#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e9p n PHE 1834N 0.00 -0.89 -1.96 6.00 0.99 -1.26 -4.95 117.46 115.39 3e9p n PHE 1834Ca 0.00 0.53 -0.42 0.00 -0.00 0.00 0.00 57.45 57.56 3e9p n PHE 1834Cb 0.00 -2.32 -0.03 0.00 -1.00 0.00 0.00 39.48 36.13 3e9p n PHE 1834CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 3e9p s LEU 1835N -0.10 4.37 0.00 4.37 2.96 -1.22 -4.78 118.68 124.28 3e9p s LEU 1835Ca 0.00 2.62 0.00 0.00 -0.22 0.00 0.00 54.13 56.53 3e9p s LEU 1835Cb 0.00 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.09 3e9p s LEU 1835CO 0.00 -0.80 0.00 -0.46 -1.32 0.00 0.00 176.35 173.77 3e9p n ASN 1836N 3.62 0.00 0.25 3.68 0.23 -1.26 -0.57 115.26 121.21 3e9p n ASN 1836Ca 0.12 -0.34 0.14 0.00 -0.53 0.00 0.00 54.58 53.96 3e9p n ASN 1836Cb 0.39 0.00 0.52 0.00 -2.08 0.00 0.00 39.78 38.61 3e9p n ASN 1836CO 0.00 0.00 0.00 -1.28 -0.93 0.00 0.00 177.26 175.05 3e9p h SER 1837N 0.00 0.00 0.41 0.53 0.87 -1.94 -2.21 113.55 111.21 3e9p h SER 1837Ca 0.00 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.51 3e9p h SER 1837Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 3e9p h SER 1837CO 0.00 0.09 -1.64 -1.20 -0.53 0.00 0.00 176.83 173.56 3e9p n SER 1838N -3.20 0.38 -0.03 6.23 7.64 -1.26 -4.44 113.62 118.94 3e9p n SER 1838Ca 0.01 0.15 0.01 0.00 1.01 0.00 0.00 58.87 60.05 3e9p n SER 1838Cb 0.39 1.20 0.02 0.00 -1.01 0.00 0.00 64.21 64.81 3e9p n SER 1838CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3e9p n ASN 1839N -2.51 2.07 0.27 6.43 0.23 -1.17 -4.79 115.26 115.79 3e9p n ASN 1839Ca -0.06 -2.10 0.15 0.00 -0.53 0.00 0.00 54.58 52.04 3e9p n ASN 1839Cb 0.64 -0.05 0.88 0.00 -2.08 0.00 0.00 39.78 39.17 3e9p n ASN 1839CO 0.00 0.00 0.00 0.10 -0.93 0.00 0.00 177.26 176.43 3e9p h TYR 1840N 0.08 0.00 -0.24 -2.53 -0.00 -1.61 -2.49 116.97 110.17 3e9p h TYR 1840Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 58.73 58.76 3e9p h TYR 1840Cb 0.56 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.28 3e9p h TYR 1840CO 0.01 0.00 0.16 0.00 -0.00 0.00 0.00 178.16 178.33 3e9p h ALA 1841N 1.94 2.00 0.00 0.10 0.00 -1.89 -1.80 119.26 119.61 3e9p h ALA 1841Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3e9p h ALA 1841Cb 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3e9p h ALA 1841CO -0.00 -0.04 0.10 1.49 0.00 0.00 0.00 179.25 180.81 3e9p h GLU 1842N 0.18 0.00 0.00 0.00 4.22 -1.85 -1.74 114.58 115.39 3e9p h GLU 1842Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.54 3e9p h GLU 1842Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3e9p h GLU 1842CO -0.02 0.00 0.00 -0.07 -2.18 0.00 0.00 179.01 176.74 3e9p h LEU 1843N 0.00 0.00 -3.08 1.64 3.38 -1.53 -2.30 115.31 113.42 3e9p h LEU 1843Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3e9p h LEU 1843Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3e9p h LEU 1843CO 0.00 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.02 3e9p n PHE 1844N -2.49 0.63 -1.30 1.13 3.72 -0.65 -4.35 117.46 114.15 3e9p n PHE 1844Ca -0.01 -0.71 -0.29 0.00 -0.05 0.00 0.00 57.45 56.39 3e9p n PHE 1844Cb 0.12 -0.17 0.20 0.00 -0.94 0.00 0.00 39.48 38.69 3e9p n PHE 1844CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3e9p s ASN 1845N -1.57 2.13 0.19 4.37 0.01 -0.87 -5.00 114.94 114.20 3e9p s ASN 1845Ca 0.31 0.79 0.23 0.00 -0.71 0.00 0.00 52.86 53.49 3e9p s ASN 1845Cb 0.23 -1.19 0.16 0.00 0.41 0.00 0.00 41.25 40.85 3e9p s ASN 1845CO 0.11 -3.39 1.19 0.78 -1.51 0.00 0.00 177.10 174.28 3e9p h ASN 1846N -2.08 0.00 -3.18 -1.22 4.21 -1.92 -3.45 115.58 107.93 3e9p h ASN 1846Ca -0.49 -0.09 -0.53 0.00 1.21 0.00 0.00 56.30 56.41 3e9p h ASN 1846Cb 1.31 0.00 0.05 0.00 -1.12 0.00 0.00 38.32 38.56 3e9p h ASN 1846CO 0.47 0.04 0.80 -1.81 -1.29 0.00 0.00 177.43 175.64 3e9p s ASP 1847N -4.98 6.64 0.14 5.81 1.01 -1.26 -4.92 116.67 119.11 3e9p s ASP 1847Ca 0.03 2.63 -0.31 0.00 0.71 0.00 0.00 52.55 55.61 3e9p s ASP 1847Cb 0.11 -2.61 -0.09 0.00 1.01 0.00 0.00 42.92 41.34 3e9p s ASP 1847CO 0.75 -0.74 1.42 -0.63 0.21 0.00 0.00 175.17 176.19 3e9p s ILE 1848N 0.42 3.11 0.07 0.77 1.01 -1.26 -4.90 121.20 120.43 3e9p s ILE 1848Ca 0.63 0.81 0.08 0.00 0.00 0.00 0.00 60.65 62.17 3e9p s ILE 1848Cb -0.42 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.50 3e9p s ILE 1848CO 0.39 0.07 -0.21 -0.54 0.00 0.00 0.00 174.94 174.65 3e9p s LYS 1849N 0.90 1.28 -0.05 2.79 1.02 -1.26 -0.35 119.74 124.06 3e9p s LYS 1849Ca 0.65 -1.05 0.01 0.00 0.02 0.00 0.00 55.97 55.60 3e9p s LYS 1849Cb -0.39 -1.47 0.02 0.00 -0.52 0.00 0.00 37.83 35.48 3e9p s LYS 1849CO 0.32 0.36 -0.07 -0.51 -0.92 0.00 0.00 175.35 174.53 3e9p s LEU 1850N -1.52 1.42 0.11 3.17 1.43 -0.90 -4.23 118.68 118.16 3e9p s LEU 1850Ca 0.07 -0.18 -0.28 0.00 -1.03 0.00 0.00 54.13 52.71 3e9p s LEU 1850Cb -0.09 -0.56 -0.06 0.00 0.03 0.00 0.00 46.19 45.50 3e9p s LEU 1850CO 0.03 -0.03 0.88 -0.36 0.23 0.00 0.00 176.35 177.11 3e9p s PHE 1851N 0.85 3.82 -0.21 0.29 0.08 0.10 -0.67 117.98 122.24 3e9p s PHE 1851Ca -0.12 1.70 -0.00 0.00 0.12 0.00 0.00 56.93 58.63 3e9p s PHE 1851Cb -0.15 -2.95 0.02 0.00 -0.57 0.00 0.00 43.02 39.37 3e9p s PHE 1851CO 0.01 0.28 -0.14 0.08 -0.10 0.00 0.00 175.22 175.35 3e9p s VAL 1852N -0.24 2.47 -0.18 -0.44 1.01 -0.03 -1.06 120.40 121.92 3e9p s VAL 1852Ca 0.43 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3e9p s VAL 1852Cb -0.23 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.04 3e9p s VAL 1852CO 0.28 0.40 -0.19 -0.62 0.00 0.00 0.00 175.10 174.97 3e9p s ASP 1853N 1.32 3.15 -0.07 3.32 2.15 0.52 -1.85 116.67 125.21 3e9p s ASP 1853Ca 0.03 -0.67 0.14 0.00 0.43 0.00 0.00 52.55 52.48 3e9p s ASP 1853Cb -0.15 -1.45 0.46 0.00 -0.30 0.00 0.00 42.92 41.49 3e9p s ASP 1853CO -0.09 -0.02 1.38 -0.90 -0.17 0.00 0.00 175.17 175.38 3e9p n ASP 1854N 4.63 3.58 0.28 -0.34 5.75 -1.26 -1.48 116.55 127.71 3e9p n ASP 1854Ca -0.20 -2.37 0.16 0.00 -0.01 0.00 0.00 54.79 52.37 3e9p n ASP 1854Cb 0.50 -0.39 0.79 0.00 -1.03 0.00 0.00 41.12 40.98 3e9p n ASP 1854CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 3e9p h THR 1855N 2.42 0.22 -0.29 2.12 1.35 -1.94 -2.71 112.91 114.09 3e9p h THR 1855Ca 0.00 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 3e9p h THR 1855Cb 1.08 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 3e9p h THR 1855CO 0.11 0.06 0.00 0.59 -0.25 0.00 0.00 175.52 176.03 3e9p n ASN 1856N -3.28 3.63 0.08 5.36 3.02 -1.26 -4.69 115.26 118.13 3e9p n ASN 1856Ca -0.01 -2.73 -0.10 0.00 -0.03 0.00 0.00 54.58 51.71 3e9p n ASN 1856Cb 0.25 -0.46 -0.07 0.00 -0.61 0.00 0.00 39.78 38.90 3e9p n ASN 1856CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3e9p h VAL 1857N 1.88 0.62 -3.25 2.41 2.07 -1.35 -1.38 116.25 117.25 3e9p h VAL 1857Ca 0.00 -0.99 -0.68 0.00 0.82 0.00 0.00 66.70 65.84 3e9p h VAL 1857Cb 1.25 1.04 -0.18 0.00 -1.52 0.00 0.00 31.29 31.88 3e9p h VAL 1857CO 0.16 0.16 0.06 -0.47 0.02 0.00 0.00 177.57 177.51 3e9p s TYR 1858N -3.36 3.04 0.01 1.57 5.04 -1.26 -4.18 117.35 118.21 3e9p s TYR 1858Ca -0.11 -0.52 0.06 0.00 -2.44 0.00 0.00 57.07 54.05 3e9p s TYR 1858Cb 0.01 -3.55 -0.02 0.00 0.35 0.00 0.00 41.96 38.74 3e9p s TYR 1858CO 0.41 -1.04 -0.17 1.03 -1.34 0.00 0.00 175.55 174.43 3e9p s ARG 1859N 2.67 1.29 0.14 4.97 0.52 -1.26 -5.08 118.95 122.19 3e9p s ARG 1859Ca 0.16 -0.73 -0.03 0.00 -0.52 0.00 0.00 55.73 54.61 3e9p s ARG 1859Cb -0.19 -1.30 -0.03 0.00 0.52 0.00 0.00 34.95 33.95 3e9p s ARG 1859CO 0.12 0.34 0.11 0.14 0.02 0.00 0.00 175.30 176.03 3e9p s VAL 1860N -0.60 0.09 0.08 3.52 -7.23 -1.26 -1.25 120.40 113.75 3e9p s VAL 1860Ca 0.06 -1.80 0.06 0.00 -1.81 0.00 0.00 61.98 58.49 3e9p s VAL 1860Cb -0.07 -2.00 -0.03 0.00 0.56 0.00 0.00 36.38 34.83 3e9p s VAL 1860CO 0.00 -0.43 -0.16 0.28 -0.31 0.00 0.00 175.10 174.49 3e9p s THR 1861N -4.03 1.30 -0.05 5.32 -1.32 0.36 -4.83 115.64 112.39 3e9p s THR 1861Ca 0.23 -1.35 -0.23 0.00 -1.21 0.00 0.00 61.69 59.13 3e9p s THR 1861Cb 0.07 -1.21 -0.04 0.00 -1.51 0.00 0.00 72.50 69.80 3e9p s THR 1861CO 0.01 -0.15 0.67 -0.69 -2.21 0.00 0.00 174.62 172.25 3e9p s VAL 1862N -1.20 4.99 0.30 5.08 1.01 -1.26 0.21 120.40 129.53 3e9p s VAL 1862Ca 0.01 1.39 -0.05 0.00 0.00 0.00 0.00 61.98 63.33 3e9p s VAL 1862Cb -0.10 -4.01 -0.00 0.00 0.00 0.00 0.00 36.38 32.27 3e9p s VAL 1862CO 0.03 0.30 0.45 -1.38 0.00 0.00 0.00 175.10 174.50 3e9p s HIS 1863N 0.50 0.86 -0.33 5.22 -3.43 -0.45 -4.96 115.29 112.70 3e9p s HIS 1863Ca 0.36 -1.13 -0.25 0.00 -0.80 0.00 0.00 55.06 53.24 3e9p s HIS 1863Cb -0.18 -0.04 0.01 0.00 -1.43 0.00 0.00 32.58 30.94 3e9p s HIS 1863CO 0.18 -1.05 0.85 0.21 -2.00 0.00 0.00 174.74 172.93 3e9p s LYS 1864N -3.42 3.93 0.76 -0.38 2.20 -1.26 -2.66 119.74 118.90 3e9p s LYS 1864Ca 0.29 0.62 -0.14 0.00 -0.36 0.00 0.00 55.97 56.38 3e9p s LYS 1864Cb 0.00 -3.75 0.06 0.00 -1.51 0.00 0.00 37.83 32.63 3e9p s LYS 1864CO 0.16 -0.78 1.21 0.99 -0.36 0.00 0.00 175.35 176.57 3e9p s THR 1865N 3.16 2.18 -0.63 3.43 2.01 0.10 -4.81 115.64 121.09 3e9p s THR 1865Ca 0.35 0.08 -0.30 0.00 0.31 0.00 0.00 61.69 62.14 3e9p s THR 1865Cb -0.13 -2.60 -0.13 0.00 0.01 0.00 0.00 72.50 69.64 3e9p s THR 1865CO 0.14 -0.05 2.46 0.33 -0.69 0.00 0.00 174.62 176.82 3e9p n PHE 1866N -2.95 1.18 0.00 4.92 -0.00 -1.26 -1.74 117.46 117.61 3e9p n PHE 1866Ca 0.14 0.24 0.00 0.00 -0.00 0.00 0.00 57.45 57.82 3e9p n PHE 1866Cb 0.50 -2.53 0.00 0.00 -0.00 0.00 0.00 39.48 37.45 3e9p n PHE 1866CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 3e9p n GLU 1867N 8.66 0.00 0.00 -4.13 4.07 -1.26 -4.84 120.64 123.14 3e9p n GLU 1867Ca 0.48 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.58 3e9p n GLU 1867Cb 0.30 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.68 3e9p n GLU 1867CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3e9p n GLY 1868N 0.00 0.00 3.74 8.31 0.00 -0.71 -5.10 105.19 111.43 3e9p n GLY 1868Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3e9p n GLY 1868CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3e9p s ASN 1869N 0.00 6.62 0.22 1.61 0.01 -1.26 -4.79 114.94 117.35 3e9p s ASN 1869Ca 0.00 0.74 -0.30 0.00 -0.71 0.00 0.00 52.86 52.59 3e9p s ASN 1869Cb 0.00 -2.25 -0.09 0.00 0.41 0.00 0.00 41.25 39.32 3e9p s ASN 1869CO 0.00 0.07 1.31 -0.69 -1.51 0.00 0.00 177.10 176.28 3e9p s VAL 1870N 0.38 3.13 0.10 1.60 1.01 -1.26 -0.72 120.40 124.65 3e9p s VAL 1870Ca 0.23 0.96 -0.23 0.00 0.00 0.00 0.00 61.98 62.93 3e9p s VAL 1870Cb -0.15 -3.61 0.06 0.00 0.00 0.00 0.00 36.38 32.69 3e9p s VAL 1870CO 0.09 0.15 0.58 0.00 0.00 0.00 0.00 175.10 175.92 3e9p s ALA 1871N -0.05 -1.50 0.29 5.51 0.00 -1.09 -4.92 121.76 120.01 3e9p s ALA 1871Ca 0.56 0.58 -0.21 0.00 0.00 0.00 0.00 51.96 52.89 3e9p s ALA 1871Cb -0.37 0.64 -0.09 0.00 0.00 0.00 0.00 23.12 23.30 3e9p s ALA 1871CO 0.40 -0.65 0.81 0.95 0.00 0.00 0.00 175.76 177.28 3e9p s THR 1872N -3.12 4.47 -0.06 0.00 -4.23 -1.26 -1.34 115.64 110.10 3e9p s THR 1872Ca -0.02 1.40 0.06 0.00 -1.18 0.00 0.00 61.69 61.95 3e9p s THR 1872Cb -0.00 -3.83 -0.01 0.00 1.34 0.00 0.00 72.50 70.00 3e9p s THR 1872CO -0.07 0.06 -0.25 -0.75 -0.54 0.00 0.00 174.62 173.07 3e9p s LYS 1873N -2.31 2.57 0.34 3.99 2.20 0.13 -4.92 119.74 121.74 3e9p s LYS 1873Ca 0.49 -0.90 -0.29 0.00 -0.36 0.00 0.00 55.97 54.91 3e9p s LYS 1873Cb -0.15 -2.17 -0.11 0.00 -1.51 0.00 0.00 37.83 33.89 3e9p s LYS 1873CO 0.20 0.38 1.51 0.00 -0.36 0.00 0.00 175.35 177.08 3e9p s ALA 1874N -0.16 3.62 0.27 3.13 0.00 -1.26 -0.49 121.76 126.88 3e9p s ALA 1874Ca -0.04 1.55 0.10 0.00 0.00 0.00 0.00 51.96 53.58 3e9p s ALA 1874Cb -0.14 -3.61 -0.05 0.00 0.00 0.00 0.00 23.12 19.32 3e9p s ALA 1874CO 0.04 -1.00 -0.16 0.96 0.00 0.00 0.00 175.76 175.59 3e9p s ILE 1875N -0.75 2.22 0.58 0.00 -4.36 -0.38 -4.82 121.20 113.69 3e9p s ILE 1875Ca 0.56 -2.31 -0.20 0.00 -0.26 0.00 0.00 60.65 58.44 3e9p s ILE 1875Cb -0.46 -2.32 -0.04 0.00 1.25 0.00 0.00 42.46 40.89 3e9p s ILE 1875CO 0.57 -0.40 1.22 0.59 0.24 0.00 0.00 174.94 177.16 3e9p n ASN 1876N -0.60 1.94 -0.81 4.36 3.02 -1.26 -4.32 115.26 117.60 3e9p n ASN 1876Ca -0.06 0.89 0.00 0.00 -0.03 0.00 0.00 54.58 55.39 3e9p n ASN 1876Cb 0.61 -1.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.27 3e9p n ASN 1876CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3e9p n GLY 1877N 0.96 5.14 3.50 7.41 0.00 0.45 -4.74 105.19 117.92 3e9p n GLY 1877Ca 0.13 -1.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.17 3e9p n GLY 1877CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e9p s ILE 1879N -1.73 5.29 -0.40 0.00 1.01 0.78 -2.91 121.20 123.24 3e9p s ILE 1879Ca -0.08 0.51 -0.07 0.00 0.00 0.00 0.00 60.65 61.00 3e9p s ILE 1879Cb -0.00 -3.57 0.08 0.00 0.01 0.00 0.00 42.46 38.98 3e9p s ILE 1879CO 0.05 0.54 0.22 0.12 0.00 0.00 0.00 174.94 175.86 3e9p s PHE 1880N -0.59 3.36 -0.23 3.97 5.36 -0.55 -2.44 117.98 126.86 3e9p s PHE 1880Ca 0.18 -1.67 0.02 0.00 -0.96 0.00 0.00 56.93 54.50 3e9p s PHE 1880Cb -0.14 -2.86 0.05 0.00 -0.34 0.00 0.00 43.02 39.73 3e9p s PHE 1880CO 0.07 -0.85 -0.12 0.99 -1.46 0.00 0.00 175.22 173.85 3e9p s THR 1881N 1.37 1.97 -0.08 0.12 2.01 -1.14 -0.35 115.64 119.52 3e9p s THR 1881Ca 0.03 -1.33 0.02 0.00 0.31 0.00 0.00 61.69 60.72 3e9p s THR 1881Cb -0.22 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 70.27 3e9p s THR 1881CO 0.01 0.11 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.69 3e9p s LEU 1882N 1.23 1.70 -0.50 4.42 2.96 -0.23 -0.20 118.68 128.07 3e9p s LEU 1882Ca -0.04 -0.37 -0.26 0.00 -0.22 0.00 0.00 54.13 53.24 3e9p s LEU 1882Cb -0.18 -0.98 0.03 0.00 0.50 0.00 0.00 46.19 45.57 3e9p s LEU 1882CO -0.07 0.04 0.98 0.21 -1.32 0.00 0.00 176.35 176.18 3e9p s ASN 1883N 0.76 6.45 0.45 3.68 3.84 -0.14 0.02 114.94 130.01 3e9p s ASN 1883Ca -0.12 -0.00 0.31 0.00 0.21 0.00 0.00 52.86 53.25 3e9p s ASN 1883Cb -0.16 -2.46 1.37 0.00 -0.55 0.00 0.00 41.25 39.45 3e9p s ASN 1883CO 0.02 -1.17 1.92 1.55 -2.79 0.00 0.00 177.10 176.63 3e9p h PRO 1884N 9.22 0.00 0.03 0.43 0.13 -1.88 -0.88 132.00 139.05 3e9p h PRO 1884Ca -0.25 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.76 3e9p h PRO 1884Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 3e9p h PRO 1884CO 1.07 0.00 -0.62 -0.22 -0.23 0.00 0.00 178.00 178.00 3e9p h LYS 1885N 0.00 0.07 0.00 0.86 3.64 -1.89 -3.40 116.57 115.85 3e9p h LYS 1885Ca 0.00 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3e9p h LYS 1885Cb 0.34 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3e9p h LYS 1885CO 0.00 1.06 -0.92 0.25 -2.27 0.00 0.00 179.45 177.56 3e9p n THR 1886N -4.41 0.11 -0.94 1.00 -2.24 -1.17 -4.68 114.28 101.95 3e9p n THR 1886Ca -0.18 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 3e9p n THR 1886Cb 0.63 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 3e9p n THR 1886CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3e9p n GLY 1887N 1.41 0.89 3.66 3.38 0.00 -0.34 -4.87 105.19 109.31 3e9p n GLY 1887Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 3e9p n GLY 1887CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3e9p s HIS 1888N -3.53 2.60 -0.32 1.61 3.76 -1.21 0.15 115.29 118.36 3e9p s HIS 1888Ca 0.00 0.80 -0.05 0.00 -0.15 0.00 0.00 55.06 55.66 3e9p s HIS 1888Cb 0.00 -3.66 0.04 0.00 1.11 0.00 0.00 32.58 30.07 3e9p s HIS 1888CO 0.00 -2.23 0.06 -1.17 -0.85 0.00 0.00 174.74 170.55 3e9p s LEU 1889N 3.81 4.06 -0.64 0.89 2.96 0.65 -0.97 118.68 129.45 3e9p s LEU 1889Ca 0.60 -1.13 -0.19 0.00 -0.22 0.00 0.00 54.13 53.18 3e9p s LEU 1889Cb -0.24 -1.80 0.10 0.00 0.50 0.00 0.00 46.19 44.75 3e9p s LEU 1889CO 0.19 -0.28 0.78 -0.36 -1.32 0.00 0.00 176.35 175.36 3e9p s PHE 1890N 1.36 2.98 -0.62 5.38 0.08 0.72 -1.56 117.98 126.32 3e9p s PHE 1890Ca -0.02 -0.96 -0.21 0.00 0.12 0.00 0.00 56.93 55.85 3e9p s PHE 1890Cb -0.19 -4.07 0.08 0.00 -0.57 0.00 0.00 43.02 38.27 3e9p s PHE 1890CO 0.01 -1.36 0.83 -1.17 -0.10 0.00 0.00 175.22 173.43 3e9p s LEU 1891N 2.82 4.85 -0.38 -0.37 2.96 -0.17 -2.90 118.68 125.49 3e9p s LEU 1891Ca 0.15 -1.17 -0.23 0.00 -0.22 0.00 0.00 54.13 52.66 3e9p s LEU 1891Cb -0.21 -2.38 0.01 0.00 0.50 0.00 0.00 46.19 44.11 3e9p s LEU 1891CO 0.05 -1.27 0.76 -0.54 -1.32 0.00 0.00 176.35 174.04 3e9p s LYS 1892N 3.38 3.68 -0.13 1.98 1.02 -1.02 -1.47 119.74 127.18 3e9p s LYS 1892Ca 0.17 0.21 -0.27 0.00 0.02 0.00 0.00 55.97 56.10 3e9p s LYS 1892Cb -0.20 -3.83 -0.01 0.00 -0.52 0.00 0.00 37.83 33.26 3e9p s LYS 1892CO 0.09 -0.88 0.90 0.42 -0.92 0.00 0.00 175.35 174.96 3e9p s ILE 1893N 3.08 4.85 -0.56 2.17 1.09 0.12 -0.16 121.20 131.79 3e9p s ILE 1893Ca 0.30 1.81 -0.17 0.00 -1.10 0.00 0.00 60.65 61.49 3e9p s ILE 1893Cb -0.13 -4.21 0.11 0.00 -1.06 0.00 0.00 42.46 37.17 3e9p s ILE 1893CO 0.18 0.03 0.60 -0.63 -0.10 0.00 0.00 174.94 175.02 3e9p s ILE 1894N 1.99 5.01 0.51 2.92 -1.09 -0.28 -3.67 121.20 126.60 3e9p s ILE 1894Ca 0.43 -1.22 -0.19 0.00 -2.23 0.00 0.00 60.65 57.44 3e9p s ILE 1894Cb -0.17 -4.41 -0.07 0.00 -1.58 0.00 0.00 42.46 36.22 3e9p s ILE 1894CO 0.15 -0.99 1.02 -2.28 -1.23 0.00 0.00 174.94 171.61 3e9p s HIS 1895N 2.17 3.10 0.53 3.97 2.46 -1.26 -0.41 115.29 125.84 3e9p s HIS 1895Ca 0.07 1.55 0.18 0.00 0.47 0.00 0.00 55.06 57.34 3e9p s HIS 1895Cb -0.27 -2.99 1.34 0.00 -0.13 0.00 0.00 32.58 30.54 3e9p s HIS 1895CO 0.05 -0.74 2.15 1.79 -2.47 0.00 0.00 174.74 175.51 3e9p h THR 1896N 1.24 0.92 -0.03 0.89 1.35 -1.92 -2.51 112.91 112.84 3e9p h THR 1896Ca -0.48 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.39 3e9p h THR 1896Cb 1.21 0.98 -0.00 0.00 -1.73 0.00 0.00 68.15 68.61 3e9p h THR 1896CO 0.59 0.00 0.03 0.77 -0.25 0.00 0.00 175.52 176.66 3e9p h SER 1897N 0.00 0.00 0.18 5.36 4.64 -1.97 -2.54 113.55 119.22 3e9p h SER 1897Ca 0.02 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 3e9p h SER 1897Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3e9p h SER 1897CO -0.00 0.00 -0.14 -0.37 -0.87 0.00 0.00 176.83 175.45 3e9p h VAL 1898N 0.00 1.00 0.00 0.95 -1.51 -1.84 -2.80 116.25 112.04 3e9p h VAL 1898Ca 0.01 -0.51 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 3e9p h VAL 1898Cb 0.07 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 30.52 3e9p h VAL 1898CO -0.00 0.14 -0.83 0.79 -1.23 0.00 0.00 177.57 176.44 3e9p n TRP 1899N -4.21 0.48 -1.69 5.19 7.02 -0.96 -4.95 117.44 118.32 3e9p n TRP 1899Ca -0.02 0.14 -0.43 0.00 -1.02 0.00 0.00 57.50 56.16 3e9p n TRP 1899Cb 0.22 -0.60 -0.03 0.00 -2.42 0.00 0.00 31.31 28.47 3e9p n TRP 1899CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3e9p n ALA 1900N -1.87 2.08 -3.55 6.99 0.00 -1.06 -2.87 120.51 120.23 3e9p n ALA 1900Ca 0.02 0.35 -0.25 0.00 0.00 0.00 0.00 53.44 53.56 3e9p n ALA 1900Cb 0.45 -2.53 0.04 0.00 0.00 0.00 0.00 19.45 17.41 3e9p n ALA 1900CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3e9p n GLY 1901N 4.06 -1.08 2.94 0.00 0.00 -1.26 -5.02 105.19 104.83 3e9p n GLY 1901Ca 0.18 0.49 -0.13 0.00 0.00 0.00 0.00 46.02 46.57 3e9p n GLY 1901CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3e9p s GLN 1902N -5.32 0.09 0.66 1.61 -1.52 -1.14 -5.17 119.66 108.88 3e9p s GLN 1902Ca 0.40 0.17 0.06 0.00 -1.95 0.00 0.00 55.36 54.04 3e9p s GLN 1902Cb -0.12 -0.02 0.12 0.00 -0.22 0.00 0.00 33.01 32.77 3e9p s GLN 1902CO 0.83 -0.05 0.90 1.63 -0.25 0.00 0.00 175.29 178.35 3e9p n LYS 1903N 3.34 0.30 -4.11 2.91 5.02 -1.26 -4.69 118.16 119.66 3e9p n LYS 1903Ca -0.16 -3.02 -0.42 0.00 -2.02 0.00 0.00 58.31 52.69 3e9p n LYS 1903Cb 0.57 -0.42 -0.01 0.00 -0.02 0.00 0.00 35.03 35.15 3e9p n LYS 1903CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3e9p n ARG 1904N -2.54 -0.57 -0.25 1.97 1.74 -1.26 -4.78 116.66 110.98 3e9p n ARG 1904Ca 0.17 0.11 -0.06 0.00 -0.77 0.00 0.00 57.85 57.29 3e9p n ARG 1904Cb 0.61 -2.93 0.05 0.00 -1.02 0.00 0.00 32.46 29.16 3e9p n ARG 1904CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3e9p h LEU 1905N -2.38 0.89 -0.30 0.55 -0.00 -1.98 -0.08 115.31 112.02 3e9p h LEU 1905Ca -0.70 -0.13 0.03 0.00 -0.00 0.00 0.00 57.88 57.08 3e9p h LEU 1905Cb 1.40 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 41.80 3e9p h LEU 1905CO 0.57 0.77 0.13 0.28 -0.00 0.00 0.00 178.44 180.19 3e9p h SER 1906N 0.95 0.18 -0.39 -0.43 0.02 -2.00 0.06 113.55 111.94 3e9p h SER 1906Ca 0.24 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 61.10 3e9p h SER 1906Cb 0.11 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 3e9p h SER 1906CO -0.03 0.14 -0.17 -0.61 -1.14 0.00 0.00 176.83 175.02 3e9p h GLN 1907N 0.28 0.80 -0.86 3.45 5.75 -1.91 -3.08 115.11 119.55 3e9p h GLN 1907Ca 0.13 -0.34 0.08 0.00 -0.15 0.00 0.00 58.65 58.37 3e9p h GLN 1907Cb 0.07 -0.03 -0.07 0.00 1.07 0.00 0.00 27.48 28.52 3e9p h GLN 1907CO -0.11 0.96 0.51 1.25 -2.65 0.00 0.00 178.83 178.80 3e9p h LEU 1908N 0.60 0.77 -0.35 -2.39 5.85 -0.64 -2.68 115.31 116.47 3e9p h LEU 1908Ca 0.09 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3e9p h LEU 1908Cb 0.71 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 3e9p h LEU 1908CO 0.05 0.46 0.18 0.00 -0.34 0.00 0.00 178.44 178.79 3e9p h ALA 1909N 1.44 0.45 -0.02 1.25 0.00 -0.90 0.19 119.26 121.67 3e9p h ALA 1909Ca 0.40 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 3e9p h ALA 1909Cb 0.29 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3e9p h ALA 1909CO -0.22 -0.01 -0.54 1.57 0.00 0.00 0.00 179.25 180.06 3e9p h LYS 1910N 0.43 0.05 0.07 0.00 2.10 -1.55 -1.48 116.57 116.20 3e9p h LYS 1910Ca 0.12 -0.03 -0.26 0.00 -2.00 0.00 0.00 60.65 58.48 3e9p h LYS 1910Cb 0.09 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.43 3e9p h LYS 1910CO -0.02 0.58 -1.12 -1.49 -2.00 0.00 0.00 179.45 175.40 3e9p h TRP 1911N 0.04 0.72 -0.88 0.07 4.06 -1.14 -0.64 115.95 118.19 3e9p h TRP 1911Ca -0.00 -0.44 -0.02 0.00 2.06 0.00 0.00 58.89 60.48 3e9p h TRP 1911Cb 0.96 -0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 29.02 3e9p h TRP 1911CO 0.00 1.29 0.48 0.87 -3.56 0.00 0.00 178.44 177.53 3e9p h LYS 1912N 0.21 1.23 -0.44 0.49 1.57 -0.61 0.10 116.57 119.12 3e9p h LYS 1912Ca -0.13 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.48 3e9p h LYS 1912Cb 1.79 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 33.84 3e9p h LYS 1912CO 0.20 0.90 0.16 1.15 -0.57 0.00 0.00 179.45 181.29 3e9p h THR 1913N 1.23 1.21 -0.58 -0.16 2.02 -1.17 -0.42 112.91 115.04 3e9p h THR 1913Ca 0.31 -0.66 -0.00 0.00 0.77 0.00 0.00 66.41 66.82 3e9p h THR 1913Cb 0.03 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 3e9p h THR 1913CO -0.05 0.24 0.34 0.00 0.37 0.00 0.00 175.52 176.43 3e9p h ALA 1914N 1.01 0.73 0.28 6.16 0.00 -0.90 -1.50 119.26 125.05 3e9p h ALA 1914Ca 0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3e9p h ALA 1914Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3e9p h ALA 1914CO -0.01 0.22 -0.18 1.49 0.00 0.00 0.00 179.25 180.77 3e9p h GLU 1915N 0.78 -0.43 -0.46 0.00 4.81 -0.61 -1.85 114.58 116.81 3e9p h GLU 1915Ca 0.21 0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.38 3e9p h GLU 1915Cb -0.01 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 3e9p h GLU 1915CO -0.04 -0.29 -0.04 0.93 -0.73 0.00 0.00 179.01 178.84 3e9p h GLU 1916N -0.45 0.78 -0.18 1.92 4.39 -1.04 -2.18 114.58 117.82 3e9p h GLU 1916Ca -0.03 -0.23 -0.12 0.00 0.34 0.00 0.00 59.36 59.32 3e9p h GLU 1916Cb 0.37 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 3e9p h GLU 1916CO 0.02 0.82 -0.37 0.28 -1.16 0.00 0.00 179.01 178.60 3e9p h VAL 1917N 0.72 1.34 -0.41 3.13 2.07 -1.24 -2.26 116.25 119.61 3e9p h VAL 1917Ca 0.13 -1.61 -0.07 0.00 0.82 0.00 0.00 66.70 65.97 3e9p h VAL 1917Cb 0.50 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 3e9p h VAL 1917CO 0.03 0.49 -0.02 0.77 0.02 0.00 0.00 177.57 178.86 3e9p h SER 1918N 0.22 0.63 -0.54 0.57 4.64 -1.34 -1.57 113.55 116.16 3e9p h SER 1918Ca 0.00 -0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.14 3e9p h SER 1918Cb 0.97 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 3e9p h SER 1918CO 0.08 0.72 0.20 0.00 -0.87 0.00 0.00 176.83 176.97 3e9p h ALA 1919N 1.35 0.70 0.28 5.18 0.00 -1.34 -1.07 119.26 124.37 3e9p h ALA 1919Ca 0.12 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3e9p h ALA 1919Cb 0.42 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3e9p h ALA 1919CO 0.02 0.33 -0.25 1.25 0.00 0.00 0.00 179.25 180.59 3e9p h LEU 1920N 0.74 -0.66 -0.33 0.00 5.85 -1.22 -2.23 115.31 117.46 3e9p h LEU 1920Ca 0.18 0.06 0.06 0.00 0.84 0.00 0.00 57.88 59.02 3e9p h LEU 1920Cb 0.22 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 3e9p h LEU 1920CO -0.01 -0.37 -0.06 0.58 -0.34 0.00 0.00 178.44 178.24 3e9p h VAL 1921N -0.55 0.70 -0.65 1.05 2.07 -1.11 -0.47 116.25 117.28 3e9p h VAL 1921Ca -0.01 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.58 3e9p h VAL 1921Cb 0.50 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 3e9p h VAL 1921CO -0.04 0.01 0.43 0.03 0.02 0.00 0.00 177.57 178.02 3e9p h ARG 1922N 0.03 0.55 0.00 1.57 3.08 -1.15 -2.06 114.38 116.40 3e9p h ARG 1922Ca 0.16 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.12 3e9p h ARG 1922Cb 0.23 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 3e9p h ARG 1922CO -0.32 0.36 -0.25 0.66 -1.07 0.00 0.00 179.97 179.36 3e9p h SER 1923N 0.57 0.00 -3.97 7.04 4.64 -0.49 -3.47 113.55 117.87 3e9p h SER 1923Ca 0.29 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 61.12 3e9p h SER 1923Cb 0.40 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.53 3e9p h SER 1923CO -0.09 0.25 0.45 -0.76 -0.87 0.00 0.00 176.83 175.81 3e9p s LEU 1924N -6.44 4.11 0.94 5.97 1.43 -0.58 -5.05 118.68 119.06 3e9p s LEU 1924Ca 0.04 2.19 -0.15 0.00 -1.03 0.00 0.00 54.13 55.18 3e9p s LEU 1924Cb 0.07 -4.16 0.17 0.00 0.03 0.00 0.00 46.19 42.30 3e9p s LEU 1924CO 0.68 -0.66 1.25 -2.16 0.23 0.00 0.00 176.35 175.69 3e9p s PRO 1925N -2.51 0.90 0.39 1.29 0.04 -1.26 -4.63 135.00 129.23 3e9p s PRO 1925Ca 0.59 -0.17 0.11 0.00 0.04 0.00 0.00 61.00 61.58 3e9p s PRO 1925Cb -0.26 -1.85 0.90 0.00 0.04 0.00 0.00 34.50 33.33 3e9p s PRO 1925CO 0.32 -2.28 1.93 -0.22 0.04 0.00 0.00 177.00 176.79 3e9p h LYS 1926N -1.55 0.56 0.00 4.56 3.11 -1.96 0.22 116.57 121.51 3e9p h LYS 1926Ca -0.46 -0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 57.34 3e9p h LYS 1926Cb 1.28 -0.13 -0.00 0.00 -1.00 0.00 0.00 32.23 32.38 3e9p h LYS 1926CO 0.48 0.37 -0.08 0.93 -2.81 0.00 0.00 179.45 178.34 3e9p h GLU 1927N 0.58 0.00 0.00 1.90 3.07 -2.04 -3.31 114.58 114.78 3e9p h GLU 1927Ca 0.36 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.21 3e9p h GLU 1927Cb 0.61 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.52 3e9p h GLU 1927CO -0.13 0.08 -1.05 -1.91 -1.40 0.00 0.00 179.01 174.59 3e9p n GLU 1928N -3.27 2.68 -1.93 2.33 4.07 -0.65 -5.01 120.64 118.86 3e9p n GLU 1928Ca -0.00 -0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.67 3e9p n GLU 1928Cb 0.29 -1.02 -0.03 0.00 -0.06 0.00 0.00 31.44 30.62 3e9p n GLU 1928CO 0.00 0.00 0.00 -1.14 -0.06 0.00 0.00 177.13 175.93 3e9p s GLN 1929N -2.03 4.19 0.57 5.31 0.74 0.68 -4.94 119.66 124.18 3e9p s GLN 1929Ca -0.00 2.32 -0.17 0.00 0.05 0.00 0.00 55.36 57.56 3e9p s GLN 1929Cb 0.00 -3.71 -0.05 0.00 1.10 0.00 0.00 33.01 30.35 3e9p s GLN 1929CO 0.03 -0.77 1.06 -1.25 -0.55 0.00 0.00 175.29 173.81 3e9p s PRO 1930N 3.04 3.40 0.00 1.67 0.04 -1.26 -4.74 135.00 137.15 3e9p s PRO 1930Ca 0.75 1.25 0.22 0.00 0.04 0.00 0.00 61.00 63.26 3e9p s PRO 1930Cb -0.39 -2.04 -0.24 0.00 0.04 0.00 0.00 34.50 31.87 3e9p s PRO 1930CO 0.32 -0.75 0.69 1.63 0.04 0.00 0.00 177.00 178.93 3e9p n LYS 1931N -1.80 0.46 -4.26 4.56 4.76 0.53 -4.86 118.16 117.54 3e9p n LYS 1931Ca 0.09 -0.11 -0.18 0.00 -2.87 0.00 0.00 58.31 55.25 3e9p n LYS 1931Cb 0.53 -1.55 -0.13 0.00 -1.84 0.00 0.00 35.03 32.04 3e9p n LYS 1931CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3e9p s GLN 1932N -3.35 0.74 -0.13 1.97 -0.21 -1.06 -1.28 119.66 116.34 3e9p s GLN 1932Ca -0.02 -0.62 0.00 0.00 0.02 0.00 0.00 55.36 54.74 3e9p s GLN 1932Cb 0.14 -0.69 0.02 0.00 1.00 0.00 0.00 33.01 33.49 3e9p s GLN 1932CO 0.88 0.17 -0.12 0.42 -2.12 0.00 0.00 175.29 174.51 3e9p s ILE 1933N -0.79 1.40 -0.38 1.08 1.01 0.47 -2.11 121.20 121.88 3e9p s ILE 1933Ca -0.01 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 59.96 3e9p s ILE 1933Cb -0.07 -1.33 0.01 0.00 0.01 0.00 0.00 42.46 41.07 3e9p s ILE 1933CO 0.01 0.43 0.29 -0.63 0.00 0.00 0.00 174.94 175.03 3e9p s ILE 1934N 1.47 5.26 -0.06 2.92 1.01 0.15 -0.49 121.20 131.47 3e9p s ILE 1934Ca 0.03 -0.47 -0.25 0.00 0.00 0.00 0.00 60.65 59.96 3e9p s ILE 1934Cb -0.13 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.45 3e9p s ILE 1934CO -0.09 -0.20 0.78 0.68 0.00 0.00 0.00 174.94 176.11 3e9p s VAL 1935N 1.72 4.99 -1.04 2.92 -7.23 0.23 -0.85 120.40 121.13 3e9p s VAL 1935Ca 0.06 1.61 0.18 0.00 -1.81 0.00 0.00 61.98 62.02 3e9p s VAL 1935Cb -0.18 -4.12 0.17 0.00 0.56 0.00 0.00 36.38 32.81 3e9p s VAL 1935CO 0.10 0.21 1.59 0.35 -0.31 0.00 0.00 175.10 177.04 3e9p n THR 1936N 3.90 0.70 -3.77 5.32 -2.24 -0.77 -3.62 114.28 113.80 3e9p n THR 1936Ca 0.01 0.18 -0.17 0.00 -2.27 0.00 0.00 64.05 61.79 3e9p n THR 1936Cb 0.51 -0.86 -0.17 0.00 -2.10 0.00 0.00 70.33 67.71 3e9p n THR 1936CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3e9p s ARG 1937N -2.96 0.06 0.57 -0.78 0.52 -1.26 -4.86 118.95 110.24 3e9p s ARG 1937Ca 0.10 0.22 0.26 0.00 -0.52 0.00 0.00 55.73 55.78 3e9p s ARG 1937Cb 0.12 -0.42 1.66 0.00 0.52 0.00 0.00 34.95 36.83 3e9p s ARG 1937CO 0.33 -0.22 2.22 0.87 0.02 0.00 0.00 175.30 178.52 3e9p h LYS 1938N 7.69 0.00 0.00 3.54 1.57 -1.93 -1.12 116.57 126.33 3e9p h LYS 1938Ca -0.33 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.44 3e9p h LYS 1938Cb 1.12 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 3e9p h LYS 1938CO 0.37 0.00 -0.01 0.00 -0.57 0.00 0.00 179.45 179.25 3e9p h ALA 1939N 2.00 1.05 -0.00 3.86 0.00 -1.98 -2.41 119.26 121.78 3e9p h ALA 1939Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3e9p h ALA 1939Cb 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3e9p h ALA 1939CO 0.00 0.01 -0.04 -1.33 0.00 0.00 0.00 179.25 177.88 3e9p n MET 1940N -3.16 0.10 0.33 0.00 2.81 -0.42 -4.32 117.12 112.45 3e9p n MET 1940Ca -0.02 -0.01 -0.15 0.00 -1.81 0.00 0.00 57.70 55.71 3e9p n MET 1940Cb 0.12 -1.50 -0.08 0.00 -0.71 0.00 0.00 33.22 31.05 3e9p n MET 1940CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3e9p h LEU 1941N 0.02 -0.72 0.09 4.03 5.85 -1.60 -2.51 115.31 120.47 3e9p h LEU 1941Ca 0.00 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.72 3e9p h LEU 1941Cb 0.46 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 3e9p h LEU 1941CO 0.00 -0.36 -0.14 -0.78 -0.34 0.00 0.00 178.44 176.81 3e9p h ASP 1942N -1.12 -0.39 -0.59 1.25 3.58 -1.79 -1.40 116.42 115.96 3e9p h ASP 1942Ca -0.09 0.05 0.09 0.00 0.42 0.00 0.00 57.03 57.50 3e9p h ASP 1942Cb 0.69 0.15 -0.07 0.00 1.72 0.00 0.00 39.33 41.82 3e9p h ASP 1942CO 0.14 -0.21 0.22 -0.65 -2.88 0.00 0.00 179.24 175.86 3e9p h PRO 1943N -0.29 0.39 -0.44 0.28 0.11 -1.78 -1.66 132.00 128.62 3e9p h PRO 1943Ca 0.02 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 3e9p h PRO 1943Cb 0.30 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 3e9p h PRO 1943CO -0.08 0.26 -0.13 1.25 -0.21 0.00 0.00 178.00 179.09 3e9p h LEU 1944N 0.40 0.88 -0.65 2.35 5.85 -1.33 -2.53 115.31 120.28 3e9p h LEU 1944Ca 0.30 -0.37 0.01 0.00 0.84 0.00 0.00 57.88 58.65 3e9p h LEU 1944Cb 0.35 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 3e9p h LEU 1944CO -0.29 1.05 0.43 -0.33 -0.34 0.00 0.00 178.44 178.96 3e9p h GLU 1945N 0.70 0.86 -0.79 1.25 5.08 -0.97 -0.91 114.58 119.81 3e9p h GLU 1945Ca 0.11 -0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 3e9p h GLU 1945Cb 0.68 -0.19 -0.06 0.00 0.50 0.00 0.00 28.75 29.68 3e9p h GLU 1945CO 0.05 0.57 0.48 0.28 -1.00 0.00 0.00 179.01 179.39 3e9p h VAL 1946N 0.89 1.04 0.00 3.13 2.07 -1.15 -2.74 116.25 119.49 3e9p h VAL 1946Ca 0.24 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3e9p h VAL 1946Cb -0.10 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.74 3e9p h VAL 1946CO -0.05 0.16 -0.15 0.45 0.02 0.00 0.00 177.57 178.00 3e9p h HIS 1947N 0.89 0.00 -0.43 1.57 3.86 -1.13 -3.30 115.15 116.62 3e9p h HIS 1947Ca 0.34 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.40 3e9p h HIS 1947Cb 0.14 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 28.52 3e9p h HIS 1947CO -0.04 0.00 0.06 -1.33 0.86 0.00 0.00 177.93 177.48 3e9p n MET 1948N -2.47 2.56 0.07 2.45 2.00 -0.38 -4.67 117.12 116.69 3e9p n MET 1948Ca 0.05 -3.03 0.01 0.00 0.00 0.00 0.00 57.70 54.72 3e9p n MET 1948Cb 0.46 -1.92 0.34 0.00 0.00 0.00 0.00 33.22 32.10 3e9p n MET 1948CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 3e9p h LEU 1949N 1.55 0.34 0.00 4.03 3.38 -1.59 -1.76 115.31 121.25 3e9p h LEU 1949Ca 0.18 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3e9p h LEU 1949Cb 1.78 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.44 3e9p h LEU 1949CO 0.44 0.48 0.00 -0.90 0.09 0.00 0.00 178.44 178.55 3e9p n ASP 1950N -4.26 0.00 -3.73 -0.43 3.85 -1.26 -3.97 116.55 106.75 3e9p n ASP 1950Ca 0.00 0.23 -0.28 0.00 -0.71 0.00 0.00 54.79 54.02 3e9p n ASP 1950Cb 0.27 -0.35 -0.12 0.00 -1.35 0.00 0.00 41.12 39.57 3e9p n ASP 1950CO 0.00 0.00 0.00 -0.36 -1.01 0.00 0.00 177.20 175.83 3e9p s PHE 1951N -2.70 2.49 -0.60 2.11 0.08 -0.66 -4.98 117.98 113.71 3e9p s PHE 1951Ca 0.10 -2.82 0.25 0.00 0.12 0.00 0.00 56.93 54.58 3e9p s PHE 1951Cb 0.08 -2.06 0.49 0.00 -0.57 0.00 0.00 43.02 40.96 3e9p s PHE 1951CO 0.20 -0.70 1.52 -1.00 -0.10 0.00 0.00 175.22 175.14 3e9p h PRO 1952N 5.94 0.00 -0.30 0.24 0.13 -1.75 -3.09 132.00 133.18 3e9p h PRO 1952Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3e9p h PRO 1952Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3e9p h PRO 1952CO 0.56 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.42 3e9p n ASN 1953N -2.40 2.08 -4.52 1.44 4.13 -1.26 -4.75 115.26 109.99 3e9p n ASN 1953Ca 0.04 -1.86 -0.43 0.00 1.68 0.00 0.00 54.58 54.01 3e9p n ASN 1953Cb 0.46 -0.19 -0.06 0.00 -1.54 0.00 0.00 39.78 38.45 3e9p n ASN 1953CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3e9p s ILE 1954N -1.61 4.70 -0.18 2.41 1.01 -1.17 -4.84 121.20 121.52 3e9p s ILE 1954Ca 0.31 0.21 -0.29 0.00 0.00 0.00 0.00 60.65 60.88 3e9p s ILE 1954Cb 0.17 -4.30 -0.01 0.00 0.01 0.00 0.00 42.46 38.32 3e9p s ILE 1954CO 0.24 -0.73 1.21 0.00 0.00 0.00 0.00 174.94 175.66 3e9p s ALA 1955N 3.14 3.67 -0.35 9.38 0.00 -0.40 -4.90 121.76 132.29 3e9p s ALA 1955Ca 0.26 0.39 -0.13 0.00 0.00 0.00 0.00 51.96 52.48 3e9p s ALA 1955Cb -0.13 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.37 3e9p s ALA 1955CO 0.20 -1.15 0.24 0.42 0.00 0.00 0.00 175.76 175.47 3e9p s ILE 1956N 3.44 5.20 -0.03 0.00 -1.09 -1.26 -0.40 121.20 127.06 3e9p s ILE 1956Ca 0.52 -0.34 0.07 0.00 -2.23 0.00 0.00 60.65 58.67 3e9p s ILE 1956Cb -0.20 -3.72 -0.02 0.00 -1.58 0.00 0.00 42.46 36.94 3e9p s ILE 1956CO 0.13 -0.07 -0.24 -0.13 -1.23 0.00 0.00 174.94 173.40 3e9p s ARG 1957N 1.70 2.08 0.90 2.79 0.52 0.36 -4.98 118.95 122.32 3e9p s ARG 1957Ca 0.06 -0.85 -0.14 0.00 -0.52 0.00 0.00 55.73 54.27 3e9p s ARG 1957Cb -0.18 -1.92 0.16 0.00 0.52 0.00 0.00 34.95 33.53 3e9p s ARG 1957CO 0.10 0.46 1.26 -1.25 0.02 0.00 0.00 175.30 175.89 3e9p s PRO 1958N -0.42 1.11 0.07 3.54 0.05 -1.26 -0.60 135.00 137.49 3e9p s PRO 1958Ca 0.05 -0.27 0.03 0.00 0.05 0.00 0.00 61.00 60.86 3e9p s PRO 1958Cb -0.10 -1.90 -0.03 0.00 0.05 0.00 0.00 34.50 32.51 3e9p s PRO 1958CO 0.00 -2.11 -0.08 -0.08 0.05 0.00 0.00 177.00 174.78 3e9p s THR 1959N -3.76 0.69 -1.25 1.26 -1.32 -1.24 -3.39 115.64 106.64 3e9p s THR 1959Ca 0.70 -1.42 0.25 0.00 -1.21 0.00 0.00 61.69 60.01 3e9p s THR 1959Cb -0.06 -1.06 0.09 0.00 -1.51 0.00 0.00 72.50 69.96 3e9p s THR 1959CO 0.51 -0.53 1.45 -0.62 -2.21 0.00 0.00 174.62 173.22 3e9p n GLU 1960N 0.89 0.27 -3.17 7.08 4.71 0.26 -4.92 120.64 125.77 3e9p n GLU 1960Ca -0.19 -0.16 -0.37 0.00 -0.01 0.00 0.00 57.16 56.44 3e9p n GLU 1960Cb 0.57 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.44 3e9p n GLU 1960CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3e9p s LEU 1961N -2.84 4.39 -1.10 -4.62 1.43 -1.25 -3.92 118.68 110.78 3e9p s LEU 1961Ca 0.15 1.34 -0.07 0.00 -1.03 0.00 0.00 54.13 54.53 3e9p s LEU 1961Cb 0.18 -3.40 0.29 0.00 0.03 0.00 0.00 46.19 43.30 3e9p s LEU 1961CO 0.64 0.10 1.31 0.54 0.23 0.00 0.00 176.35 179.17 3e9p n ARG 1962N 0.96 4.02 -2.24 1.70 1.74 0.73 -4.98 116.66 118.59 3e9p n ARG 1962Ca -0.04 -4.50 -0.38 0.00 -0.77 0.00 0.00 57.85 52.16 3e9p n ARG 1962Cb 0.51 -2.54 -0.01 0.00 -1.02 0.00 0.00 32.46 29.40 3e9p n ARG 1962CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3e9p s LEU 1963N -2.03 4.14 -0.01 0.55 1.43 -1.20 -3.99 118.68 117.56 3e9p s LEU 1963Ca 0.31 2.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.80 3e9p s LEU 1963Cb -0.02 -4.07 0.02 0.00 0.03 0.00 0.00 46.19 42.14 3e9p s LEU 1963CO 0.02 -0.79 0.62 -0.81 0.23 0.00 0.00 176.35 175.62 3e9p n PRO 1964N -0.10 1.07 0.00 1.29 -0.04 -1.26 -4.42 135.00 131.54 3e9p n PRO 1964Ca 0.05 -0.07 0.01 0.00 -0.04 0.00 0.00 63.50 63.45 3e9p n PRO 1964Cb 0.46 -1.42 0.04 0.00 -0.04 0.00 0.00 33.50 32.55 3e9p n PRO 1964CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3e9p n PHE 1965N 0.10 0.00 0.15 0.54 3.72 -1.26 -1.33 117.46 119.38 3e9p n PHE 1965Ca 0.01 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 3e9p n PHE 1965Cb 0.32 -0.48 0.22 0.00 -0.94 0.00 0.00 39.48 38.60 3e9p n PHE 1965CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3e9p h SER 1966N 0.00 0.00 0.00 4.37 4.64 -1.96 -3.02 113.55 117.59 3e9p h SER 1966Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3e9p h SER 1966Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3e9p h SER 1966CO 0.00 0.54 0.00 0.00 -0.87 0.00 0.00 176.83 176.50 3e9p n ALA 1967N -2.39 1.89 -0.06 5.18 0.00 -0.45 -3.41 120.51 121.28 3e9p n ALA 1967Ca -0.01 -0.04 -0.00 0.00 0.00 0.00 0.00 53.44 53.38 3e9p n ALA 1967Cb 0.58 -1.11 0.28 0.00 0.00 0.00 0.00 19.45 19.19 3e9p n ALA 1967CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3e9p h ALA 1968N 2.33 1.38 0.00 0.00 0.00 -1.73 -1.40 119.26 119.83 3e9p h ALA 1968Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3e9p h ALA 1968Cb 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3e9p h ALA 1968CO 0.00 0.45 0.00 -1.33 0.00 0.00 0.00 179.25 178.37 3e9p n MET 1969N -4.32 0.54 0.00 0.00 2.81 -1.22 -1.75 117.12 113.18 3e9p n MET 1969Ca 0.03 0.03 0.12 0.00 -1.81 0.00 0.00 57.70 56.07 3e9p n MET 1969Cb 0.19 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.39 3e9p n MET 1969CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3e9p n SER 1970N -1.09 2.44 -4.60 7.83 7.64 -0.53 -4.55 113.62 120.75 3e9p n SER 1970Ca 0.14 -1.76 -0.41 0.00 1.01 0.00 0.00 58.87 57.84 3e9p n SER 1970Cb 0.10 0.08 -0.07 0.00 -1.01 0.00 0.00 64.21 63.31 3e9p n SER 1970CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3e9p s ILE 1971N -2.10 4.95 0.38 0.44 1.01 -0.72 -4.99 121.20 120.18 3e9p s ILE 1971Ca 0.28 0.90 0.07 0.00 0.00 0.00 0.00 60.65 61.90 3e9p s ILE 1971Cb 0.20 -3.98 0.29 0.00 0.01 0.00 0.00 42.46 38.98 3e9p s ILE 1971CO 0.36 -0.10 1.98 0.44 0.00 0.00 0.00 174.94 177.62 3e9p h ASP 1972N 8.13 0.60 0.41 3.58 3.32 -1.86 -0.98 116.42 129.63 3e9p h ASP 1972Ca -0.27 -0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.53 3e9p h ASP 1972Cb 1.12 -0.13 0.01 0.00 0.22 0.00 0.00 39.33 40.54 3e9p h ASP 1972CO 0.79 0.40 -1.06 0.11 -1.72 0.00 0.00 179.24 177.76 3e9p h LYS 1973N 0.69 0.39 0.02 3.56 1.57 -1.94 -2.19 116.57 118.68 3e9p h LYS 1973Ca 0.27 -0.49 -0.00 0.00 -1.87 0.00 0.00 60.65 58.57 3e9p h LYS 1973Cb 0.21 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3e9p h LYS 1973CO -0.08 1.17 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.88 3e9p h LEU 1974N 0.19 -0.02 -0.47 2.94 4.07 -1.75 -2.49 115.31 117.78 3e9p h LEU 1974Ca -0.11 -0.36 0.07 0.00 0.08 0.00 0.00 57.88 57.56 3e9p h LEU 1974Cb 1.73 0.01 -0.06 0.00 1.08 0.00 0.00 40.66 43.42 3e9p h LEU 1974CO 0.18 0.35 0.12 -1.28 -1.08 0.00 0.00 178.44 176.74 3e9p h SER 1975N -0.41 0.06 -0.13 -0.43 0.87 -1.27 -2.29 113.55 109.96 3e9p h SER 1975Ca -0.00 0.07 -0.10 0.00 -1.23 0.00 0.00 61.79 60.53 3e9p h SER 1975Cb 0.39 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 3e9p h SER 1975CO 0.00 0.07 -0.25 0.44 -0.53 0.00 0.00 176.83 176.56 3e9p h ASP 1976N 0.27 0.59 0.41 6.23 3.32 -1.45 -1.07 116.42 124.72 3e9p h ASP 1976Ca 0.23 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 3e9p h ASP 1976Cb 0.28 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3e9p h ASP 1976CO -0.28 0.82 -0.45 -0.37 -1.72 0.00 0.00 179.24 177.25 3e9p h VAL 1977N 0.51 1.32 -0.03 -1.35 -1.51 -1.20 -1.95 116.25 112.04 3e9p h VAL 1977Ca 0.07 -1.55 -0.03 0.00 -1.23 0.00 0.00 66.70 63.97 3e9p h VAL 1977Cb 0.70 1.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.67 3e9p h VAL 1977CO 0.05 0.45 -0.09 0.58 -1.23 0.00 0.00 177.57 177.33 3e9p h VAL 1978N 0.04 1.47 -0.07 7.19 2.07 -1.16 -3.19 116.25 122.59 3e9p h VAL 1978Ca -0.00 -1.51 -0.16 0.00 0.82 0.00 0.00 66.70 65.85 3e9p h VAL 1978Cb 0.80 2.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.97 3e9p h VAL 1978CO 0.06 0.41 -0.64 0.24 0.02 0.00 0.00 177.57 177.66 3e9p h MET 1979N -0.46 0.28 0.00 1.57 2.07 -1.20 -2.99 114.93 114.20 3e9p h MET 1979Ca -0.00 -0.21 0.00 0.00 -2.07 0.00 0.00 59.70 57.42 3e9p h MET 1979Cb 0.71 0.03 0.00 0.00 -1.87 0.00 0.00 31.60 30.47 3e9p h MET 1979CO 0.02 0.83 0.00 1.63 1.07 0.00 0.00 176.91 180.45 3e9p n LYS 1980N -3.86 0.00 -1.70 1.72 5.02 -0.74 -4.89 118.16 113.72 3e9p n LYS 1980Ca -0.03 0.01 -0.44 0.00 -2.02 0.00 0.00 58.31 55.83 3e9p n LYS 1980Cb 0.64 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.12 3e9p n LYS 1980CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3e9p n ALA 1981N -1.50 2.02 0.58 7.82 0.00 -1.13 -4.91 120.51 123.39 3e9p n ALA 1981Ca 0.07 0.41 0.07 0.00 0.00 0.00 0.00 53.44 53.99 3e9p n ALA 1981Cb 0.33 -2.41 0.03 0.00 0.00 0.00 0.00 19.45 17.40 3e9p n ALA 1981CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3e9p n THR 1982N 3.03 0.00 -3.70 0.00 -2.24 -1.26 -5.00 114.28 105.11 3e9p n THR 1982Ca 0.14 -0.45 -0.08 0.00 -2.27 0.00 0.00 64.05 61.39 3e9p n THR 1982Cb 0.33 1.24 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 3e9p n THR 1982CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3e9p s GLU 1983N -1.35 1.48 0.38 -0.78 -1.05 -1.26 -5.05 118.70 111.07 3e9p s GLU 1983Ca 0.14 -0.74 -0.28 0.00 -0.15 0.00 0.00 54.97 53.94 3e9p s GLU 1983Cb 0.11 0.56 -0.10 0.00 -0.44 0.00 0.00 34.13 34.26 3e9p s GLU 1983CO 0.24 -0.67 1.41 -2.14 0.95 0.00 0.00 175.26 175.05 3e9p s PRO 1984N -3.71 4.09 -0.10 -4.83 0.02 -1.26 -4.74 135.00 124.47 3e9p s PRO 1984Ca 0.08 2.41 -0.32 0.00 0.02 0.00 0.00 61.00 63.19 3e9p s PRO 1984Cb -0.04 -2.92 0.12 0.00 0.02 0.00 0.00 34.50 31.68 3e9p s PRO 1984CO -0.00 -0.49 1.08 1.14 -0.33 0.00 0.00 177.00 178.40 3e9p s GLN 1985N -2.09 0.54 -0.05 5.54 -2.07 -1.24 -5.04 119.66 115.24 3e9p s GLN 1985Ca 0.53 -0.21 0.05 0.00 -1.82 0.00 0.00 55.36 53.92 3e9p s GLN 1985Cb -0.43 0.24 -0.01 0.00 -1.09 0.00 0.00 33.01 31.72 3e9p s GLN 1985CO 0.58 -0.24 -0.22 1.41 -1.32 0.00 0.00 175.29 175.50 3e9p s MET 1986N -2.72 2.33 -0.01 9.60 -2.45 -1.26 0.14 119.30 124.92 3e9p s MET 1986Ca 0.08 -0.81 0.07 0.00 -1.25 0.00 0.00 55.69 53.78 3e9p s MET 1986Cb -0.01 -1.97 -0.02 0.00 1.25 0.00 0.00 34.83 34.08 3e9p s MET 1986CO -0.06 0.33 -0.22 0.08 1.05 0.00 0.00 175.02 176.20 3e9p s VAL 1987N -0.07 2.41 -0.08 10.11 1.01 -0.54 -4.98 120.40 128.26 3e9p s VAL 1987Ca -0.04 -1.06 -0.03 0.00 0.00 0.00 0.00 61.98 60.84 3e9p s VAL 1987Cb -0.13 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3e9p s VAL 1987CO 0.03 0.52 0.07 -0.22 0.00 0.00 0.00 175.10 175.51 3e9p s LEU 1988N -0.83 3.97 0.07 3.92 0.20 -1.26 -1.00 118.68 123.75 3e9p s LEU 1988Ca 0.11 0.27 0.02 0.00 0.69 0.00 0.00 54.13 55.22 3e9p s LEU 1988Cb -0.10 -2.03 -0.03 0.00 -0.43 0.00 0.00 46.19 43.59 3e9p s LEU 1988CO 0.01 0.36 -0.07 -0.36 -0.29 0.00 0.00 176.35 176.00 3e9p s PHE 1989N -1.02 0.77 -0.37 5.38 0.08 -0.60 -4.98 117.98 117.24 3e9p s PHE 1989Ca 0.16 -0.75 -0.13 0.00 0.12 0.00 0.00 56.93 56.34 3e9p s PHE 1989Cb -0.12 -0.46 0.00 0.00 -0.57 0.00 0.00 43.02 41.88 3e9p s PHE 1989CO 0.06 -0.13 0.24 1.21 -0.10 0.00 0.00 175.22 176.50 3e9p s ASN 1990N -2.42 5.95 0.06 1.36 3.84 -1.26 -0.25 114.94 122.22 3e9p s ASN 1990Ca 0.02 -0.70 0.21 0.00 0.21 0.00 0.00 52.86 52.60 3e9p s ASN 1990Cb -0.01 -2.11 0.86 0.00 -0.55 0.00 0.00 41.25 39.44 3e9p s ASN 1990CO -0.03 -0.33 1.66 0.00 -2.79 0.00 0.00 177.10 175.61 3e9p n ILE 1991N 5.09 0.67 -0.30 -5.21 3.06 0.12 -2.06 119.36 120.74 3e9p n ILE 1991Ca -0.12 0.13 0.11 0.00 -2.50 0.00 0.00 62.75 60.37 3e9p n ILE 1991Cb 0.48 -0.86 0.29 0.00 0.54 0.00 0.00 39.64 40.09 3e9p n ILE 1991CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 3e9p n TYR 1992N -1.69 0.87 0.00 9.51 4.01 -1.26 -4.95 117.16 123.65 3e9p n TYR 1992Ca 0.04 -0.48 0.00 0.00 -0.16 0.00 0.00 57.90 57.30 3e9p n TYR 1992Cb 0.25 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 3e9p n TYR 1992CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3e9p n ASP 1993N 1.47 0.00 -1.50 7.72 8.00 -0.87 -0.68 116.55 130.69 3e9p n ASP 1993Ca 0.22 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.80 3e9p n ASP 1993Cb 0.59 0.00 0.34 0.00 -0.02 0.00 0.00 41.12 42.04 3e9p n ASP 1993CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3e9p n ASP 1994N 3.73 4.89 -0.20 -2.24 5.75 -1.26 -4.72 116.55 122.49 3e9p n ASP 1994Ca 0.00 -2.79 0.07 0.00 -0.01 0.00 0.00 54.79 52.06 3e9p n ASP 1994Cb 0.00 -0.60 0.35 0.00 -1.03 0.00 0.00 41.12 39.84 3e9p n ASP 1994CO 0.00 0.00 0.00 -0.50 -0.11 0.00 0.00 177.20 176.59 3e9p h TRP 1995N 3.35 0.79 0.00 2.11 6.55 -1.30 -2.11 115.95 125.34 3e9p h TRP 1995Ca 0.00 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.86 3e9p h TRP 1995Cb 1.65 -0.26 0.00 0.00 -0.86 0.00 0.00 29.16 29.70 3e9p h TRP 1995CO 0.82 0.40 0.00 1.28 -1.05 0.00 0.00 178.44 179.89 3e9p n LEU 1996N -4.49 0.36 0.25 -4.49 4.77 -1.26 -0.08 117.00 112.06 3e9p n LEU 1996Ca 0.11 0.60 0.13 0.00 -0.03 0.00 0.00 56.01 56.83 3e9p n LEU 1996Cb 0.25 -0.57 0.78 0.00 -2.33 0.00 0.00 43.42 41.55 3e9p n LEU 1996CO 0.33 -0.49 1.11 0.44 -1.33 0.00 0.00 177.39 177.45 3e9p h ASP 1997N 0.00 0.00 0.00 -1.43 3.32 -1.76 -3.36 116.42 113.19 3e9p h ASP 1997Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3e9p h ASP 1997Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3e9p h ASP 1997CO 0.00 0.00 -0.80 0.54 -1.72 0.00 0.00 179.24 177.26 3e9p n ARG 1998N -4.13 2.88 -4.40 3.56 1.74 0.89 -5.10 116.66 112.10 3e9p n ARG 1998Ca -0.01 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.86 3e9p n ARG 1998Cb 0.16 -0.90 -0.10 0.00 -1.02 0.00 0.00 32.46 30.60 3e9p n ARG 1998CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 3e9p s ILE 1999N -1.80 1.60 0.78 0.55 -4.36 0.25 -5.15 121.20 113.08 3e9p s ILE 1999Ca 0.00 -2.13 -0.11 0.00 -0.26 0.00 0.00 60.65 58.15 3e9p s ILE 1999Cb 0.00 -2.36 0.06 0.00 1.25 0.00 0.00 42.46 41.41 3e9p s ILE 1999CO 0.00 -0.36 1.09 -0.94 0.24 0.00 0.00 174.94 174.96 3e9p s SER 2000N -3.40 4.57 0.23 4.36 1.04 -1.26 -4.31 113.70 114.92 3e9p s SER 2000Ca 0.28 1.48 -0.07 0.00 0.48 0.00 0.00 55.95 58.12 3e9p s SER 2000Cb 0.03 -2.24 0.33 0.00 0.10 0.00 0.00 66.02 64.24 3e9p s SER 2000CO 0.11 -1.94 1.80 0.28 0.98 0.00 0.00 173.24 174.47 3e9p h SER 2001N -1.07 0.59 -0.14 7.02 0.02 -1.92 -1.03 113.55 117.03 3e9p h SER 2001Ca -0.46 0.04 0.04 0.00 -0.84 0.00 0.00 61.79 60.58 3e9p h SER 2001Cb 1.25 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 3e9p h SER 2001CO 0.57 0.36 -0.16 0.22 -1.14 0.00 0.00 176.83 176.68 3e9p h TYR 2002N 0.72 -0.41 -0.63 3.45 3.20 -1.93 0.24 116.97 121.63 3e9p h TYR 2002Ca 0.35 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.20 3e9p h TYR 2002Cb 0.30 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.74 3e9p h TYR 2002CO -0.08 -0.23 0.21 1.15 -1.64 0.00 0.00 178.16 177.58 3e9p h THR 2003N -0.19 1.24 -0.81 1.81 2.02 -1.86 -2.06 112.91 113.06 3e9p h THR 2003Ca 0.10 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 3e9p h THR 2003Cb 0.34 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 3e9p h THR 2003CO -0.26 0.31 0.44 0.00 0.37 0.00 0.00 175.52 176.39 3e9p h ALA 2004N 1.08 1.26 -0.45 6.16 0.00 -0.84 -1.45 119.26 125.02 3e9p h ALA 2004Ca 0.20 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3e9p h ALA 2004Cb 0.27 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3e9p h ALA 2004CO -0.01 0.60 -0.24 0.35 0.00 0.00 0.00 179.25 179.95 3e9p h PHE 2005N 1.13 1.08 -0.60 0.00 3.57 -0.58 -0.99 116.94 120.54 3e9p h PHE 2005Ca 0.29 -0.27 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3e9p h PHE 2005Cb 0.02 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 3e9p h PHE 2005CO 0.01 1.07 0.24 0.77 -2.23 0.00 0.00 178.31 178.17 3e9p h SER 2006N 0.81 0.82 -0.24 0.41 0.02 -1.03 0.15 113.55 114.50 3e9p h SER 2006Ca 0.10 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 3e9p h SER 2006Cb 0.81 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 3e9p h SER 2006CO 0.07 0.77 0.09 -0.09 -1.14 0.00 0.00 176.83 176.53 3e9p h ARG 2007N 0.83 0.36 0.56 3.45 2.43 -1.19 -1.58 114.38 119.24 3e9p h ARG 2007Ca 0.20 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 3e9p h ARG 2007Cb 0.20 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3e9p h ARG 2007CO -0.02 0.41 -0.28 1.25 -1.51 0.00 0.00 179.97 179.83 3e9p h LEU 2008N 0.23 -0.66 -1.75 3.80 5.85 -0.95 -1.49 115.31 120.35 3e9p h LEU 2008Ca 0.08 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 3e9p h LEU 2008Cb 0.19 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 3e9p h LEU 2008CO -0.01 -0.46 -0.14 0.71 -0.34 0.00 0.00 178.44 178.20 3e9p h THR 2009N -0.76 1.05 -0.36 1.05 1.35 -0.98 0.87 112.91 115.13 3e9p h THR 2009Ca -0.08 -0.48 -0.12 0.00 -0.55 0.00 0.00 66.41 65.19 3e9p h THR 2009Cb 0.59 1.26 -0.01 0.00 -1.73 0.00 0.00 68.15 68.26 3e9p h THR 2009CO 0.12 0.14 -0.23 0.25 -0.25 0.00 0.00 175.52 175.55 3e9p h LEU 2010N 0.00 0.82 -0.26 3.87 5.85 -1.16 0.63 115.31 125.06 3e9p h LEU 2010Ca -0.00 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.27 3e9p h LEU 2010Cb 0.25 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3e9p h LEU 2010CO 0.02 1.07 0.07 -0.07 -0.34 0.00 0.00 178.44 179.18 3e9p h LEU 2011N 0.57 0.39 -0.84 2.25 3.38 -0.16 -1.95 115.31 118.95 3e9p h LEU 2011Ca 0.07 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 3e9p h LEU 2011Cb 0.79 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3e9p h LEU 2011CO 0.06 0.51 -0.31 -0.07 0.09 0.00 0.00 178.44 178.73 3e9p h LEU 2012N 0.24 0.52 -0.57 1.67 3.38 -0.88 -1.07 115.31 118.60 3e9p h LEU 2012Ca 0.08 -0.20 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 3e9p h LEU 2012Cb 0.27 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3e9p h LEU 2012CO 0.00 0.80 -0.13 -0.09 0.09 0.00 0.00 178.44 179.11 3e9p h ARG 2013N 0.43 1.00 -0.26 1.13 9.65 -0.84 -1.56 114.38 123.94 3e9p h ARG 2013Ca 0.05 -0.38 -0.02 0.00 -1.10 0.00 0.00 59.98 58.53 3e9p h ARG 2013Cb 0.76 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.27 3e9p h ARG 2013CO 0.06 1.06 0.08 0.00 2.80 0.00 0.00 179.97 183.97 3e9p h ALA 2014N 0.95 0.35 -0.46 2.80 0.00 -1.19 -0.00 119.26 121.70 3e9p h ALA 2014Ca 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3e9p h ALA 2014Cb 0.70 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3e9p h ALA 2014CO 0.05 -0.02 0.23 -0.07 0.00 0.00 0.00 179.25 179.44 3e9p h LEU 2015N 0.26 0.57 -0.17 0.00 3.38 -1.18 0.10 115.31 118.27 3e9p h LEU 2015Ca 0.08 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 3e9p h LEU 2015Cb 0.24 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3e9p h LEU 2015CO -0.00 0.48 -0.14 0.50 0.09 0.00 0.00 178.44 179.36 3e9p h LYS 2016N 0.64 0.39 -0.45 1.13 3.64 -1.13 -2.47 116.57 118.32 3e9p h LYS 2016Ca 0.16 -0.20 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 3e9p h LYS 2016Cb 0.06 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3e9p h LYS 2016CO -0.02 0.75 -0.26 1.15 -2.27 0.00 0.00 179.45 178.79 3e9p h THR 2017N 0.04 1.27 -0.89 1.00 2.02 -0.55 -3.42 112.91 112.38 3e9p h THR 2017Ca 0.03 -1.43 -0.07 0.00 0.77 0.00 0.00 66.41 65.71 3e9p h THR 2017Cb 0.67 1.21 -0.18 0.00 -1.74 0.00 0.00 68.15 68.11 3e9p h THR 2017CO 0.04 0.49 -0.42 0.21 0.37 0.00 0.00 175.52 176.21 3e9p s ASN 2018N -6.74 -1.34 0.23 4.18 3.84 0.31 -5.04 114.94 110.39 3e9p s ASN 2018Ca -0.11 -1.03 -0.06 0.00 0.21 0.00 0.00 52.86 51.87 3e9p s ASN 2018Cb 0.12 1.73 0.38 0.00 -0.55 0.00 0.00 41.25 42.93 3e9p s ASN 2018CO 0.87 -0.11 1.78 -0.08 -2.79 0.00 0.00 177.10 176.77 3e9p h GLU 2019N 6.04 0.61 -0.05 0.43 4.81 -1.57 -1.19 114.58 123.65 3e9p h GLU 2019Ca 0.04 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3e9p h GLU 2019Cb 1.16 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 3e9p h GLU 2019CO 0.04 0.40 0.01 1.49 -0.73 0.00 0.00 179.01 180.22 3e9p h GLU 2020N 0.63 0.08 -0.39 1.92 4.81 -1.92 -1.11 114.58 118.59 3e9p h GLU 2020Ca 0.38 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.51 3e9p h GLU 2020Cb 0.42 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 3e9p h GLU 2020CO -0.29 0.32 -0.04 0.77 -0.73 0.00 0.00 179.01 179.04 3e9p h SER 2021N -0.17 0.62 -0.17 1.04 0.02 -1.91 -2.63 113.55 110.35 3e9p h SER 2021Ca 0.02 -0.15 -0.15 0.00 -0.84 0.00 0.00 61.79 60.67 3e9p h SER 2021Cb 0.28 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 3e9p h SER 2021CO 0.00 0.72 -0.43 0.00 -1.14 0.00 0.00 176.83 175.98 3e9p h ALA 2022N 1.35 0.70 0.00 3.77 0.00 -1.12 -2.47 119.26 121.50 3e9p h ALA 2022Ca 0.12 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 3e9p h ALA 2022Cb 0.45 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3e9p h ALA 2022CO 0.02 0.67 -0.26 0.87 0.00 0.00 0.00 179.25 180.55 3e9p h LYS 2023N 0.58 0.00 0.08 0.00 1.57 -1.12 -2.78 116.57 114.90 3e9p h LYS 2023Ca 0.04 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.56 3e9p h LYS 2023Cb 0.98 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.30 3e9p h LYS 2023CO 0.09 0.26 -1.13 0.52 -0.57 0.00 0.00 179.45 178.62 3e9p h MET 2024N 0.00 0.35 -0.93 3.15 2.86 -1.33 -2.12 114.93 116.91 3e9p h MET 2024Ca -0.00 -0.49 0.03 0.00 -2.06 0.00 0.00 59.70 57.17 3e9p h MET 2024Cb 0.82 0.17 -0.05 0.00 0.06 0.00 0.00 31.60 32.60 3e9p h MET 2024CO 0.03 1.19 0.61 0.82 1.06 0.00 0.00 176.91 180.63 3e9p h ILE 2025N 0.15 1.19 0.00 -1.22 2.04 -1.39 -1.32 117.51 116.95 3e9p h ILE 2025Ca -0.12 -0.41 -0.09 0.00 1.00 0.00 0.00 64.86 65.24 3e9p h ILE 2025Cb 1.82 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3e9p h ILE 2025CO 0.19 0.22 -0.42 -0.07 0.00 0.00 0.00 178.15 178.07 3e9p h LEU 2026N 1.20 0.00 -3.06 1.44 3.38 -1.39 -2.81 115.31 114.06 3e9p h LEU 2026Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3e9p h LEU 2026Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3e9p h LEU 2026CO -0.10 0.42 0.00 0.18 0.09 0.00 0.00 178.44 179.03 3e9p n LEU 2027N -3.60 4.75 -0.40 1.67 4.77 -0.81 -4.59 117.00 118.80 3e9p n LEU 2027Ca -0.00 -2.40 0.00 0.00 -0.03 0.00 0.00 56.01 53.58 3e9p n LEU 2027Cb 0.53 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 3e9p n LEU 2027CO 0.38 0.75 0.15 -1.20 -1.33 0.00 0.00 177.39 176.15 3e9p n SER 2028N 1.02 0.41 -3.15 -1.43 7.64 -0.53 -4.16 113.62 113.42 3e9p n SER 2028Ca 0.25 -1.03 0.05 0.00 1.01 0.00 0.00 58.87 59.15 3e9p n SER 2028Cb 0.91 -0.21 -0.00 0.00 -1.01 0.00 0.00 64.21 63.90 3e9p n SER 2028CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3e9p s ASP 2029N -0.68 -0.88 0.45 6.43 -1.08 -1.26 -5.05 116.67 114.60 3e9p s ASP 2029Ca 0.00 0.21 0.20 0.00 -0.52 0.00 0.00 52.55 52.44 3e9p s ASP 2029Cb 0.00 1.60 1.08 0.00 -1.46 0.00 0.00 42.92 44.14 3e9p s ASP 2029CO 0.00 -0.16 1.96 1.55 0.52 0.00 0.00 175.17 179.04 3e9p h PRO 2030N 7.68 0.00 0.00 4.34 0.13 -1.95 -2.91 132.00 139.30 3e9p h PRO 2030Ca -0.09 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.00 3e9p h PRO 2030Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 3e9p h PRO 2030CO 0.01 0.22 -0.21 1.15 -0.23 0.00 0.00 178.00 178.94 3e9p h THR 2031N 0.00 0.80 -3.42 1.56 2.02 -1.96 -3.42 112.91 108.49 3e9p h THR 2031Ca -0.00 -0.85 -0.53 0.00 0.77 0.00 0.00 66.41 65.81 3e9p h THR 2031Cb 0.47 1.51 -0.00 0.00 -1.74 0.00 0.00 68.15 68.39 3e9p h THR 2031CO 0.03 0.21 0.47 -0.63 0.37 0.00 0.00 175.52 175.97 3e9p s ILE 2032N -4.13 4.16 0.29 3.11 -1.09 -1.10 -5.05 121.20 117.39 3e9p s ILE 2032Ca -0.02 1.69 0.08 0.00 -2.23 0.00 0.00 60.65 60.16 3e9p s ILE 2032Cb 0.13 -4.08 -0.03 0.00 -1.58 0.00 0.00 42.46 36.90 3e9p s ILE 2032CO 0.64 0.21 0.19 0.42 -1.23 0.00 0.00 174.94 175.17 3e9p s THR 2033N 0.42 3.79 -0.13 2.92 -4.23 -1.26 -4.90 115.64 112.25 3e9p s THR 2033Ca 0.53 -1.51 -0.03 0.00 -1.18 0.00 0.00 61.69 59.49 3e9p s THR 2033Cb -0.27 -3.19 -0.03 0.00 1.34 0.00 0.00 72.50 70.35 3e9p s THR 2033CO 0.31 -0.27 -0.01 -0.63 -0.54 0.00 0.00 174.62 173.48 3e9p s ILE 2034N -2.26 4.17 0.69 2.99 1.01 -1.26 0.46 121.20 127.00 3e9p s ILE 2034Ca 0.36 -0.28 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 3e9p s ILE 2034Cb -0.06 -2.80 0.02 0.00 0.01 0.00 0.00 42.46 39.62 3e9p s ILE 2034CO 0.24 0.54 1.14 -0.54 0.00 0.00 0.00 174.94 176.33 3e9p s LYS 2035N -0.20 2.54 0.28 2.79 -0.14 -1.26 -4.93 119.74 118.81 3e9p s LYS 2035Ca 0.05 1.52 0.00 0.00 -1.36 0.00 0.00 55.97 56.18 3e9p s LYS 2035Cb -0.13 -1.91 0.51 0.00 -1.68 0.00 0.00 37.83 34.63 3e9p s LYS 2035CO 0.02 -1.48 1.85 0.66 -0.76 0.00 0.00 175.35 175.64 3e9p h SER 2036N -0.11 0.96 -0.48 2.83 4.64 -1.99 -1.66 113.55 117.74 3e9p h SER 2036Ca -0.47 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3e9p h SER 2036Cb 1.26 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3e9p h SER 2036CO 0.52 0.54 0.00 0.00 -0.87 0.00 0.00 176.83 177.02 3e9p n TYR 2037N -4.59 1.48 -4.17 4.77 4.11 -1.26 -4.96 117.16 112.55 3e9p n TYR 2037Ca 0.18 -0.73 -0.33 0.00 -0.00 0.00 0.00 57.90 57.01 3e9p n TYR 2037Cb 0.31 -0.36 -0.08 0.00 -0.00 0.00 0.00 39.34 39.21 3e9p n TYR 2037CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.86 175.85 3e9p s HIS 2038N -2.46 3.23 -0.14 -3.48 3.76 -0.63 -4.82 115.29 110.75 3e9p s HIS 2038Ca 0.48 0.18 0.16 0.00 -0.15 0.00 0.00 55.06 55.73 3e9p s HIS 2038Cb 0.35 -1.73 -0.03 0.00 1.11 0.00 0.00 32.58 32.28 3e9p s HIS 2038CO 0.16 0.53 1.15 -0.07 -0.85 0.00 0.00 174.74 175.65 3e9p h LEU 2039N 4.29 0.00 -8.88 0.89 3.38 -1.85 -3.43 115.31 109.72 3e9p h LEU 2039Ca -0.49 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.00 3e9p h LEU 2039Cb 1.18 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.78 3e9p h LEU 2039CO 0.60 0.51 -0.75 0.26 0.09 0.00 0.00 178.44 179.15 3e9p s TRP 2040N -2.96 1.76 0.73 1.13 0.52 -1.26 -4.95 118.94 113.91 3e9p s TRP 2040Ca 0.01 -0.53 -0.15 0.00 0.02 0.00 0.00 56.10 55.45 3e9p s TRP 2040Cb 0.08 -0.83 0.04 0.00 -1.15 0.00 0.00 33.47 31.61 3e9p s TRP 2040CO 0.78 0.36 1.22 -2.14 0.02 0.00 0.00 176.95 177.19 3e9p s PRO 2041N -3.34 2.11 -1.43 4.98 0.02 -1.26 -4.49 135.00 131.58 3e9p s PRO 2041Ca 0.20 1.81 -0.13 0.00 0.02 0.00 0.00 61.00 62.91 3e9p s PRO 2041Cb -0.03 -1.82 0.06 0.00 0.02 0.00 0.00 34.50 32.73 3e9p s PRO 2041CO 0.07 -1.87 2.21 0.43 -0.33 0.00 0.00 177.00 177.51 3e9p n SER 2042N -2.69 4.49 -4.81 2.53 7.64 0.17 -4.95 113.62 116.01 3e9p n SER 2042Ca 0.14 -2.88 -0.34 0.00 1.01 0.00 0.00 58.87 56.79 3e9p n SER 2042Cb 0.50 -1.61 -0.07 0.00 -1.01 0.00 0.00 64.21 62.02 3e9p n SER 2042CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3e9p s PHE 2043N 2.51 3.45 0.96 1.43 0.08 -1.26 -4.75 117.98 120.39 3e9p s PHE 2043Ca 0.47 1.65 -0.14 0.00 0.12 0.00 0.00 56.93 59.02 3e9p s PHE 2043Cb 0.13 -2.85 0.17 0.00 -0.57 0.00 0.00 43.02 39.90 3e9p s PHE 2043CO -0.07 0.02 1.19 0.95 -0.10 0.00 0.00 175.22 177.20 3e9p s THR 2044N -1.97 1.93 0.20 0.64 -4.23 -1.26 -4.81 115.64 106.14 3e9p s THR 2044Ca 0.57 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.97 3e9p s THR 2044Cb -0.12 -2.80 0.13 0.00 1.34 0.00 0.00 72.50 71.04 3e9p s THR 2044CO 0.17 0.00 1.84 0.44 -0.54 0.00 0.00 174.62 176.53 3e9p h ASP 2045N -1.66 0.84 -0.42 3.99 5.19 -1.99 0.10 116.42 122.46 3e9p h ASP 2045Ca -0.47 -0.06 -0.07 0.00 -0.62 0.00 0.00 57.03 55.81 3e9p h ASP 2045Cb 1.30 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.58 3e9p h ASP 2045CO 0.52 0.66 0.01 -0.33 -3.12 0.00 0.00 179.24 176.97 3e9p h GLU 2046N 0.95 0.74 -0.35 3.56 3.07 -2.01 -2.76 114.58 117.78 3e9p h GLU 2046Ca 0.25 -0.23 -0.07 0.00 -0.50 0.00 0.00 59.36 58.81 3e9p h GLU 2046Cb -0.03 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 3e9p h GLU 2046CO -0.05 0.81 -0.06 1.96 -1.40 0.00 0.00 179.01 180.28 3e9p h GLN 2047N 0.58 0.58 -0.77 2.33 4.20 -1.86 -2.81 115.11 117.35 3e9p h GLN 2047Ca 0.12 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.68 3e9p h GLN 2047Cb 0.47 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 3e9p h GLN 2047CO 0.02 0.65 0.50 -1.49 -0.67 0.00 0.00 178.83 177.84 3e9p h TRP 2048N 0.54 0.97 -0.75 2.96 -0.00 -0.77 -1.15 115.95 117.76 3e9p h TRP 2048Ca 0.11 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 59.00 3e9p h TRP 2048Cb 0.44 -0.33 -0.04 0.00 -0.00 0.00 0.00 29.16 29.24 3e9p h TRP 2048CO 0.02 0.62 0.41 0.82 -0.00 0.00 0.00 178.44 180.31 3e9p h ILE 2049N 1.04 1.22 0.09 1.49 2.04 -1.25 0.19 117.51 122.33 3e9p h ILE 2049Ca 0.28 -0.55 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 3e9p h ILE 2049Cb -0.11 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.18 3e9p h ILE 2049CO -0.06 0.25 -0.04 0.74 0.00 0.00 0.00 178.15 179.03 3e9p h THR 2050N 1.04 1.14 -0.51 -0.27 2.02 -1.27 -1.91 112.91 113.15 3e9p h THR 2050Ca 0.27 -0.90 0.06 0.00 0.77 0.00 0.00 66.41 66.61 3e9p h THR 2050Cb 0.02 1.71 -0.05 0.00 -1.74 0.00 0.00 68.15 68.08 3e9p h THR 2050CO -0.04 0.22 0.21 0.40 0.37 0.00 0.00 175.52 176.67 3e9p h ILE 2051N -0.53 0.87 -0.55 3.11 1.08 -1.07 -1.24 117.51 119.18 3e9p h ILE 2051Ca -0.01 -0.14 0.01 0.00 -0.39 0.00 0.00 64.86 64.33 3e9p h ILE 2051Cb 0.44 0.43 -0.03 0.00 -3.07 0.00 0.00 36.82 34.59 3e9p h ILE 2051CO 0.02 0.07 0.35 -0.33 -0.69 0.00 0.00 178.15 177.58 3e9p h GLU 2052N 0.41 0.69 0.00 2.37 5.08 -0.59 -0.17 114.58 122.36 3e9p h GLU 2052Ca 0.24 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.50 3e9p h GLU 2052Cb 0.22 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3e9p h GLU 2052CO -0.22 0.46 -0.25 0.66 -1.00 0.00 0.00 179.01 178.66 3e9p h SER 2053N 0.71 0.00 -0.02 1.42 4.64 -1.10 -0.95 113.55 118.25 3e9p h SER 2053Ca 0.21 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 3e9p h SER 2053Cb -0.05 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3e9p h SER 2053CO -0.06 0.25 -0.03 1.56 -0.87 0.00 0.00 176.83 177.68 3e9p h GLN 2054N 0.00 0.06 -0.60 4.77 4.20 -0.62 -2.24 115.11 120.69 3e9p h GLN 2054Ca -0.00 -0.03 0.07 0.00 0.06 0.00 0.00 58.65 58.75 3e9p h GLN 2054Cb 0.83 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.55 3e9p h GLN 2054CO 0.03 0.56 0.27 0.52 -0.67 0.00 0.00 178.83 179.54 3e9p h MET 2055N -0.44 0.47 -0.83 1.46 2.86 -0.91 -1.30 114.93 116.25 3e9p h MET 2055Ca 0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 3e9p h MET 2055Cb 0.55 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 32.07 3e9p h MET 2055CO 0.01 0.31 0.41 -0.09 1.06 0.00 0.00 176.91 178.61 3e9p h ARG 2056N 0.49 1.19 -0.11 1.72 2.43 -1.22 -1.10 114.38 117.78 3e9p h ARG 2056Ca 0.29 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3e9p h ARG 2056Cb 0.28 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 3e9p h ARG 2056CO -0.24 0.91 0.07 0.22 -1.51 0.00 0.00 179.97 179.41 3e9p h ASP 2057N 1.18 0.11 -0.01 -3.80 3.58 -0.90 -2.03 116.42 114.55 3e9p h ASP 2057Ca 0.29 -0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.77 3e9p h ASP 2057Cb 0.10 -0.03 -0.04 0.00 1.72 0.00 0.00 39.33 41.08 3e9p h ASP 2057CO -0.04 0.08 -0.24 0.25 -2.88 0.00 0.00 179.24 176.42 3e9p h LEU 2058N 0.14 -0.70 -0.16 2.28 6.46 -0.74 0.28 115.31 122.87 3e9p h LEU 2058Ca 0.04 0.10 0.04 0.00 -0.12 0.00 0.00 57.88 57.94 3e9p h LEU 2058Cb -0.01 0.29 -0.04 0.00 -0.73 0.00 0.00 40.66 40.17 3e9p h LEU 2058CO -0.01 -0.30 -0.08 0.40 -0.62 0.00 0.00 178.44 177.83 3e9p h ILE 2059N -0.37 0.75 -0.16 4.05 2.04 -1.17 -2.34 117.51 120.31 3e9p h ILE 2059Ca 0.06 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.72 3e9p h ILE 2059Cb 0.45 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 3e9p h ILE 2059CO -0.22 0.00 -0.70 -0.07 0.00 0.00 0.00 178.15 177.16 3e9p h LEU 2060N -0.06 0.80 -0.40 1.44 4.07 -1.08 -1.10 115.31 118.99 3e9p h LEU 2060Ca 0.09 -0.50 0.03 0.00 0.08 0.00 0.00 57.88 57.58 3e9p h LEU 2060Cb 0.19 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 41.66 3e9p h LEU 2060CO -0.20 1.28 0.19 0.74 -1.08 0.00 0.00 178.44 179.36 3e9p h THR 2061N 0.49 0.96 0.04 0.22 2.02 -0.37 0.22 112.91 116.49 3e9p h THR 2061Ca -0.03 -0.13 -0.23 0.00 0.77 0.00 0.00 66.41 66.79 3e9p h THR 2061Cb 1.31 0.54 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 3e9p h THR 2061CO 0.14 0.07 -1.01 -0.08 0.37 0.00 0.00 175.52 175.01 3e9p h GLU 2062N 0.38 0.27 -0.68 6.66 4.81 -1.40 -1.23 114.58 123.39 3e9p h GLU 2062Ca 0.17 -0.34 -0.02 0.00 -0.13 0.00 0.00 59.36 59.04 3e9p h GLU 2062Cb 0.09 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 3e9p h GLU 2062CO -0.13 1.08 0.34 -0.92 -0.73 0.00 0.00 179.01 178.65 3e9p h TYR 2063N 0.12 0.95 -0.46 0.92 3.20 -1.06 -0.85 116.97 119.78 3e9p h TYR 2063Ca -0.08 -0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.64 3e9p h TYR 2063Cb 1.68 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.64 3e9p h TYR 2063CO 0.05 0.68 -0.21 0.78 -1.64 0.00 0.00 178.16 177.82 3e9p h GLY 2064N 1.02 1.01 1.46 1.82 0.00 -0.38 -2.51 103.07 105.50 3e9p h GLY 2064Ca 0.24 -0.88 -0.16 0.00 0.00 0.00 0.00 47.33 46.52 3e9p h GLY 2064CO -0.03 0.80 -0.55 -0.09 0.00 0.00 0.00 176.54 176.67 3e9p h ARG 2065N 0.81 0.56 -0.29 4.80 2.43 -0.95 0.59 114.38 122.33 3e9p h ARG 2065Ca 0.11 -0.35 -0.17 0.00 -0.81 0.00 0.00 59.98 58.75 3e9p h ARG 2065Cb 0.77 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.36 3e9p h ARG 2065CO 0.06 0.96 -0.50 -0.22 -1.51 0.00 0.00 179.97 178.77 3e9p h LYS 2066N 0.43 0.80 -0.24 0.20 3.64 -1.16 -3.31 116.57 116.93 3e9p h LYS 2066Ca 0.01 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 3e9p h LYS 2066Cb 1.09 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3e9p h LYS 2066CO 0.10 1.11 0.00 0.66 -2.27 0.00 0.00 179.45 179.05 3e9p n TYR 2067N -4.01 0.32 -2.92 1.91 4.01 -0.95 -5.03 117.16 110.49 3e9p n TYR 2067Ca -0.03 -0.33 -0.21 0.00 -0.16 0.00 0.00 57.90 57.16 3e9p n TYR 2067Cb 0.59 -0.02 0.01 0.00 -0.31 0.00 0.00 39.34 39.62 3e9p n TYR 2067CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 3e9p n ASN 2068N 0.58 -3.23 -4.01 7.72 0.23 0.18 -5.01 115.26 111.71 3e9p n ASN 2068Ca 0.10 -0.34 -0.09 0.00 -0.53 0.00 0.00 54.58 53.72 3e9p n ASN 2068Cb 0.38 -1.00 -0.11 0.00 -2.08 0.00 0.00 39.78 36.98 3e9p n ASN 2068CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3e9p s VAL 2069N -1.69 0.18 -0.36 3.53 0.11 -1.08 -5.05 120.40 116.04 3e9p s VAL 2069Ca 0.13 -1.10 -0.29 0.00 -2.93 0.00 0.00 61.98 57.80 3e9p s VAL 2069Cb -0.01 -0.54 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 3e9p s VAL 2069CO 0.56 -0.58 1.62 0.21 -3.33 0.00 0.00 175.10 173.57 3e9p s ASN 2070N -1.75 6.12 0.09 3.54 3.04 -1.26 -4.68 114.94 120.04 3e9p s ASN 2070Ca -0.11 1.12 0.27 0.00 0.04 0.00 0.00 52.86 54.17 3e9p s ASN 2070Cb -0.07 -2.53 0.85 0.00 -1.54 0.00 0.00 41.25 37.96 3e9p s ASN 2070CO -0.02 -1.56 1.71 2.30 -3.04 0.00 0.00 177.10 176.49 3e9p n ILE 2071N 7.21 0.26 1.87 -5.21 -5.35 -1.26 -3.11 119.36 113.76 3e9p n ILE 2071Ca 0.20 -0.14 0.16 0.00 -0.27 0.00 0.00 62.75 62.69 3e9p n ILE 2071Cb 0.47 -0.37 0.88 0.00 -1.74 0.00 0.00 39.64 38.89 3e9p n ILE 2071CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3e9p n SER 2072N -1.86 0.11 -0.31 7.28 3.41 -1.26 -3.98 113.62 117.01 3e9p n SER 2072Ca 0.06 -0.89 0.09 0.00 -0.26 0.00 0.00 58.87 57.86 3e9p n SER 2072Cb 0.39 -0.04 0.17 0.00 -0.26 0.00 0.00 64.21 64.46 3e9p n SER 2072CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3e9p n ALA 2073N -0.97 2.45 -2.75 7.33 0.00 -1.18 -5.03 120.51 120.36 3e9p n ALA 2073Ca 0.22 -2.40 -0.33 0.00 0.00 0.00 0.00 53.44 50.93 3e9p n ALA 2073Cb 0.15 -0.45 -0.08 0.00 0.00 0.00 0.00 19.45 19.07 3e9p n ALA 2073CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3e9p s LEU 2074N -2.70 3.76 0.71 0.00 1.02 -1.26 -5.10 118.68 115.12 3e9p s LEU 2074Ca 0.33 0.09 -0.11 0.00 0.02 0.00 0.00 54.13 54.46 3e9p s LEU 2074Cb 0.28 -2.17 0.02 0.00 0.02 0.00 0.00 46.19 44.34 3e9p s LEU 2074CO 0.05 0.28 1.07 0.42 0.02 0.00 0.00 176.35 178.19 3e9p s THR 2075N -1.15 3.77 0.46 5.49 -4.23 -1.26 -4.82 115.64 113.91 3e9p s THR 2075Ca 0.21 0.59 0.39 0.00 -1.18 0.00 0.00 61.69 61.71 3e9p s THR 2075Cb -0.12 -3.24 0.41 0.00 1.34 0.00 0.00 72.50 70.90 3e9p s THR 2075CO 0.12 -0.73 2.22 0.06 -0.54 0.00 0.00 174.62 175.75 3e9p h GLN 2076N -0.78 0.00 0.29 3.99 -0.00 -1.99 0.15 115.11 116.78 3e9p h GLN 2076Ca -0.44 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.20 3e9p h GLN 2076Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.70 3e9p h GLN 2076CO 0.55 0.01 -0.14 1.15 -0.00 0.00 0.00 178.83 180.40 3e9p h THR 2077N 0.00 0.74 -0.64 1.86 2.02 -1.98 0.04 112.91 114.95 3e9p h THR 2077Ca -0.00 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.72 3e9p h THR 2077Cb 0.20 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 3e9p h THR 2077CO 0.00 0.09 0.37 -0.33 0.37 0.00 0.00 175.52 176.03 3e9p h GLU 2078N -0.64 0.86 0.01 6.66 5.08 -1.51 -0.64 114.58 124.39 3e9p h GLU 2078Ca -0.04 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3e9p h GLU 2078Cb 0.45 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3e9p h GLU 2078CO 0.07 0.61 -0.00 0.82 -1.00 0.00 0.00 179.01 179.50 3e9p h ILE 2079N 0.87 1.27 -1.01 3.13 2.04 -0.78 -2.79 117.51 120.25 3e9p h ILE 2079Ca 0.23 -0.83 0.06 0.00 1.00 0.00 0.00 64.86 65.31 3e9p h ILE 2079Cb -0.02 1.84 -0.07 0.00 -0.74 0.00 0.00 36.82 37.83 3e9p h ILE 2079CO -0.04 0.22 0.65 0.50 0.00 0.00 0.00 178.15 179.48 3e9p h LYS 2080N -0.37 1.17 -0.97 2.37 1.63 -0.73 -1.63 116.57 118.04 3e9p h LYS 2080Ca -0.00 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 3e9p h LYS 2080Cb 0.36 -0.26 -0.05 0.00 -0.60 0.00 0.00 32.23 31.68 3e9p h LYS 2080CO 0.00 0.77 0.62 -0.44 -3.45 0.00 0.00 179.45 176.95 3e9p h ASP 2081N 1.20 1.14 -0.39 4.20 5.19 -1.15 0.18 116.42 126.79 3e9p h ASP 2081Ca 0.43 -0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.77 3e9p h ASP 2081Cb 0.13 -0.29 -0.02 0.00 0.18 0.00 0.00 39.33 39.34 3e9p h ASP 2081CO -0.16 0.85 0.17 0.40 -3.12 0.00 0.00 179.24 177.37 3e9p h ILE 2082N 1.33 1.19 -0.07 0.35 2.04 -1.10 0.27 117.51 121.51 3e9p h ILE 2082Ca 0.35 -0.56 -0.12 0.00 1.00 0.00 0.00 64.86 65.53 3e9p h ILE 2082Cb -0.11 0.83 0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3e9p h ILE 2082CO -0.07 0.21 -0.41 0.40 0.00 0.00 0.00 178.15 178.27 3e9p h ILE 2083N 0.49 1.40 0.00 -0.67 2.04 -0.83 -3.21 117.51 116.74 3e9p h ILE 2083Ca 0.13 -1.80 -0.03 0.00 1.00 0.00 0.00 64.86 64.16 3e9p h ILE 2083Cb 0.17 2.31 -0.00 0.00 -0.74 0.00 0.00 36.82 38.55 3e9p h ILE 2083CO -0.01 0.53 -0.17 -0.07 0.00 0.00 0.00 178.15 178.43 3e9p h LEU 2084N -0.05 0.00 -0.50 1.44 3.38 -0.75 -3.44 115.31 115.40 3e9p h LEU 2084Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3e9p h LEU 2084Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3e9p h LEU 2084CO 0.09 0.17 0.00 0.61 0.09 0.00 0.00 178.44 179.39 3e9p n GLY 2085N 0.48 0.99 3.61 0.83 0.00 -0.47 -3.27 105.19 107.35 3e9p n GLY 2085Ca 0.01 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.20 3e9p n GLY 2085CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3e9p s GLN 2086N -2.84 3.71 0.00 1.61 2.00 0.82 -0.19 119.66 124.77 3e9p s GLN 2086Ca 0.00 0.94 0.00 0.00 -2.00 0.00 0.00 55.36 54.30 3e9p s GLN 2086Cb 0.00 -3.95 0.00 0.00 0.80 0.00 0.00 33.01 29.86 3e9p s GLN 2086CO 0.00 -1.39 0.01 0.09 -0.50 0.00 0.00 175.29 173.50