#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w6p s SER 2002N 0.00 0.14 0.28 0.00 1.04 -1.26 -4.27 113.70 109.63 1w6p s SER 2002Ca 0.00 0.69 0.00 0.00 0.48 0.00 0.00 55.95 57.12 1w6p s SER 2002Cb 0.00 -0.96 0.00 0.00 0.10 0.00 0.00 66.02 65.16 1w6p s SER 2002CO 0.00 -4.61 0.00 0.61 0.98 0.00 0.00 173.24 170.22 1w6p n GLY 2003N -0.12 1.02 3.77 7.32 0.00 -0.44 -4.66 105.19 112.08 1w6p n GLY 2003Ca 0.13 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 1w6p n GLY 2003CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1w6p s LEU 2004N 0.00 4.35 -0.08 0.99 0.20 -1.25 -4.62 118.68 118.27 1w6p s LEU 2004Ca 0.00 2.94 0.02 0.00 0.69 0.00 0.00 54.13 57.78 1w6p s LEU 2004Cb 0.00 -3.66 0.01 0.00 -0.43 0.00 0.00 46.19 42.11 1w6p s LEU 2004CO 0.00 -0.79 -0.15 -0.69 -0.29 0.00 0.00 176.35 174.43 1w6p s VAL 2005N -0.95 1.41 -0.04 1.68 1.01 -1.26 -1.00 120.40 121.25 1w6p s VAL 2005Ca 0.53 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.93 1w6p s VAL 2005Cb -0.45 -1.27 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 1w6p s VAL 2005CO 0.58 0.42 -0.16 0.00 0.00 0.00 0.00 175.10 175.94 1w6p s ALA 2006N 0.69 1.40 0.30 5.51 0.00 0.13 -5.00 121.76 124.78 1w6p s ALA 2006Ca -0.13 -0.64 0.06 0.00 0.00 0.00 0.00 51.96 51.25 1w6p s ALA 2006Cb -0.16 -0.45 -0.06 0.00 0.00 0.00 0.00 23.12 22.45 1w6p s ALA 2006CO 0.04 0.26 -0.01 -1.54 0.00 0.00 0.00 175.76 174.50 1w6p s SER 2007N -0.00 2.71 -1.53 0.00 1.04 -1.26 -0.97 113.70 113.68 1w6p s SER 2007Ca -0.02 -1.26 -0.05 0.00 0.48 0.00 0.00 55.95 55.09 1w6p s SER 2007Cb -0.10 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 65.87 1w6p s SER 2007CO 0.01 -0.44 0.64 -3.20 0.98 0.00 0.00 173.24 171.23 1w6p n ASN 2008N -0.64 -5.97 -0.12 7.02 2.85 0.11 -4.89 115.26 113.62 1w6p n ASN 2008Ca -0.04 -0.31 -0.04 0.00 -0.11 0.00 0.00 54.58 54.08 1w6p n ASN 2008Cb 0.65 -4.82 0.18 0.00 1.24 0.00 0.00 39.78 37.02 1w6p n ASN 2008CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1w6p h LEU 2009N -1.44 0.77 -1.16 1.20 4.07 -1.52 -3.47 115.31 113.76 1w6p h LEU 2009Ca -0.53 -0.16 -0.45 0.00 0.08 0.00 0.00 57.88 56.82 1w6p h LEU 2009Cb 1.36 -0.20 0.01 0.00 1.08 0.00 0.00 40.66 42.91 1w6p h LEU 2009CO 0.57 0.79 -0.77 -3.20 -1.08 0.00 0.00 178.44 174.75 1w6p n ASN 2010N -4.25 -4.11 -4.68 -0.43 5.15 -1.10 -4.92 115.26 100.93 1w6p n ASN 2010Ca 0.03 -0.76 -0.43 0.00 -0.60 0.00 0.00 54.58 52.83 1w6p n ASN 2010Cb 0.26 -4.08 -0.02 0.00 -0.53 0.00 0.00 39.78 35.40 1w6p n ASN 2010CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1w6p s LEU 2011N -7.13 4.22 0.27 1.20 2.96 -0.09 -4.85 118.68 115.26 1w6p s LEU 2011Ca 0.49 1.69 0.06 0.00 -0.22 0.00 0.00 54.13 56.14 1w6p s LEU 2011Cb -0.24 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 42.88 1w6p s LEU 2011CO 0.81 -0.63 0.39 -0.54 -1.32 0.00 0.00 176.35 175.07 1w6p s LYS 2012N 2.70 3.31 0.16 1.98 1.02 -1.26 -0.79 119.74 126.87 1w6p s LYS 2012Ca 0.53 -0.86 -0.34 0.00 0.02 0.00 0.00 55.97 55.32 1w6p s LYS 2012Cb -0.22 -2.86 -0.15 0.00 -0.52 0.00 0.00 37.83 34.09 1w6p s LYS 2012CO 0.17 0.30 1.43 -2.30 -0.92 0.00 0.00 175.35 174.03 1w6p n PRO 2013N -1.48 1.76 0.00 -1.68 -0.02 -1.26 -1.32 135.00 130.99 1w6p n PRO 2013Ca -0.06 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1w6p n PRO 2013Cb 0.57 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1w6p n PRO 2013CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w6p n GLY 2014N 2.72 3.02 3.77 -1.23 0.00 -0.58 -4.98 105.19 107.90 1w6p n GLY 2014Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1w6p n GLY 2014CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w6p s GLU 2015N -0.22 3.99 -0.26 1.61 2.02 -0.44 -4.89 118.70 120.52 1w6p s GLU 2015Ca 0.00 1.99 -0.10 0.00 0.02 0.00 0.00 54.97 56.89 1w6p s GLU 2015Cb 0.00 -2.71 -0.04 0.00 0.10 0.00 0.00 34.13 31.48 1w6p s GLU 2015CO 0.00 -0.42 0.15 0.00 0.02 0.00 0.00 175.26 175.01 1w6p s LEU 2017N 1.46 4.32 -0.21 0.00 2.96 0.50 -0.98 118.68 126.73 1w6p s LEU 2017Ca 0.07 -0.35 -0.06 0.00 -0.22 0.00 0.00 54.13 53.57 1w6p s LEU 2017Cb -0.15 -2.10 -0.02 0.00 0.50 0.00 0.00 46.19 44.41 1w6p s LEU 2017CO 0.07 -0.19 0.01 -0.13 -1.32 0.00 0.00 176.35 174.80 1w6p s ARG 2018N 1.71 3.61 -0.13 1.98 0.52 -0.30 -0.30 118.95 126.03 1w6p s ARG 2018Ca 0.06 -0.52 0.01 0.00 -0.52 0.00 0.00 55.73 54.76 1w6p s ARG 2018Cb -0.17 -3.13 0.02 0.00 0.52 0.00 0.00 34.95 32.18 1w6p s ARG 2018CO 0.10 -0.05 -0.15 0.08 0.02 0.00 0.00 175.30 175.29 1w6p s VAL 2019N 1.19 1.59 -0.11 3.52 1.01 -0.24 -0.69 120.40 126.67 1w6p s VAL 2019Ca 0.03 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.36 1w6p s VAL 2019Cb -0.14 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.76 1w6p s VAL 2019CO 0.02 0.46 -0.18 -0.60 0.00 0.00 0.00 175.10 174.79 1w6p s ARG 2020N 1.22 3.17 0.20 2.72 3.52 -0.24 -0.97 118.95 128.56 1w6p s ARG 2020Ca -0.01 -0.78 -0.11 0.00 -0.13 0.00 0.00 55.73 54.70 1w6p s ARG 2020Cb -0.14 -2.46 -0.00 0.00 -1.56 0.00 0.00 34.95 30.79 1w6p s ARG 2020CO -0.06 0.22 0.38 0.20 -0.81 0.00 0.00 175.30 175.23 1w6p s GLY 2021N 0.28 0.47 -0.25 8.12 0.00 -0.24 0.19 107.32 115.89 1w6p s GLY 2021Ca -0.13 -0.84 -0.11 0.00 0.00 0.00 0.00 44.72 43.64 1w6p s GLY 2021CO 0.07 -0.71 0.19 -0.54 0.00 0.00 0.00 173.10 172.11 1w6p s GLU 2022N -3.98 4.03 -0.06 2.90 2.02 0.43 -0.43 118.70 123.60 1w6p s GLU 2022Ca 0.19 -0.25 -0.30 0.00 0.02 0.00 0.00 54.97 54.63 1w6p s GLU 2022Cb 0.01 -3.59 -0.02 0.00 0.10 0.00 0.00 34.13 30.64 1w6p s GLU 2022CO 0.03 -0.05 1.01 0.08 0.02 0.00 0.00 175.26 176.36 1w6p s VAL 2023N 1.37 4.79 0.32 2.63 1.01 0.12 -1.33 120.40 129.31 1w6p s VAL 2023Ca 0.08 2.03 -0.28 0.00 0.00 0.00 0.00 61.98 63.81 1w6p s VAL 2023Cb -0.15 -4.30 -0.13 0.00 0.00 0.00 0.00 36.38 31.80 1w6p s VAL 2023CO 0.07 0.06 1.12 0.00 0.00 0.00 0.00 175.10 176.36 1w6p n ALA 2024N 4.61 0.43 -0.18 5.51 0.00 -0.12 -0.57 120.51 130.20 1w6p n ALA 2024Ca 0.08 0.36 0.08 0.00 0.00 0.00 0.00 53.44 53.96 1w6p n ALA 2024Cb 0.49 -2.12 0.37 0.00 0.00 0.00 0.00 19.45 18.20 1w6p n ALA 2024CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1w6p h PRO 2025N 2.17 0.68 -0.56 0.00 0.13 -1.90 -1.52 132.00 131.00 1w6p h PRO 2025Ca -0.43 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1w6p h PRO 2025Cb 1.32 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1w6p h PRO 2025CO 0.61 0.45 0.00 -0.40 -0.23 0.00 0.00 178.00 178.43 1w6p n ASP 2026N -4.48 4.97 -4.74 1.44 5.68 -1.26 -4.21 116.55 113.94 1w6p n ASP 2026Ca 0.11 -2.68 -0.42 0.00 -0.50 0.00 0.00 54.79 51.30 1w6p n ASP 2026Cb 0.27 -0.60 -0.02 0.00 -1.14 0.00 0.00 41.12 39.62 1w6p n ASP 2026CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1w6p s ALA 2027N -2.28 3.69 -0.67 2.12 0.00 -0.75 -4.88 121.76 119.00 1w6p s ALA 2027Ca 0.50 1.41 0.22 0.00 0.00 0.00 0.00 51.96 54.09 1w6p s ALA 2027Cb 0.36 -3.60 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 1w6p s ALA 2027CO 0.19 -0.82 0.89 1.63 0.00 0.00 0.00 175.76 177.65 1w6p n LYS 2028N 2.60 0.23 -3.70 0.00 4.76 -1.26 -4.82 118.16 115.97 1w6p n LYS 2028Ca 0.08 -0.04 0.04 0.00 -2.87 0.00 0.00 58.31 55.52 1w6p n LYS 2028Cb 0.39 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 1w6p n LYS 2028CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1w6p s SER 2029N -3.63 -0.01 0.12 4.39 1.04 -1.26 -0.62 113.70 113.73 1w6p s SER 2029Ca 0.03 -0.04 -0.14 0.00 0.48 0.00 0.00 55.95 56.28 1w6p s SER 2029Cb 0.15 0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.34 1w6p s SER 2029CO 0.84 -0.07 0.36 0.72 0.98 0.00 0.00 173.24 176.08 1w6p s PHE 2030N -2.07 -0.11 0.00 5.02 -0.12 -0.82 -4.72 117.98 115.17 1w6p s PHE 2030Ca 0.20 -0.23 0.02 0.00 -0.05 0.00 0.00 56.93 56.87 1w6p s PHE 2030Cb 0.05 0.20 -0.01 0.00 -0.63 0.00 0.00 43.02 42.63 1w6p s PHE 2030CO -0.05 -0.69 -0.06 0.08 -0.05 0.00 0.00 175.22 174.45 1w6p s VAL 2031N -3.82 0.47 -0.14 -2.49 1.01 -1.26 -2.84 120.40 111.33 1w6p s VAL 2031Ca 0.04 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 1w6p s VAL 2031Cb 0.02 -0.42 0.04 0.00 0.00 0.00 0.00 36.38 36.02 1w6p s VAL 2031CO -0.11 0.06 -0.02 -0.22 0.00 0.00 0.00 175.10 174.81 1w6p s LEU 2032N -0.35 1.16 -0.06 3.92 1.98 -0.47 -1.72 118.68 123.14 1w6p s LEU 2032Ca 0.01 -0.50 -0.01 0.00 -2.89 0.00 0.00 54.13 50.74 1w6p s LEU 2032Cb -0.03 -0.68 -0.03 0.00 0.66 0.00 0.00 46.19 46.10 1w6p s LEU 2032CO -0.00 -0.21 0.02 0.20 -1.89 0.00 0.00 176.35 174.46 1w6p s ASN 2033N 1.80 5.32 -0.00 3.68 0.01 0.10 -1.36 114.94 124.49 1w6p s ASN 2033Ca 0.02 0.13 0.02 0.00 -0.71 0.00 0.00 52.86 52.32 1w6p s ASN 2033Cb -0.15 -1.49 -0.01 0.00 0.41 0.00 0.00 41.25 40.02 1w6p s ASN 2033CO -0.07 0.35 -0.07 -0.76 -1.51 0.00 0.00 177.10 175.04 1w6p s LEU 2034N -1.13 2.02 0.00 0.60 1.43 -0.02 -1.13 118.68 120.46 1w6p s LEU 2034Ca 0.16 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 1w6p s LEU 2034Cb -0.11 -0.33 0.00 0.00 0.03 0.00 0.00 46.19 45.77 1w6p s LEU 2034CO 0.05 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.31 1w6p n GLY 2035N 2.87 -0.65 0.13 -3.19 0.00 -0.17 -0.54 105.19 103.64 1w6p n GLY 2035Ca -0.13 -0.51 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 1w6p n GLY 2035CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1w6p n LYS 2036N 0.00 0.73 -2.90 1.61 0.00 0.23 -0.52 118.16 117.30 1w6p n LYS 2036Ca 0.00 0.31 -0.05 0.00 0.00 0.00 0.00 58.31 58.58 1w6p n LYS 2036Cb 0.00 -1.72 0.02 0.00 0.00 0.00 0.00 35.03 33.33 1w6p n LYS 2036CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1w6p n ASP 2037N -3.65 -1.43 0.30 3.14 5.68 -1.16 -4.27 116.55 115.16 1w6p n ASP 2037Ca -0.32 -1.93 0.19 0.00 -0.50 0.00 0.00 54.79 52.23 1w6p n ASP 2037Cb 0.99 2.36 1.00 0.00 -1.14 0.00 0.00 41.12 44.33 1w6p n ASP 2037CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1w6p h SER 2038N 1.31 0.00 -0.02 -1.12 4.64 -1.98 -1.91 113.55 114.47 1w6p h SER 2038Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1w6p h SER 2038Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1w6p h SER 2038CO 0.27 0.00 -0.11 0.59 -0.87 0.00 0.00 176.83 176.71 1w6p n ASN 2039N -3.42 2.45 -3.56 4.97 3.02 -1.26 -4.75 115.26 112.71 1w6p n ASN 2039Ca -0.02 -1.73 -0.29 0.00 -0.03 0.00 0.00 54.58 52.51 1w6p n ASN 2039Cb 0.18 0.13 -0.13 0.00 -0.61 0.00 0.00 39.78 39.35 1w6p n ASN 2039CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1w6p s ASN 2040N -1.84 3.31 -0.18 6.41 0.01 -0.72 -0.61 114.94 121.32 1w6p s ASN 2040Ca 0.22 -2.13 -0.04 0.00 -0.71 0.00 0.00 52.86 50.20 1w6p s ASN 2040Cb 0.17 -0.59 -0.02 0.00 0.41 0.00 0.00 41.25 41.21 1w6p s ASN 2040CO 0.32 -0.33 -0.04 -0.76 -1.51 0.00 0.00 177.10 174.79 1w6p s LEU 2041N 1.08 3.10 0.32 0.60 1.43 0.75 -0.60 118.68 125.36 1w6p s LEU 2041Ca 0.16 -0.24 0.24 0.00 -1.03 0.00 0.00 54.13 53.25 1w6p s LEU 2041Cb -0.22 -1.77 0.35 0.00 0.03 0.00 0.00 46.19 44.59 1w6p s LEU 2041CO -0.06 0.09 1.50 0.00 0.23 0.00 0.00 176.35 178.10 1w6p s LEU 2043N -5.56 -0.71 -0.53 0.00 2.96 -0.71 -4.69 118.68 109.44 1w6p s LEU 2043Ca 0.06 0.68 -0.07 0.00 -0.22 0.00 0.00 54.13 54.58 1w6p s LEU 2043Cb 0.08 1.34 0.14 0.00 0.50 0.00 0.00 46.19 48.25 1w6p s LEU 2043CO 0.69 -0.26 0.39 -2.28 -1.32 0.00 0.00 176.35 173.57 1w6p s HIS 2044N 2.61 3.48 -0.43 5.38 5.65 0.61 -0.84 115.29 131.75 1w6p s HIS 2044Ca 0.06 -2.14 -0.21 0.00 0.25 0.00 0.00 55.06 53.01 1w6p s HIS 2044Cb -0.14 -3.44 0.02 0.00 -1.18 0.00 0.00 32.58 27.85 1w6p s HIS 2044CO -0.15 -0.96 0.69 0.12 -0.65 0.00 0.00 174.74 173.79 1w6p s PHE 2045N 0.91 3.05 -0.55 3.88 5.36 -0.46 -2.19 117.98 127.98 1w6p s PHE 2045Ca 0.10 0.06 0.04 0.00 -0.96 0.00 0.00 56.93 56.16 1w6p s PHE 2045Cb -0.23 -3.44 0.16 0.00 -0.34 0.00 0.00 43.02 39.18 1w6p s PHE 2045CO -0.03 -0.89 0.39 1.21 -1.46 0.00 0.00 175.22 174.44 1w6p s ASN 2046N 2.03 3.43 -0.00 6.13 3.04 0.20 -1.37 114.94 128.39 1w6p s ASN 2046Ca 0.25 -3.33 -0.30 0.00 0.04 0.00 0.00 52.86 49.52 1w6p s ASN 2046Cb -0.13 -1.11 -0.05 0.00 -1.54 0.00 0.00 41.25 38.41 1w6p s ASN 2046CO 0.20 -0.15 1.38 -2.84 -3.04 0.00 0.00 177.10 172.64 1w6p s PRO 2047N -0.57 4.29 -0.23 0.43 0.02 -1.13 -1.56 135.00 136.25 1w6p s PRO 2047Ca 0.26 1.93 -0.04 0.00 0.02 0.00 0.00 61.00 63.17 1w6p s PRO 2047Cb -0.06 -3.56 -0.01 0.00 0.02 0.00 0.00 34.50 30.89 1w6p s PRO 2047CO -0.14 -0.55 -0.02 1.03 -0.33 0.00 0.00 177.00 176.98 1w6p s ARG 2048N 2.33 3.36 -0.13 5.54 0.52 0.34 -1.94 118.95 128.97 1w6p s ARG 2048Ca 0.63 -0.64 -0.17 0.00 -0.52 0.00 0.00 55.73 55.03 1w6p s ARG 2048Cb -0.31 -3.07 -0.15 0.00 0.52 0.00 0.00 34.95 31.95 1w6p s ARG 2048CO 0.26 -0.22 0.41 0.74 0.02 0.00 0.00 175.30 176.50 1w6p h PHE 2049N 8.13 0.00 -1.39 -0.53 -1.00 -1.15 0.44 116.94 121.44 1w6p h PHE 2049Ca -0.40 0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.16 1w6p h PHE 2049Cb 1.16 0.00 -0.23 0.00 3.61 0.00 0.00 35.95 40.48 1w6p h PHE 2049CO 0.60 0.60 -0.58 1.21 -1.61 0.00 0.00 178.31 178.53 1w6p s ASN 2050N -5.98 -0.49 -0.11 2.17 3.04 -0.54 -0.96 114.94 112.06 1w6p s ASN 2050Ca -0.12 -1.51 -0.23 0.00 0.04 0.00 0.00 52.86 51.04 1w6p s ASN 2050Cb -0.01 1.33 0.06 0.00 -1.54 0.00 0.00 41.25 41.08 1w6p s ASN 2050CO 0.40 -0.16 0.57 0.00 -3.04 0.00 0.00 177.10 174.87 1w6p s ALA 2051N 1.27 -1.44 -1.44 1.71 0.00 -0.55 -4.78 121.76 116.53 1w6p s ALA 2051Ca 0.22 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1w6p s ALA 2051Cb -0.05 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.68 1w6p s ALA 2051CO -0.06 -0.31 0.00 0.72 0.00 0.00 0.00 175.76 176.11 1w6p n HIS 2052N 1.76 -1.10 -0.38 0.00 8.25 -1.26 -1.08 115.22 121.41 1w6p n HIS 2052Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 1w6p n HIS 2052Cb 0.56 -3.28 0.00 0.00 1.12 0.00 0.00 29.99 28.40 1w6p n HIS 2052CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1w6p n GLY 2053N -0.83 1.13 3.79 -1.41 0.00 -1.26 -5.04 105.19 101.56 1w6p n GLY 2053Ca -0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 1w6p n GLY 2053CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w6p s ASP 2054N -3.06 5.44 -0.04 1.61 1.01 -0.24 -5.12 116.67 116.27 1w6p s ASP 2054Ca 0.00 -0.16 0.02 0.00 0.71 0.00 0.00 52.55 53.12 1w6p s ASP 2054Cb 0.00 -1.40 0.01 0.00 1.01 0.00 0.00 42.92 42.54 1w6p s ASP 2054CO 0.00 0.07 -0.07 0.00 0.21 0.00 0.00 175.17 175.37 1w6p s ALA 2055N -1.77 0.81 -1.17 5.23 0.00 -1.26 -1.48 121.76 122.12 1w6p s ALA 2055Ca 0.31 -0.22 -0.25 0.00 0.00 0.00 0.00 51.96 51.80 1w6p s ALA 2055Cb -0.10 -0.38 0.03 0.00 0.00 0.00 0.00 23.12 22.68 1w6p s ALA 2055CO 0.23 0.08 0.46 0.09 0.00 0.00 0.00 175.76 176.62 1w6p n ASN 2056N 3.63 -2.57 -3.86 0.00 3.02 0.03 -4.95 115.26 110.56 1w6p n ASN 2056Ca -0.21 -1.18 -0.14 0.00 -0.03 0.00 0.00 54.58 53.01 1w6p n ASN 2056Cb 0.53 -1.43 -0.15 0.00 -0.61 0.00 0.00 39.78 38.12 1w6p n ASN 2056CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1w6p s THR 2057N -3.82 0.11 -0.22 3.41 -1.32 -0.51 -4.75 115.64 108.55 1w6p s THR 2057Ca 0.34 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.63 1w6p s THR 2057Cb -0.19 -0.15 -0.03 0.00 -1.51 0.00 0.00 72.50 70.63 1w6p s THR 2057CO 0.89 0.07 0.56 -0.63 -2.21 0.00 0.00 174.62 173.30 1w6p s ILE 2058N 0.34 5.06 -0.16 5.08 1.01 -1.26 -0.50 121.20 130.77 1w6p s ILE 2058Ca -0.03 1.03 -0.02 0.00 0.00 0.00 0.00 60.65 61.63 1w6p s ILE 2058Cb -0.05 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 1w6p s ILE 2058CO -0.01 0.12 -0.08 -0.69 0.00 0.00 0.00 174.94 174.29 1w6p s VAL 2059N 1.93 3.41 0.09 2.92 1.01 -0.60 -1.39 120.40 127.77 1w6p s VAL 2059Ca 0.25 -0.52 0.10 0.00 0.00 0.00 0.00 61.98 61.81 1w6p s VAL 2059Cb -0.16 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 1w6p s VAL 2059CO 0.10 0.49 -0.25 0.00 0.00 0.00 0.00 175.10 175.43 1w6p s ASN 2061N -1.65 -0.25 0.27 0.00 3.84 -0.93 -0.72 114.94 115.51 1w6p s ASN 2061Ca 0.12 -0.64 0.12 0.00 0.21 0.00 0.00 52.86 52.67 1w6p s ASN 2061Cb -0.10 0.72 -0.05 0.00 -0.55 0.00 0.00 41.25 41.27 1w6p s ASN 2061CO 0.04 -1.33 -0.19 -0.94 -2.79 0.00 0.00 177.10 171.89 1w6p s SER 2062N -2.93 3.63 -0.11 -4.21 1.04 -1.26 -0.28 113.70 109.58 1w6p s SER 2062Ca 0.12 -1.00 -0.01 0.00 0.48 0.00 0.00 55.95 55.54 1w6p s SER 2062Cb -0.06 -0.33 0.03 0.00 0.10 0.00 0.00 66.02 65.77 1w6p s SER 2062CO 0.07 0.04 -0.01 -0.75 0.98 0.00 0.00 173.24 173.58 1w6p s LYS 2063N -3.46 0.83 -0.21 4.02 2.20 -0.17 -1.09 119.74 121.86 1w6p s LYS 2063Ca 0.29 -0.11 0.01 0.00 -0.36 0.00 0.00 55.97 55.81 1w6p s LYS 2063Cb -0.05 -1.38 0.03 0.00 -1.51 0.00 0.00 37.83 34.91 1w6p s LYS 2063CO 0.15 -0.38 -0.15 0.34 -0.36 0.00 0.00 175.35 174.96 1w6p s ASP 2064N 1.88 3.70 -1.45 1.43 3.68 0.22 -0.18 116.67 125.96 1w6p s ASP 2064Ca 0.03 -0.83 -0.11 0.00 2.13 0.00 0.00 52.55 53.77 1w6p s ASP 2064Cb -0.13 -1.54 0.08 0.00 -1.45 0.00 0.00 42.92 39.87 1w6p s ASP 2064CO -0.06 -0.06 0.71 -0.67 0.13 0.00 0.00 175.17 175.21 1w6p n ASP 2065N 4.60 -4.42 0.00 -0.34 2.03 -1.13 -0.66 116.55 116.63 1w6p n ASP 2065Ca -0.19 -0.56 0.00 0.00 0.52 0.00 0.00 54.79 54.56 1w6p n ASP 2065Cb 0.48 -3.58 0.00 0.00 -0.72 0.00 0.00 41.12 37.29 1w6p n ASP 2065CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1w6p n GLY 2066N -1.42 3.19 3.70 0.27 0.00 0.22 -5.04 105.19 106.10 1w6p n GLY 2066Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1w6p n GLY 2066CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w6p s ALA 2067N -2.11 3.38 0.20 4.61 0.00 0.16 -5.01 121.76 122.99 1w6p s ALA 2067Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.80 1w6p s ALA 2067Cb 0.00 -3.11 -0.08 0.00 0.00 0.00 0.00 23.12 19.93 1w6p s ALA 2067CO 0.00 -0.33 1.06 -1.58 0.00 0.00 0.00 175.76 174.90 1w6p s TRP 2068N 1.36 3.68 0.00 0.00 0.52 -1.26 -0.61 118.94 122.63 1w6p s TRP 2068Ca 0.39 1.70 0.00 0.00 0.02 0.00 0.00 56.10 58.21 1w6p s TRP 2068Cb -0.18 -3.20 0.00 0.00 -1.15 0.00 0.00 33.47 28.94 1w6p s TRP 2068CO 0.17 -0.31 0.00 0.41 0.02 0.00 0.00 176.95 177.24 1w6p n GLY 2069N 1.83 0.50 3.68 0.98 0.00 -0.25 -4.96 105.19 106.96 1w6p n GLY 2069Ca 0.01 -1.80 -0.41 0.00 0.00 0.00 0.00 46.02 43.83 1w6p n GLY 2069CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1w6p s THR 2070N 0.92 4.92 0.67 2.61 2.01 -1.26 -4.83 115.64 120.68 1w6p s THR 2070Ca 0.00 1.58 -0.15 0.00 0.31 0.00 0.00 61.69 63.43 1w6p s THR 2070Cb 0.00 -4.11 0.01 0.00 0.01 0.00 0.00 72.50 68.41 1w6p s THR 2070CO 0.00 0.08 1.14 -1.61 -0.69 0.00 0.00 174.62 173.54 1w6p s GLU 2071N 1.83 2.63 -0.04 4.92 2.02 -1.26 -4.75 118.70 124.05 1w6p s GLU 2071Ca 0.38 1.53 0.02 0.00 0.02 0.00 0.00 54.97 56.92 1w6p s GLU 2071Cb -0.17 -1.92 0.01 0.00 0.10 0.00 0.00 34.13 32.16 1w6p s GLU 2071CO 0.14 -1.41 -0.09 -0.65 0.02 0.00 0.00 175.26 173.27 1w6p s GLN 2072N -3.97 1.19 -0.06 1.61 -0.21 0.10 -4.97 119.66 113.34 1w6p s GLN 2072Ca 0.70 -0.30 -0.01 0.00 0.02 0.00 0.00 55.36 55.77 1w6p s GLN 2072Cb -0.24 -1.06 -0.03 0.00 1.00 0.00 0.00 33.01 32.68 1w6p s GLN 2072CO 0.42 0.04 0.02 1.03 -2.12 0.00 0.00 175.29 174.68 1w6p s ARG 2073N 0.52 2.98 0.52 2.91 0.52 -1.26 -0.59 118.95 124.55 1w6p s ARG 2073Ca -0.09 -0.44 -0.03 0.00 -0.52 0.00 0.00 55.73 54.65 1w6p s ARG 2073Cb -0.13 -2.80 0.00 0.00 0.52 0.00 0.00 34.95 32.55 1w6p s ARG 2073CO 0.02 0.68 0.79 -1.21 0.02 0.00 0.00 175.30 175.60 1w6p s GLU 2074N -1.15 3.01 0.12 3.54 0.41 -0.48 -5.01 118.70 119.14 1w6p s GLU 2074Ca 0.16 -0.22 0.26 0.00 -0.41 0.00 0.00 54.97 54.75 1w6p s GLU 2074Cb -0.11 -2.41 0.65 0.00 -1.78 0.00 0.00 34.13 30.48 1w6p s GLU 2074CO 0.06 -0.48 1.58 0.00 -0.49 0.00 0.00 175.26 175.92 1w6p n ALA 2075N -2.34 2.69 -2.46 5.21 0.00 -1.26 -4.60 120.51 117.76 1w6p n ALA 2075Ca 0.03 -0.16 -0.22 0.00 0.00 0.00 0.00 53.44 53.09 1w6p n ALA 2075Cb 0.58 -1.31 -0.10 0.00 0.00 0.00 0.00 19.45 18.61 1w6p n ALA 2075CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1w6p s VAL 2076N -3.10 1.04 -0.46 0.00 -7.23 -1.26 -5.11 120.40 104.28 1w6p s VAL 2076Ca 0.09 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.33 1w6p s VAL 2076Cb 0.14 -2.70 0.22 0.00 0.56 0.00 0.00 36.38 34.60 1w6p s VAL 2076CO 0.65 0.00 0.69 0.33 -0.31 0.00 0.00 175.10 176.46 1w6p n PHE 2077N -0.71 -2.43 -1.39 2.82 -0.00 -1.26 -4.43 117.46 110.04 1w6p n PHE 2077Ca -0.03 -2.30 -0.29 0.00 -0.00 0.00 0.00 57.45 54.83 1w6p n PHE 2077Cb 0.66 0.92 -0.07 0.00 -0.00 0.00 0.00 39.48 40.99 1w6p n PHE 2077CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1w6p n PRO 2078N 2.02 3.11 -4.05 -7.13 -0.04 -1.26 -4.88 135.00 122.77 1w6p n PRO 2078Ca 0.17 -2.13 -0.09 0.00 -0.04 0.00 0.00 63.50 61.41 1w6p n PRO 2078Cb 0.57 -2.39 -0.11 0.00 -0.04 0.00 0.00 33.50 31.53 1w6p n PRO 2078CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1w6p s PHE 2079N 0.34 0.49 -0.13 0.54 0.40 -1.26 -4.67 117.98 113.69 1w6p s PHE 2079Ca 0.64 -0.78 -0.14 0.00 -0.60 0.00 0.00 56.93 56.05 1w6p s PHE 2079Cb 0.26 -0.33 0.04 0.00 0.51 0.00 0.00 43.02 43.50 1w6p s PHE 2079CO -0.08 -0.25 0.38 -0.65 0.70 0.00 0.00 175.22 175.32 1w6p s GLN 2080N -2.70 0.47 0.69 0.44 -0.21 -1.26 -5.11 119.66 111.98 1w6p s GLN 2080Ca -0.03 0.47 -0.16 0.00 0.02 0.00 0.00 55.36 55.66 1w6p s GLN 2080Cb -0.01 0.23 0.01 0.00 1.00 0.00 0.00 33.01 34.24 1w6p s GLN 2080CO -0.05 -0.07 1.22 -2.14 -2.12 0.00 0.00 175.29 172.13 1w6p s PRO 2081N 0.06 2.40 -1.16 2.91 0.02 -1.26 -3.43 135.00 134.55 1w6p s PRO 2081Ca -0.01 1.81 -0.07 0.00 0.02 0.00 0.00 61.00 62.74 1w6p s PRO 2081Cb -0.03 -1.86 0.01 0.00 0.02 0.00 0.00 34.50 32.64 1w6p s PRO 2081CO 0.01 -1.64 0.99 0.41 -0.33 0.00 0.00 177.00 176.44 1w6p n GLY 2082N 0.45 -0.32 3.31 0.52 0.00 0.27 -4.81 105.19 104.61 1w6p n GLY 2082Ca 0.14 0.11 -0.09 0.00 0.00 0.00 0.00 46.02 46.17 1w6p n GLY 2082CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1w6p s SER 2083N -3.25 0.05 -0.07 1.61 1.04 -1.11 -4.88 113.70 107.09 1w6p s SER 2083Ca 0.49 -0.81 -0.20 0.00 0.48 0.00 0.00 55.95 55.91 1w6p s SER 2083Cb -0.22 0.41 -0.04 0.00 0.10 0.00 0.00 66.02 66.27 1w6p s SER 2083CO 0.61 -0.85 0.58 -0.69 0.98 0.00 0.00 173.24 173.86 1w6p s VAL 2084N -3.94 5.07 -0.01 5.02 1.01 -1.26 0.14 120.40 126.42 1w6p s VAL 2084Ca 0.14 1.18 0.03 0.00 0.00 0.00 0.00 61.98 63.33 1w6p s VAL 2084Cb 0.04 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.50 1w6p s VAL 2084CO -0.03 0.33 -0.10 0.00 0.00 0.00 0.00 175.10 175.31 1w6p s ALA 2085N 0.43 0.83 -0.04 5.51 0.00 0.42 -4.96 121.76 123.96 1w6p s ALA 2085Ca 0.31 -0.40 0.05 0.00 0.00 0.00 0.00 51.96 51.92 1w6p s ALA 2085Cb -0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 1w6p s ALA 2085CO 0.15 0.18 -0.21 -2.00 0.00 0.00 0.00 175.76 173.88 1w6p s GLU 2086N -0.11 2.03 0.08 0.00 2.12 -1.26 -1.08 118.70 120.49 1w6p s GLU 2086Ca 0.02 -0.75 0.08 0.00 0.36 0.00 0.00 54.97 54.68 1w6p s GLU 2086Cb -0.05 -1.79 -0.03 0.00 0.26 0.00 0.00 34.13 32.52 1w6p s GLU 2086CO -0.00 0.34 -0.20 0.14 -0.54 0.00 0.00 175.26 175.00 1w6p s VAL 2087N -0.16 1.61 -0.13 3.70 -7.23 -0.14 -3.09 120.40 114.96 1w6p s VAL 2087Ca -0.01 -1.42 0.02 0.00 -1.81 0.00 0.00 61.98 58.76 1w6p s VAL 2087Cb -0.11 -1.46 0.02 0.00 0.56 0.00 0.00 36.38 35.39 1w6p s VAL 2087CO 0.02 -0.02 -0.17 0.00 -0.31 0.00 0.00 175.10 174.62 1w6p s ILE 2089N 1.09 1.89 0.12 0.00 1.09 0.58 -0.08 121.20 125.89 1w6p s ILE 2089Ca -0.03 -1.00 -0.02 0.00 -1.10 0.00 0.00 60.65 58.50 1w6p s ILE 2089Cb -0.14 -1.58 -0.04 0.00 -1.06 0.00 0.00 42.46 39.64 1w6p s ILE 2089CO -0.05 0.53 0.06 0.28 -0.10 0.00 0.00 174.94 175.66 1w6p s THR 2090N -0.40 0.12 0.18 2.92 -1.32 -0.57 -0.37 115.64 116.20 1w6p s THR 2090Ca 0.04 -1.85 -0.18 0.00 -1.21 0.00 0.00 61.69 58.49 1w6p s THR 2090Cb -0.11 -1.94 0.03 0.00 -1.51 0.00 0.00 72.50 68.97 1w6p s THR 2090CO 0.01 -0.54 0.51 0.72 -2.21 0.00 0.00 174.62 173.11 1w6p s PHE 2091N -4.02 -0.18 0.31 9.09 -0.71 -1.26 0.17 117.98 121.38 1w6p s PHE 2091Ca 0.21 -0.15 0.06 0.00 -1.04 0.00 0.00 56.93 56.01 1w6p s PHE 2091Cb 0.07 0.39 -0.03 0.00 -1.21 0.00 0.00 43.02 42.24 1w6p s PHE 2091CO -0.00 -0.87 0.26 0.16 -1.34 0.00 0.00 175.22 173.43 1w6p s ASP 2092N -2.85 1.47 0.58 1.98 3.84 -0.51 -1.53 116.67 119.65 1w6p s ASP 2092Ca 0.07 -1.71 0.28 0.00 -0.00 0.00 0.00 52.55 51.19 1w6p s ASP 2092Cb -0.00 0.53 1.72 0.00 -1.38 0.00 0.00 42.92 43.79 1w6p s ASP 2092CO -0.06 -1.03 2.20 0.06 -0.00 0.00 0.00 175.17 176.34 1w6p h GLN 2093N 2.20 0.00 0.07 2.11 -0.00 -1.96 -3.19 115.11 114.35 1w6p h GLN 2093Ca -0.26 0.00 -0.33 0.00 -0.00 0.00 0.00 58.65 58.06 1w6p h GLN 2093Cb 1.23 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 28.69 1w6p h GLN 2093CO 0.39 0.00 -1.82 0.00 -0.00 0.00 0.00 178.83 177.40 1w6p n ALA 2094N -2.35 0.90 -2.61 0.06 0.00 -1.26 -4.62 120.51 110.62 1w6p n ALA 2094Ca -0.01 -0.61 -0.09 0.00 0.00 0.00 0.00 53.44 52.73 1w6p n ALA 2094Cb 0.16 -0.58 -0.08 0.00 0.00 0.00 0.00 19.45 18.96 1w6p n ALA 2094CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1w6p s ASN 2095N -6.98 0.14 -0.03 0.00 0.01 -1.20 -0.45 114.94 106.42 1w6p s ASN 2095Ca -0.26 -0.59 -0.03 0.00 -0.71 0.00 0.00 52.86 51.27 1w6p s ASN 2095Cb 0.07 0.30 -0.04 0.00 0.41 0.00 0.00 41.25 41.99 1w6p s ASN 2095CO 0.69 -0.65 0.14 -0.76 -1.51 0.00 0.00 177.10 175.01 1w6p s LEU 2096N -2.57 4.20 -0.14 0.60 1.02 0.96 -1.42 118.68 121.33 1w6p s LEU 2096Ca 0.01 0.30 0.01 0.00 0.02 0.00 0.00 54.13 54.48 1w6p s LEU 2096Cb 0.03 -2.37 -0.00 0.00 0.02 0.00 0.00 46.19 43.86 1w6p s LEU 2096CO -0.08 0.30 -0.18 -0.89 0.02 0.00 0.00 176.35 175.51 1w6p s THR 2097N -1.21 2.46 -0.16 5.49 2.01 0.13 -0.86 115.64 123.50 1w6p s THR 2097Ca 0.23 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.38 1w6p s THR 2097Cb -0.12 -2.01 0.00 0.00 0.01 0.00 0.00 72.50 70.38 1w6p s THR 2097CO 0.14 0.53 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.74 1w6p s VAL 2098N 0.66 2.51 -0.16 3.82 1.01 0.51 -1.51 120.40 127.23 1w6p s VAL 2098Ca -0.09 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.02 1w6p s VAL 2098Cb -0.16 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1w6p s VAL 2098CO 0.02 0.52 -0.00 -0.75 0.00 0.00 0.00 175.10 174.89 1w6p s LYS 2099N 0.91 3.69 0.48 2.72 2.20 0.88 -1.26 119.74 129.37 1w6p s LYS 2099Ca -0.04 -0.45 0.06 0.00 -0.36 0.00 0.00 55.97 55.19 1w6p s LYS 2099Cb -0.15 -3.00 0.03 0.00 -1.51 0.00 0.00 37.83 33.20 1w6p s LYS 2099CO -0.02 0.31 0.66 -0.51 -0.36 0.00 0.00 175.35 175.43 1w6p s LEU 2100N 0.21 3.48 0.51 5.43 1.43 0.13 -1.10 118.68 128.77 1w6p s LEU 2100Ca 0.00 -0.35 0.27 0.00 -1.03 0.00 0.00 54.13 53.02 1w6p s LEU 2100Cb -0.13 -2.60 1.37 0.00 0.03 0.00 0.00 46.19 44.86 1w6p s LEU 2100CO 0.02 -0.96 1.93 -0.65 0.23 0.00 0.00 176.35 176.92 1w6p h PRO 2101N 0.40 0.08 -0.18 1.29 0.11 -1.81 0.52 132.00 132.41 1w6p h PRO 2101Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1w6p h PRO 2101Cb 1.28 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1w6p h PRO 2101CO 0.46 0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 177.90 1w6p n ASP 2102N -4.35 0.99 0.00 -2.05 5.75 -1.26 -4.87 116.55 110.76 1w6p n ASP 2102Ca 0.15 -1.96 0.00 0.00 -0.01 0.00 0.00 54.79 52.97 1w6p n ASP 2102Cb 0.77 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.74 1w6p n ASP 2102CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1w6p n GLY 2103N 0.81 2.07 3.75 6.12 0.00 0.18 -5.00 105.19 113.12 1w6p n GLY 2103Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1w6p n GLY 2103CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1w6p s TYR 2104N -3.34 3.55 0.01 1.61 5.04 -1.26 -4.74 117.35 118.21 1w6p s TYR 2104Ca 0.00 1.64 0.03 0.00 -2.44 0.00 0.00 57.07 56.29 1w6p s TYR 2104Cb 0.00 -3.31 -0.01 0.00 0.35 0.00 0.00 41.96 38.99 1w6p s TYR 2104CO 0.00 -0.68 -0.08 -1.83 -1.34 0.00 0.00 175.55 171.62 1w6p s GLU 2105N -1.09 0.63 0.22 4.97 -1.05 -1.26 0.18 118.70 121.30 1w6p s GLU 2105Ca 0.47 -0.38 0.01 0.00 -0.15 0.00 0.00 54.97 54.91 1w6p s GLU 2105Cb -0.32 -0.59 -0.05 0.00 -0.44 0.00 0.00 34.13 32.74 1w6p s GLU 2105CO 0.40 0.15 0.09 -0.59 0.95 0.00 0.00 175.26 176.26 1w6p s PHE 2106N -0.40 1.35 0.12 4.83 -0.71 -0.39 -4.96 117.98 117.82 1w6p s PHE 2106Ca 0.01 -1.21 0.09 0.00 -1.04 0.00 0.00 56.93 54.78 1w6p s PHE 2106Cb -0.04 -0.76 -0.04 0.00 -1.21 0.00 0.00 43.02 40.97 1w6p s PHE 2106CO -0.00 -0.40 -0.18 0.15 -1.34 0.00 0.00 175.22 173.45 1w6p s LYS 2107N -4.05 1.79 -0.05 1.99 1.02 -1.26 -0.37 119.74 118.82 1w6p s LYS 2107Ca 0.35 -1.20 0.02 0.00 0.02 0.00 0.00 55.97 55.16 1w6p s LYS 2107Cb 0.07 -2.10 0.02 0.00 -0.52 0.00 0.00 37.83 35.29 1w6p s LYS 2107CO 0.11 0.47 -0.08 0.12 -0.92 0.00 0.00 175.35 175.05 1w6p s PHE 2108N -1.21 1.05 0.36 3.18 5.36 -0.04 -4.95 117.98 121.72 1w6p s PHE 2108Ca 0.19 -0.34 -0.27 0.00 -0.96 0.00 0.00 56.93 55.55 1w6p s PHE 2108Cb -0.10 -0.82 -0.12 0.00 -0.34 0.00 0.00 43.02 41.64 1w6p s PHE 2108CO 0.10 -0.21 1.21 -2.30 -1.46 0.00 0.00 175.22 172.57 1w6p n PRO 2109N 3.85 1.89 -2.91 10.12 -0.02 -1.26 -0.02 135.00 146.65 1w6p n PRO 2109Ca -0.24 0.67 -0.44 0.00 -2.02 0.00 0.00 63.50 61.47 1w6p n PRO 2109Cb 0.52 -2.24 -0.01 0.00 -0.02 0.00 0.00 33.50 31.75 1w6p n PRO 2109CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1w6p s ASN 2110N -0.44 6.95 0.15 2.55 3.84 0.41 -4.69 114.94 123.71 1w6p s ASN 2110Ca 0.58 -2.73 0.23 0.00 0.21 0.00 0.00 52.86 51.15 1w6p s ASN 2110Cb -0.57 -2.42 0.90 0.00 -0.55 0.00 0.00 41.25 38.61 1w6p s ASN 2110CO 0.61 -0.86 1.70 0.54 -2.79 0.00 0.00 177.10 176.30 1w6p n ARG 2111N 6.11 0.14 0.00 0.43 1.74 -1.26 -2.50 116.66 121.32 1w6p n ARG 2111Ca 0.35 0.27 0.12 0.00 -0.77 0.00 0.00 57.85 57.81 1w6p n ARG 2111Cb 0.44 -1.71 0.09 0.00 -1.02 0.00 0.00 32.46 30.26 1w6p n ARG 2111CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1w6p n LEU 2112N -1.96 2.24 -2.74 0.55 4.32 -1.26 -4.95 117.00 113.21 1w6p n LEU 2112Ca 0.04 -0.79 -0.20 0.00 -0.02 0.00 0.00 56.01 55.04 1w6p n LEU 2112Cb 0.28 -0.01 0.01 0.00 -1.62 0.00 0.00 43.42 42.08 1w6p n LEU 2112CO 0.22 0.40 -0.13 0.59 -1.22 0.00 0.00 177.39 177.25 1w6p n ASN 2113N 0.39 -5.41 -4.75 -1.43 5.03 -1.04 -4.90 115.26 103.15 1w6p n ASN 2113Ca 0.12 -0.12 -0.41 0.00 0.87 0.00 0.00 54.58 55.03 1w6p n ASN 2113Cb 0.50 -4.46 -0.02 0.00 -1.02 0.00 0.00 39.78 34.78 1w6p n ASN 2113CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1w6p s LEU 2114N -6.25 4.36 0.00 3.41 1.02 -1.26 -4.90 118.68 115.06 1w6p s LEU 2114Ca 0.15 2.85 0.17 0.00 0.02 0.00 0.00 54.13 57.32 1w6p s LEU 2114Cb -0.07 -3.63 0.20 0.00 0.02 0.00 0.00 46.19 42.70 1w6p s LEU 2114CO 0.19 -0.82 1.10 -0.62 0.02 0.00 0.00 176.35 176.22 1w6p n GLU 2115N 2.03 1.61 -3.62 1.70 1.02 -1.26 -4.64 120.64 117.48 1w6p n GLU 2115Ca 0.07 -1.66 -0.10 0.00 -0.02 0.00 0.00 57.16 55.45 1w6p n GLU 2115Cb 0.39 -1.34 -0.06 0.00 -0.02 0.00 0.00 31.44 30.40 1w6p n GLU 2115CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w6p s ALA 2116N -1.33 -1.95 -0.27 0.62 0.00 -1.26 -4.31 121.76 113.25 1w6p s ALA 2116Ca 0.23 1.77 -0.04 0.00 0.00 0.00 0.00 51.96 53.92 1w6p s ALA 2116Cb 0.15 -1.17 0.02 0.00 0.00 0.00 0.00 23.12 22.12 1w6p s ALA 2116CO 0.22 -0.26 0.00 0.42 0.00 0.00 0.00 175.76 176.14 1w6p s ILE 2117N -0.22 3.31 -0.52 0.00 1.01 0.03 -4.85 121.20 119.96 1w6p s ILE 2117Ca 0.01 -0.96 0.12 0.00 0.00 0.00 0.00 60.65 59.82 1w6p s ILE 2117Cb -0.03 -2.73 -0.13 0.00 0.01 0.00 0.00 42.46 39.58 1w6p s ILE 2117CO -0.03 0.10 0.49 0.59 0.00 0.00 0.00 174.94 176.09 1w6p n ASN 2118N 4.74 0.68 -4.20 3.58 4.13 -1.00 -0.91 115.26 122.28 1w6p n ASN 2118Ca -0.15 -0.72 -0.28 0.00 1.68 0.00 0.00 54.58 55.11 1w6p n ASN 2118Cb 0.47 1.04 -0.16 0.00 -1.54 0.00 0.00 39.78 39.59 1w6p n ASN 2118CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1w6p s TYR 2119N -2.18 1.91 -0.06 3.10 5.04 0.32 -0.71 117.35 124.77 1w6p s TYR 2119Ca 0.04 -0.48 -0.06 0.00 -2.44 0.00 0.00 57.07 54.13 1w6p s TYR 2119Cb 0.09 -1.26 0.02 0.00 0.35 0.00 0.00 41.96 41.16 1w6p s TYR 2119CO 0.49 -0.12 0.17 1.41 -1.34 0.00 0.00 175.55 176.16 1w6p s MET 2120N -0.21 0.19 -0.17 4.97 -2.45 -0.15 -1.00 119.30 120.49 1w6p s MET 2120Ca 0.01 0.24 -0.12 0.00 -1.25 0.00 0.00 55.69 54.56 1w6p s MET 2120Cb -0.11 0.09 0.05 0.00 1.25 0.00 0.00 34.83 36.11 1w6p s MET 2120CO 0.01 -0.03 0.43 0.00 1.05 0.00 0.00 175.02 176.48 1w6p s ALA 2121N 0.12 -1.08 0.15 4.11 0.00 -0.28 0.19 121.76 124.97 1w6p s ALA 2121Ca -0.00 1.39 0.06 0.00 0.00 0.00 0.00 51.96 53.40 1w6p s ALA 2121Cb -0.01 -0.82 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 1w6p s ALA 2121CO 0.00 -0.24 0.03 0.00 0.00 0.00 0.00 175.76 175.56 1w6p s ALA 2122N 0.78 3.31 0.50 0.00 0.00 -0.17 0.01 121.76 126.20 1w6p s ALA 2122Ca -0.04 -1.26 -0.00 0.00 0.00 0.00 0.00 51.96 50.65 1w6p s ALA 2122Cb -0.05 -1.14 0.03 0.00 0.00 0.00 0.00 23.12 21.96 1w6p s ALA 2122CO -0.06 0.55 0.22 -0.40 0.00 0.00 0.00 175.76 176.07 1w6p n ASP 2123N 0.03 0.27 0.00 0.00 3.85 -0.70 -1.33 116.55 118.67 1w6p n ASP 2123Ca -0.10 -1.23 0.05 0.00 -0.71 0.00 0.00 54.79 52.81 1w6p n ASP 2123Cb 0.54 -0.15 0.28 0.00 -1.35 0.00 0.00 41.12 40.45 1w6p n ASP 2123CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1w6p n GLY 2124N 3.34 -0.59 0.61 6.12 0.00 -1.26 -2.66 105.19 110.75 1w6p n GLY 2124Ca 0.04 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.07 1w6p n GLY 2124CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w6p n ASP 2125N -1.24 2.36 -3.72 1.61 10.43 -1.26 -4.82 116.55 119.91 1w6p n ASP 2125Ca 0.06 -1.66 -0.30 0.00 2.57 0.00 0.00 54.79 55.46 1w6p n ASP 2125Cb 0.08 -0.05 -0.14 0.00 1.84 0.00 0.00 41.12 42.84 1w6p n ASP 2125CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 1w6p s PHE 2126N -1.15 1.83 -0.62 1.24 5.36 -1.09 -0.94 117.98 122.62 1w6p s PHE 2126Ca 0.19 -2.01 -0.26 0.00 -0.96 0.00 0.00 56.93 53.90 1w6p s PHE 2126Cb 0.12 -1.78 0.04 0.00 -0.34 0.00 0.00 43.02 41.06 1w6p s PHE 2126CO 0.18 -0.85 1.09 0.21 -1.46 0.00 0.00 175.22 174.39 1w6p s LYS 2127N 1.15 3.30 0.16 10.12 2.20 -0.44 -4.52 119.74 131.72 1w6p s LYS 2127Ca 0.13 -0.23 -0.31 0.00 -0.36 0.00 0.00 55.97 55.19 1w6p s LYS 2127Cb -0.20 -4.10 -0.10 0.00 -1.51 0.00 0.00 37.83 31.92 1w6p s LYS 2127CO -0.15 -1.75 1.53 0.42 -0.36 0.00 0.00 175.35 175.04 1w6p s ILE 2128N 4.63 2.73 -0.07 5.43 1.01 -1.26 -0.43 121.20 133.24 1w6p s ILE 2128Ca 0.33 0.53 0.09 0.00 0.00 0.00 0.00 60.65 61.60 1w6p s ILE 2128Cb -0.11 -3.34 -0.13 0.00 0.01 0.00 0.00 42.46 38.89 1w6p s ILE 2128CO 0.18 0.04 0.08 0.29 0.00 0.00 0.00 174.94 175.54 1w6p n LYS 2129N 3.85 1.89 -3.69 2.79 4.76 0.13 -4.92 118.16 122.96 1w6p n LYS 2129Ca 0.13 -0.03 -0.14 0.00 -2.87 0.00 0.00 58.31 55.40 1w6p n LYS 2129Cb 0.39 -1.24 -0.09 0.00 -1.84 0.00 0.00 35.03 32.25 1w6p n LYS 2129CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1w6p s VAL 2131N -0.13 0.33 0.07 0.00 1.01 -1.26 -1.08 120.40 119.33 1w6p s VAL 2131Ca -0.03 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.03 1w6p s VAL 2131Cb -0.03 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 1w6p s VAL 2131CO 0.02 0.19 -0.15 0.00 0.00 0.00 0.00 175.10 175.16 1w6p s ALA 2132N 1.16 1.25 -0.26 5.51 0.00 0.13 -4.98 121.76 124.57 1w6p s ALA 2132Ca -0.08 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 50.92 1w6p s ALA 2132Cb -0.14 -0.14 0.07 0.00 0.00 0.00 0.00 23.12 22.91 1w6p s ALA 2132CO -0.02 0.20 -0.04 -0.06 0.00 0.00 0.00 175.76 175.84 1w6p s PHE 2133N -1.14 2.79 0.00 0.00 0.40 -1.26 -1.15 117.98 117.62 1w6p s PHE 2133Ca -0.00 -2.10 0.00 0.00 -0.60 0.00 0.00 56.93 54.23 1w6p s PHE 2133Cb -0.09 -1.88 0.00 0.00 0.51 0.00 0.00 43.02 41.55 1w6p s PHE 2133CO 0.02 -0.84 0.00 -0.40 0.70 0.00 0.00 175.22 174.71