 1pdw s VAL 2146Ca -0.10 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1pdw s VAL 2146Cb 0.19 -0.73 0.01 0.00 0.00 0.00 0.00 36.38 35.85 1pdw s VAL 2146CO 0.78 0.29 -0.20 -0.70 0.00 0.00 0.00 175.10 175.27 1pdw s GLU 2147N 1.64 2.87 -0.20 2.72 2.56 -0.09 -5.00 118.70 123.20 1pdw s GLU 2147Ca 0.01 -0.80 0.01 0.00 0.00 0.00 0.00 54.97 54.20 1pdw s GLU 2147Cb -0.13 -2.35 0.03 0.00 2.00 0.00 0.00 34.13 33.68 1pdw s GLU 2147CO -0.05 -0.05 -0.17 0.21 -0.56 0.00 0.00 175.26 174.64 1pdw s LYS 2148N 0.91 2.79 -0.51 4.30 2.20 -1.26 -0.68 119.74 127.50 1pdw s LYS 2148Ca -0.05 -0.97 0.04 0.00 -0.36 0.00 0.00 55.97 54.63 1pdw s LYS 2148Cb -0.15 -2.66 0.13 0.00 -1.51 0.00 0.00 37.83 33.64 1pdw s LYS 2148CO -0.03 -0.31 0.26 0.34 -0.36 0.00 0.00 175.35 175.24 1pdw s ASP 2149N 1.24 4.20 1.46 1.43 2.15 -0.32 -4.99 116.67 121.84 1pdw s ASP 2149Ca 0.01 -2.95 0.00 0.00 0.43 0.00 0.00 52.55 50.04 1pdw s ASP 2149Cb -0.15 -1.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.93 1pdw s ASP 2149CO -0.11 -0.24 0.00 0.61 -0.17 0.00 0.00 175.17 175.27 1pdw n GLY 2150N 3.18 3.20 1.72 2.66 0.00 -1.26 -2.13 105.19 112.57 1pdw n GLY 2150Ca 0.06 -0.18 0.08 0.00 0.00 0.00 0.00 46.02 45.97 1pdw n GLY 2150CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pdw n LEU 2151N 0.00 5.32 -4.12 0.99 4.77 -1.26 -4.79 117.00 117.92 1pdw n LEU 2151Ca 0.00 -2.81 -0.35 0.00 -0.03 0.00 0.00 56.01 52.83 1pdw n LEU 2151Cb 0.00 -0.64 -0.13 0.00 -2.33 0.00 0.00 43.42 40.32 1pdw n LEU 2151CO 0.00 0.69 -0.27 -0.63 -1.33 0.00 0.00 177.39 175.85 1pdw s ILE 2152N -2.52 2.97 -0.17 -0.08 -1.09 -0.91 -0.43 121.20 118.98 1pdw s ILE 2152Ca 0.53 -1.89 -0.03 0.00 -2.23 0.00 0.00 60.65 57.03 1pdw s ILE 2152Cb 0.39 -2.95 -0.02 0.00 -1.58 0.00 0.00 42.46 38.29 1pdw s ILE 2152CO 0.18 -0.47 -0.05 -0.22 -1.23 0.00 0.00 174.94 173.14 1pdw s LEU 2153N 1.13 3.04 0.20 2.97 0.20 0.40 -1.17 118.68 125.45 1pdw s LEU 2153Ca 0.04 -0.25 0.05 0.00 0.69 0.00 0.00 54.13 54.65 1pdw s LEU 2153Cb -0.21 -1.74 -0.05 0.00 -0.43 0.00 0.00 46.19 43.76 1pdw s LEU 2153CO -0.04 0.10 -0.06 0.42 -0.29 0.00 0.00 176.35 176.48 1pdw s THR 2154N 0.76 1.21 0.15 3.68 -4.23 0.15 -0.50 115.64 116.86 1pdw s THR 2154Ca -0.02 -2.07 -0.07 0.00 -1.18 0.00 0.00 61.69 58.35 1pdw s THR 2154Cb -0.15 -2.11 -0.02 0.00 1.34 0.00 0.00 72.50 71.57 1pdw s THR 2154CO 0.02 -0.53 0.21 -0.55 -0.54 0.00 0.00 174.62 173.23 1pdw s SER 2155N -3.26 0.12 -0.09 3.99 0.15 -0.74 -0.91 113.70 112.97 1pdw s SER 2155Ca 0.23 -0.96 -0.22 0.00 0.70 0.00 0.00 55.95 55.69 1pdw s SER 2155Cb 0.04 0.39 -0.29 0.00 -1.71 0.00 0.00 66.02 64.45 1pdw s SER 2155CO 0.05 -0.84 0.77 0.03 1.20 0.00 0.00 173.24 174.45 1pdw h ARG 2156N 2.64 0.21 0.00 5.44 2.47 -1.70 -0.84 114.38 122.60 1pdw h ARG 2156Ca -0.33 -0.35 0.00 0.00 -1.26 0.00 0.00 59.98 58.04 1pdw h ARG 2156Cb 1.22 0.13 0.00 0.00 -1.65 0.00 0.00 29.97 29.67 1pdw h ARG 2156CO 0.52 1.17 0.00 0.41 0.56 0.00 0.00 179.97 182.63 1pdw n GLY 2157N 1.66 0.96 0.28 0.04 0.00 -1.26 -2.87 105.19 104.00 1pdw n GLY 2157Ca -0.16 -0.78 0.07 0.00 0.00 0.00 0.00 46.02 45.15 1pdw n GLY 2157CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1pdw h PRO 2158N 0.00 0.21 0.00 1.61 0.11 -1.98 0.19 132.00 132.14 1pdw h PRO 2158Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1pdw h PRO 2158Cb 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.06 1pdw h PRO 2158CO 0.00 0.14 0.00 0.41 -0.21 0.00 0.00 178.00 178.34 1pdw n GLY 2159N -1.37 -0.83 0.33 -0.55 0.00 -1.26 -2.00 105.19 99.50 1pdw n GLY 2159Ca 0.16 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.16 1pdw n GLY 2159CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pdw n THR 2160N -1.43 0.84 -0.29 2.61 -2.24 0.62 -4.73 114.28 109.65 1pdw n THR 2160Ca 0.04 -0.92 -0.01 0.00 -2.27 0.00 0.00 64.05 60.88 1pdw n THR 2160Cb 0.12 0.60 0.11 0.00 -2.10 0.00 0.00 70.33 69.06 1pdw n THR 2160CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1pdw h SER 2161N 1.10 0.81 -0.31 3.42 0.02 -0.95 0.44 113.55 118.06 1pdw h SER 2161Ca 0.00 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1pdw h SER 2161Cb 0.56 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1pdw h SER 2161CO 0.00 0.54 0.04 -0.26 -1.14 0.00 0.00 176.83 176.01 1pdw h PHE 2162N 0.95 0.57 -0.59 3.45 -1.00 -1.85 0.38 116.94 118.84 1pdw h PHE 2162Ca 0.33 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 61.01 1pdw h PHE 2162Cb 0.07 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.45 1pdw h PHE 2162CO -0.04 0.62 0.30 0.93 -1.61 0.00 0.00 178.31 178.52 1pdw h GLU 2163N 0.34 0.84 0.30 1.51 5.08 -1.79 0.12 114.58 120.99 1pdw h GLU 2163Ca 0.09 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1pdw h GLU 2163Cb 0.37 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1pdw h GLU 2163CO 0.01 0.66 -0.19 0.35 -1.00 0.00 0.00 179.01 178.84 1pdw h PHE 2164N 0.80 -0.49 -0.26 4.33 3.57 0.12 -1.11 116.94 123.90 1pdw h PHE 2164Ca 0.21 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.74 1pdw h PHE 2164Cb 0.08 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1pdw h PHE 2164CO -0.01 -0.29 0.05 0.00 -2.23 0.00 0.00 178.31 175.83 1pdw h ALA 2165N 0.21 0.27 -0.05 2.41 0.00 0.12 -1.86 119.26 120.35 1pdw h ALA 2165Ca -0.03 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1pdw h ALA 2165Cb 0.40 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1pdw h ALA 2165CO 0.03 -0.37 -0.17 -0.07 0.00 0.00 0.00 179.25 178.66 1pdw h LEU 2166N 0.14 0.08 -0.40 0.00 3.38 -0.68 -1.79 115.31 116.04 1pdw h LEU 2166Ca 0.12 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 1pdw h LEU 2166Cb 0.13 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1pdw h LEU 2166CO -0.16 0.26 -0.33 0.00 0.09 0.00 0.00 178.44 178.30 1pdw h ALA 2167N 1.75 0.57 -0.39 1.53 0.00 -0.61 0.14 119.26 122.25 1pdw h ALA 2167Ca 0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1pdw h ALA 2167Cb 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1pdw h ALA 2167CO 0.02 0.63 0.22 0.82 0.00 0.00 0.00 179.25 180.94 1pdw h ILE 2168N 0.74 1.15 0.01 0.00 2.04 -0.86 0.68 117.51 121.27 1pdw h ILE 2168Ca 0.07 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1pdw h ILE 2168Cb 0.91 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 37.68 1pdw h ILE 2168CO 0.08 0.15 -0.02 0.58 0.00 0.00 0.00 178.15 178.94 1pdw h VAL 2169N 0.50 0.94 -0.85 1.67 2.07 -1.16 -1.41 116.25 118.01 1pdw h VAL 2169Ca 0.14 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.74 1pdw h VAL 2169Cb 0.05 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 1pdw h VAL 2169CO -0.02 0.00 0.51 -0.08 0.02 0.00 0.00 177.57 178.00 1pdw h GLU 2170N -0.05 0.87 -0.00 1.57 4.81 -0.38 0.36 114.58 121.75 1pdw h GLU 2170Ca 0.01 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.12 1pdw h GLU 2170Cb 0.06 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1pdw h GLU 2170CO -0.02 0.57 -0.28 0.00 -0.73 0.00 0.00 179.01 178.55 1pdw h ALA 2171N 1.43 1.53 0.03 2.92 0.00 -0.35 0.11 119.26 124.93 1pdw h ALA 2171Ca 0.39 -0.26 -0.37 0.00 0.00 0.00 0.00 54.91 54.68 1pdw h ALA 2171Cb 0.27 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1pdw h ALA 2171CO -0.21 0.36 -2.08 1.28 0.00 0.00 0.00 179.25 178.60 1pdw n LEU 2172N -4.20 2.35 -0.47 0.00 4.32 -0.58 -4.66 117.00 113.76 1pdw n LEU 2172Ca -0.02 0.21 0.05 0.00 -0.02 0.00 0.00 56.01 56.24 1pdw n LEU 2172Cb 0.33 -0.96 0.06 0.00 -1.62 0.00 0.00 43.42 41.24 1pdw n LEU 2172CO 0.38 0.66 0.46 0.59 -1.22 0.00 0.00 177.39 178.26 1pdw n ASN 2173N -3.86 2.09 0.00 -1.43 3.02 0.12 -5.05 115.26 110.15 1pdw n ASN 2173Ca -0.41 -1.55 0.00 0.00 -0.03 0.00 0.00 54.58 52.58 1pdw n ASN 2173Cb 0.90 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 40.03 1pdw n ASN 2173CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pdw n GLY 2174N 0.60 1.23 0.34 7.41 0.00 0.03 -4.37 105.19 110.43 1pdw n GLY 2174Ca 0.07 -1.68 0.17 0.00 0.00 0.00 0.00 46.02 44.58 1pdw n GLY 2174CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pdw h LYS 2175N 0.00 0.00 -0.13 1.61 1.57 -1.89 -2.45 116.57 115.29 1pdw h LYS 2175Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1pdw h LYS 2175Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1pdw h LYS 2175CO 0.00 0.00 -0.13 1.49 -0.57 0.00 0.00 179.45 180.24 1pdw h GLU 2176N 0.00 0.32 -0.72 3.15 4.81 -1.93 -2.91 114.58 117.30 1pdw h GLU 2176Ca 0.10 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.09 1pdw h GLU 2176Cb 0.53 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 1pdw h GLU 2176CO -0.00 0.72 0.20 0.28 -0.73 0.00 0.00 179.01 179.47 1pdw h VAL 2177N -0.07 1.26 -0.80 0.32 2.07 -1.65 -2.01 116.25 115.37 1pdw h VAL 2177Ca 0.02 -0.94 0.20 0.00 0.82 0.00 0.00 66.70 66.80 1pdw h VAL 2177Cb 0.66 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1pdw h VAL 2177CO 0.03 0.37 0.56 0.00 0.02 0.00 0.00 177.57 178.54 1pdw h ALA 2178N 1.10 2.47 0.05 1.67 0.00 -1.42 0.95 119.26 124.07 1pdw h ALA 2178Ca 0.23 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.88 1pdw h ALA 2178Cb 0.35 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1pdw h ALA 2178CO -0.00 -0.70 -1.22 0.00 0.00 0.00 0.00 179.25 177.33 1pdw h ALA 2179N 1.62 0.32 -0.60 0.00 0.00 -1.18 -1.90 119.26 117.53 1pdw h ALA 2179Ca 0.40 -1.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.27 1pdw h ALA 2179Cb 1.27 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 1pdw h ALA 2179CO -0.08 1.20 0.20 1.96 0.00 0.00 0.00 179.25 182.53 1pdw h GLN 2180N 0.03 0.92 -0.19 0.00 4.20 -0.38 -2.23 115.11 117.46 1pdw h GLN 2180Ca -0.11 -0.19 -0.13 0.00 0.06 0.00 0.00 58.65 58.28 1pdw h GLN 2180Cb 1.88 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 29.53 1pdw h GLN 2180CO 0.15 0.82 -0.40 0.28 -0.67 0.00 0.00 178.83 179.01 1pdw h VAL 2181N 0.84 1.33 -0.44 -0.54 2.07 -1.20 -3.34 116.25 114.97 1pdw h VAL 2181Ca 0.19 -1.63 -0.05 0.00 0.82 0.00 0.00 66.70 66.04 1pdw h VAL 2181Cb 0.27 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1pdw h VAL 2181CO -0.01 0.50 0.09 0.50 0.02 0.00 0.00 177.57 178.68 1pdw h LYS 2182N 0.28 0.72 -0.97 1.57 3.64 -1.25 -3.33 116.57 117.23 1pdw h LYS 2182Ca 0.01 -0.18 0.21 0.00 -1.27 0.00 0.00 60.65 59.41 1pdw h LYS 2182Cb 1.00 -0.09 -0.18 0.00 -0.41 0.00 0.00 32.23 32.54 1pdw h LYS 2182CO 0.09 0.73 -0.20 0.00 -2.27 0.00 0.00 179.45 177.79 1pdw h ALA 2183N 0.96 0.72 0.00 5.00 0.00 -1.52 -0.68 119.26 123.73 1pdw h ALA 2183Ca 0.14 0.37 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1pdw h ALA 2183Cb 0.34 0.72 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1pdw h ALA 2183CO 0.00 -0.41 0.00 -2.30 0.00 0.00 0.00 179.25 176.54 1pdw n PRO 2184N -5.59 0.01 0.15 0.00 -0.02 -1.25 -3.77 135.00 124.52 1pdw n PRO 2184Ca 0.16 0.10 0.13 0.00 -2.02 0.00 0.00 63.50 61.87 1pdw n PRO 2184Cb 0.53 -1.51 0.45 0.00 -0.02 0.00 0.00 33.50 32.95 1pdw n PRO 2184CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1pdw h LEU 2185N 0.00 0.00 -1.85 2.45 3.38 -1.29 -3.47 115.31 114.54 1pdw h LEU 2185Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 1pdw h LEU 2185Cb 0.41 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.31 1pdw h LEU 2185CO 0.00 0.00 -0.66 0.52 0.09 0.00 0.00 178.44 178.39 1pdw n VAL 2186N -2.44 -5.57 -2.99 1.22 0.31 -1.25 -5.02 118.33 102.59 1pdw n VAL 2186Ca 0.03 -0.55 -0.21 0.00 -0.01 0.00 0.00 64.34 63.61 1pdw n VAL 2186Cb 0.35 -4.85 0.01 0.00 -0.91 0.00 0.00 33.84 28.44 1pdw n VAL 2186CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1pdw s LEU 2187N -5.57 3.61 0.69 7.52 1.43 -1.26 -5.07 118.68 120.03 1pdw s LEU 2187Ca 0.07 0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 53.01 1pdw s LEU 2187Cb -0.01 -2.93 0.02 0.00 0.03 0.00 0.00 46.19 43.30 1pdw s LEU 2187CO 0.62 -0.78 1.21 -1.59 0.23 0.00 0.00 176.35 176.04 1pdw s LYS 2188N -4.51 2.39 0.00 1.70 0.00 -1.26 -4.83 119.74 113.23 1pdw s LYS 2188Ca 0.51 1.77 0.12 0.00 0.00 0.00 0.00 55.97 58.37 1pdw s LYS 2188Cb -0.10 -1.86 0.69 0.00 0.00 0.00 0.00 37.83 36.56 1pdw s LYS 2188CO 0.36 -1.65 1.12 -3.47 0.00 0.00 0.00 175.35 171.71 1pdw n ASP 2189N -2.40 0.00 0.00 0.03 2.03 -1.26 -5.17 116.55 109.78 1pdw n ASP 2189Ca 0.13 -0.40 0.00 0.00 0.52 0.00 0.00 54.79 55.05 1pdw n ASP 2189Cb 0.50 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 1pdw n ASP 2189CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17