#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e66 s PHE 1834N 0.00 3.34 -0.08 6.00 0.40 -1.26 -4.69 117.98 121.68 3e66 s PHE 1834Ca 0.00 1.48 -0.24 0.00 -0.60 0.00 0.00 56.93 57.57 3e66 s PHE 1834Cb 0.00 -2.74 -0.03 0.00 0.51 0.00 0.00 43.02 40.75 3e66 s PHE 1834CO 0.00 -0.04 0.75 -1.17 0.70 0.00 0.00 175.22 175.46 3e66 s LEU 1835N -3.09 4.29 0.32 -0.37 2.96 -1.14 -4.91 118.68 116.74 3e66 s LEU 1835Ca 0.59 1.22 -0.01 0.00 -0.22 0.00 0.00 54.13 55.71 3e66 s LEU 1835Cb -0.10 -3.15 -0.01 0.00 0.50 0.00 0.00 46.19 43.44 3e66 s LEU 1835CO 0.15 -0.18 0.41 0.54 -1.32 0.00 0.00 176.35 175.94 3e66 s ASN 1836N 0.90 0.94 0.00 3.68 2.20 -1.26 -1.20 114.94 120.19 3e66 s ASN 1836Ca 0.39 -1.49 0.06 0.00 -0.94 0.00 0.00 52.86 50.88 3e66 s ASN 1836Cb -0.18 0.62 0.37 0.00 -2.00 0.00 0.00 41.25 40.06 3e66 s ASN 1836CO 0.18 -1.21 0.91 -1.54 -2.94 0.00 0.00 177.10 172.50 3e66 n SER 1837N -1.28 0.00 -0.01 3.54 3.41 -1.26 -1.42 113.62 116.60 3e66 n SER 1837Ca 0.02 -0.09 0.11 0.00 -0.26 0.00 0.00 58.87 58.65 3e66 n SER 1837Cb 0.62 -0.08 -0.16 0.00 -0.26 0.00 0.00 64.21 64.33 3e66 n SER 1837CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3e66 n SER 1838N -1.08 0.13 0.00 4.04 3.41 -1.26 -4.61 113.62 114.25 3e66 n SER 1838Ca 0.04 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 3e66 n SER 1838Cb 0.03 1.89 0.00 0.00 -0.26 0.00 0.00 64.21 65.87 3e66 n SER 1838CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3e66 n ASN 1839N -2.18 0.70 0.01 4.04 0.23 -0.67 -4.83 115.26 112.56 3e66 n ASN 1839Ca -0.03 -1.33 0.04 0.00 -0.53 0.00 0.00 54.58 52.73 3e66 n ASN 1839Cb 0.54 0.00 0.19 0.00 -2.08 0.00 0.00 39.78 38.44 3e66 n ASN 1839CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3e66 n TYR 1840N -0.17 0.03 0.29 -2.53 0.18 -0.51 -2.49 117.16 111.96 3e66 n TYR 1840Ca 0.00 0.01 0.16 0.00 1.88 0.00 0.00 57.90 59.95 3e66 n TYR 1840Cb 0.38 -0.52 0.93 0.00 -0.38 0.00 0.00 39.34 39.75 3e66 n TYR 1840CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3e66 h ALA 1841N 2.28 1.53 0.00 -3.48 0.00 -1.88 0.03 119.26 117.74 3e66 h ALA 1841Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3e66 h ALA 1841Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3e66 h ALA 1841CO 0.00 -0.05 0.00 0.93 0.00 0.00 0.00 179.25 180.13 3e66 h GLU 1842N 0.00 0.00 0.00 0.00 5.08 -1.90 -1.60 114.58 116.16 3e66 h GLU 1842Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3e66 h GLU 1842Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3e66 h GLU 1842CO -0.00 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.29 3e66 n LEU 1843N -2.85 0.48 -0.72 1.33 4.77 -0.01 -2.61 117.00 117.39 3e66 n LEU 1843Ca -0.01 0.69 0.06 0.00 -0.03 0.00 0.00 56.01 56.72 3e66 n LEU 1843Cb 0.14 -0.72 0.17 0.00 -2.33 0.00 0.00 43.42 40.68 3e66 n LEU 1843CO 0.20 -0.78 0.64 0.49 -1.33 0.00 0.00 177.39 176.61 3e66 n PHE 1844N -2.11 0.51 -0.80 -1.77 3.01 -0.60 -4.16 117.46 111.54 3e66 n PHE 1844Ca -0.00 -0.49 0.00 0.00 1.01 0.00 0.00 57.45 57.96 3e66 n PHE 1844Cb 0.07 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.52 3e66 n PHE 1844CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 3e66 n ASN 1845N 0.64 0.00 -0.08 4.37 0.23 -1.07 -4.98 115.26 114.36 3e66 n ASN 1845Ca 0.13 -0.39 0.13 0.00 -0.53 0.00 0.00 54.58 53.93 3e66 n ASN 1845Cb 0.45 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.62 3e66 n ASN 1845CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3e66 n ASN 1846N -1.16 0.48 -4.63 0.53 3.02 -1.26 -4.81 115.26 107.43 3e66 n ASN 1846Ca 0.00 -0.34 -0.43 0.00 -0.03 0.00 0.00 54.58 53.78 3e66 n ASN 1846Cb 0.00 -0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.12 3e66 n ASN 1846CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3e66 s ASP 1847N -2.72 6.61 0.17 6.41 1.01 -1.26 -4.95 116.67 121.95 3e66 s ASP 1847Ca 0.21 1.40 -0.32 0.00 0.71 0.00 0.00 52.55 54.55 3e66 s ASP 1847Cb 0.19 -2.54 -0.11 0.00 1.01 0.00 0.00 42.92 41.47 3e66 s ASP 1847CO 0.55 -1.10 1.76 -0.63 0.21 0.00 0.00 175.17 175.96 3e66 s ILE 1848N 4.54 2.25 0.05 0.77 1.01 -1.26 -4.87 121.20 123.70 3e66 s ILE 1848Ca 0.61 0.05 0.03 0.00 0.00 0.00 0.00 60.65 61.35 3e66 s ILE 1848Cb -0.20 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 3e66 s ILE 1848CO 0.24 0.00 -0.10 -0.54 0.00 0.00 0.00 174.94 174.55 3e66 s LYS 1849N 1.78 0.64 -0.03 2.79 1.02 -1.26 -0.32 119.74 124.35 3e66 s LYS 1849Ca 0.77 -0.84 0.02 0.00 0.02 0.00 0.00 55.97 55.94 3e66 s LYS 1849Cb -0.48 -0.48 0.01 0.00 -0.52 0.00 0.00 37.83 36.36 3e66 s LYS 1849CO 0.34 0.09 -0.08 -0.51 -0.92 0.00 0.00 175.35 174.28 3e66 s LEU 1850N -1.67 1.65 0.18 3.17 1.43 -0.75 -4.24 118.68 118.46 3e66 s LEU 1850Ca -0.07 -0.17 -0.13 0.00 -1.03 0.00 0.00 54.13 52.73 3e66 s LEU 1850Cb -0.10 -0.52 -0.07 0.00 0.03 0.00 0.00 46.19 45.53 3e66 s LEU 1850CO 0.01 0.03 0.56 -0.36 0.23 0.00 0.00 176.35 176.81 3e66 s PHE 1851N 0.43 3.54 -0.10 0.29 0.40 0.65 -0.14 117.98 123.03 3e66 s PHE 1851Ca -0.06 1.01 -0.01 0.00 -0.60 0.00 0.00 56.93 57.26 3e66 s PHE 1851Cb -0.11 -2.34 0.03 0.00 0.51 0.00 0.00 43.02 41.11 3e66 s PHE 1851CO 0.01 0.36 -0.02 0.08 0.70 0.00 0.00 175.22 176.35 3e66 s VAL 1852N -1.60 0.63 -0.10 -0.44 1.01 0.11 -1.46 120.40 118.55 3e66 s VAL 1852Ca 0.42 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 62.32 3e66 s VAL 1852Cb -0.14 -0.78 -0.00 0.00 0.00 0.00 0.00 36.38 35.46 3e66 s VAL 1852CO 0.20 0.24 -0.22 -0.62 0.00 0.00 0.00 175.10 174.70 3e66 s ASP 1853N 1.86 3.29 0.00 3.32 2.15 0.11 -2.12 116.67 125.28 3e66 s ASP 1853Ca 0.04 -0.50 0.13 0.00 0.43 0.00 0.00 52.55 52.65 3e66 s ASP 1853Cb -0.13 -1.38 0.16 0.00 -0.30 0.00 0.00 42.92 41.27 3e66 s ASP 1853CO -0.07 0.17 1.00 -0.90 -0.17 0.00 0.00 175.17 175.20 3e66 n ASP 1854N 3.44 2.30 -0.38 -0.34 5.75 -1.26 -1.75 116.55 124.30 3e66 n ASP 1854Ca -0.19 -1.64 0.35 0.00 -0.01 0.00 0.00 54.79 53.30 3e66 n ASP 1854Cb 0.53 -0.06 0.70 0.00 -1.03 0.00 0.00 41.12 41.26 3e66 n ASP 1854CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 3e66 h THR 1855N 2.46 0.36 -0.38 2.12 2.02 -1.95 -1.49 112.91 116.05 3e66 h THR 1855Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3e66 h THR 1855Cb 0.59 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 3e66 h THR 1855CO 0.00 0.02 0.00 0.59 0.37 0.00 0.00 175.52 176.50 3e66 n ASN 1856N -4.29 4.25 0.11 4.18 3.02 -1.26 -4.65 115.26 116.62 3e66 n ASN 1856Ca 0.29 -2.80 -0.12 0.00 -0.03 0.00 0.00 54.58 51.91 3e66 n ASN 1856Cb 1.28 -0.54 -0.08 0.00 -0.61 0.00 0.00 39.78 39.83 3e66 n ASN 1856CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3e66 h VAL 1857N 2.55 0.78 -3.71 2.41 2.07 -1.12 -0.77 116.25 118.47 3e66 h VAL 1857Ca 0.00 -0.84 -0.68 0.00 0.82 0.00 0.00 66.70 66.01 3e66 h VAL 1857Cb 1.47 1.21 -0.19 0.00 -1.52 0.00 0.00 31.29 32.26 3e66 h VAL 1857CO 0.25 0.16 -0.45 -0.47 0.02 0.00 0.00 177.57 177.08 3e66 s TYR 1858N -4.12 3.23 0.08 1.57 5.04 -1.26 -4.02 117.35 117.87 3e66 s TYR 1858Ca -0.14 -0.18 0.04 0.00 -2.44 0.00 0.00 57.07 54.35 3e66 s TYR 1858Cb 0.01 -2.50 -0.03 0.00 0.35 0.00 0.00 41.96 39.79 3e66 s TYR 1858CO 0.52 -0.37 -0.11 1.03 -1.34 0.00 0.00 175.55 175.28 3e66 s ARG 1859N 1.76 0.76 0.15 4.97 0.52 -1.26 -5.06 118.95 120.79 3e66 s ARG 1859Ca 0.07 -0.99 0.00 0.00 -0.52 0.00 0.00 55.73 54.29 3e66 s ARG 1859Cb -0.17 -0.59 -0.04 0.00 0.52 0.00 0.00 34.95 34.67 3e66 s ARG 1859CO 0.11 0.11 0.02 0.14 0.02 0.00 0.00 175.30 175.70 3e66 s VAL 1860N -1.77 0.40 0.14 3.52 -7.23 -1.26 -1.43 120.40 112.77 3e66 s VAL 1860Ca -0.01 -1.94 0.04 0.00 -1.81 0.00 0.00 61.98 58.27 3e66 s VAL 1860Cb -0.07 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.78 3e66 s VAL 1860CO 0.01 -0.51 -0.10 0.28 -0.31 0.00 0.00 175.10 174.47 3e66 s THR 1861N -3.84 1.11 -0.16 5.32 -1.32 -0.26 -4.85 115.64 111.65 3e66 s THR 1861Ca 0.23 -2.00 -0.02 0.00 -1.21 0.00 0.00 61.69 58.68 3e66 s THR 1861Cb 0.07 -1.78 -0.02 0.00 -1.51 0.00 0.00 72.50 69.26 3e66 s THR 1861CO 0.02 -0.73 -0.08 -0.69 -2.21 0.00 0.00 174.62 170.93 3e66 s VAL 1862N -3.24 3.40 0.24 5.08 1.01 -1.26 -0.52 120.40 125.11 3e66 s VAL 1862Ca 0.15 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3e66 s VAL 1862Cb 0.02 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 3e66 s VAL 1862CO 0.00 0.49 0.17 -1.38 0.00 0.00 0.00 175.10 174.38 3e66 s HIS 1863N 0.63 1.37 -0.19 5.22 -3.43 -0.20 -4.98 115.29 113.71 3e66 s HIS 1863Ca -0.05 -1.45 -0.09 0.00 -0.80 0.00 0.00 55.06 52.67 3e66 s HIS 1863Cb -0.15 -0.63 -0.05 0.00 -1.43 0.00 0.00 32.58 30.32 3e66 s HIS 1863CO 0.03 -0.69 0.12 0.15 -2.00 0.00 0.00 174.74 172.35 3e66 s LYS 1864N -3.94 4.04 0.75 -0.38 1.02 -1.26 -1.05 119.74 118.93 3e66 s LYS 1864Ca 0.39 -0.23 -0.11 0.00 0.02 0.00 0.00 55.97 56.04 3e66 s LYS 1864Cb 0.06 -3.35 0.04 0.00 -0.52 0.00 0.00 37.83 34.05 3e66 s LYS 1864CO 0.17 0.37 1.10 0.95 -0.92 0.00 0.00 175.35 177.02 3e66 s THR 1865N 0.16 3.23 0.64 2.17 -4.23 0.86 -4.90 115.64 113.57 3e66 s THR 1865Ca 0.08 0.40 0.32 0.00 -1.18 0.00 0.00 61.69 61.31 3e66 s THR 1865Cb -0.11 -3.29 0.35 0.00 1.34 0.00 0.00 72.50 70.78 3e66 s THR 1865CO -0.01 -0.52 2.03 2.19 -0.54 0.00 0.00 174.62 177.77 3e66 h PHE 1866N -0.85 0.00 -0.00 3.99 -5.15 -1.99 0.20 116.94 113.13 3e66 h PHE 1866Ca -0.46 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.31 3e66 h PHE 1866Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.43 3e66 h PHE 1866CO 0.48 0.00 -0.17 -0.85 -2.00 0.00 0.00 178.31 175.76 3e66 n GLU 1867N -3.23 0.67 -0.08 6.09 0.28 -1.26 -4.91 120.64 118.20 3e66 n GLU 1867Ca 0.00 -0.29 0.00 0.00 -0.16 0.00 0.00 57.16 56.71 3e66 n GLU 1867Cb 0.36 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.73 3e66 n GLU 1867CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3e66 n GLY 1868N 1.32 0.49 3.94 -1.84 0.00 0.69 -5.07 105.19 104.72 3e66 n GLY 1868Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3e66 n GLY 1868CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3e66 s ASN 1869N -2.72 3.24 0.05 1.61 2.47 -1.25 -4.77 114.94 113.58 3e66 s ASN 1869Ca 0.00 0.14 0.09 0.00 0.42 0.00 0.00 52.86 53.52 3e66 s ASN 1869Cb 0.00 -0.22 -0.03 0.00 -1.45 0.00 0.00 41.25 39.55 3e66 s ASN 1869CO 0.00 -2.64 -0.26 0.54 -3.72 0.00 0.00 177.10 171.02 3e66 s VAL 1870N -3.79 2.14 0.20 -5.21 0.11 -1.26 -0.10 120.40 112.49 3e66 s VAL 1870Ca 0.73 -1.42 -0.18 0.00 -2.93 0.00 0.00 61.98 58.18 3e66 s VAL 1870Cb -0.04 -1.83 0.03 0.00 -1.53 0.00 0.00 36.38 33.01 3e66 s VAL 1870CO 0.52 0.33 0.54 0.00 -3.33 0.00 0.00 175.10 173.17 3e66 s ALA 1871N -0.83 -0.95 0.09 1.54 0.00 -0.21 -4.88 121.76 116.51 3e66 s ALA 1871Ca 0.12 -0.24 -0.04 0.00 0.00 0.00 0.00 51.96 51.81 3e66 s ALA 1871Cb -0.10 0.87 -0.05 0.00 0.00 0.00 0.00 23.12 23.84 3e66 s ALA 1871CO 0.02 -0.83 0.30 0.95 0.00 0.00 0.00 175.76 176.21 3e66 s THR 1872N -3.88 5.26 -0.03 0.00 -4.23 -1.26 -1.04 115.64 110.46 3e66 s THR 1872Ca 0.10 -0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.53 3e66 s THR 1872Cb -0.01 -3.61 0.03 0.00 1.34 0.00 0.00 72.50 70.24 3e66 s THR 1872CO -0.02 0.14 0.06 -0.75 -0.54 0.00 0.00 174.62 173.51 3e66 s LYS 1873N -2.43 -0.03 0.45 3.99 2.20 0.32 -4.93 119.74 119.32 3e66 s LYS 1873Ca 0.36 0.27 -0.25 0.00 -0.36 0.00 0.00 55.97 56.00 3e66 s LYS 1873Cb -0.13 -0.30 -0.08 0.00 -1.51 0.00 0.00 37.83 35.81 3e66 s LYS 1873CO 0.24 -0.21 1.43 0.00 -0.36 0.00 0.00 175.35 176.45 3e66 n ALA 1874N 4.49 2.03 -2.34 3.13 0.00 -1.26 -1.10 120.51 125.46 3e66 n ALA 1874Ca -0.21 0.25 -0.17 0.00 0.00 0.00 0.00 53.44 53.30 3e66 n ALA 1874Cb 0.50 -2.39 -0.10 0.00 0.00 0.00 0.00 19.45 17.46 3e66 n ALA 1874CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3e66 s ILE 1875N -1.19 1.10 0.48 0.00 -4.36 -0.51 -4.84 121.20 111.87 3e66 s ILE 1875Ca 0.61 -2.04 -0.23 0.00 -0.26 0.00 0.00 60.65 58.73 3e66 s ILE 1875Cb -0.45 -2.33 -0.08 0.00 1.25 0.00 0.00 42.46 40.85 3e66 s ILE 1875CO 0.57 -0.34 1.20 0.59 0.24 0.00 0.00 174.94 177.20 3e66 n ASN 1876N -0.42 2.06 -1.26 4.36 3.02 -1.26 -4.23 115.26 117.52 3e66 n ASN 1876Ca -0.05 1.01 0.00 0.00 -0.03 0.00 0.00 54.58 55.51 3e66 n ASN 1876Cb 0.64 -1.48 0.00 0.00 -0.61 0.00 0.00 39.78 38.33 3e66 n ASN 1876CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3e66 n GLY 1877N 0.94 4.96 3.49 7.41 0.00 0.51 -4.77 105.19 117.74 3e66 n GLY 1877Ca 0.09 -2.01 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 3e66 n GLY 1877CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e66 s ILE 1879N -2.13 4.61 -0.44 0.00 1.01 0.64 -2.86 121.20 122.02 3e66 s ILE 1879Ca -0.05 -0.09 -0.17 0.00 0.00 0.00 0.00 60.65 60.34 3e66 s ILE 1879Cb -0.00 -3.09 0.04 0.00 0.01 0.00 0.00 42.46 39.41 3e66 s ILE 1879CO 0.00 0.43 0.43 0.12 0.00 0.00 0.00 174.94 175.92 3e66 s PHE 1880N 0.69 3.18 -0.23 3.97 5.36 -0.72 -2.43 117.98 127.80 3e66 s PHE 1880Ca 0.03 -0.57 0.02 0.00 -0.96 0.00 0.00 56.93 55.45 3e66 s PHE 1880Cb -0.13 -3.00 0.05 0.00 -0.34 0.00 0.00 43.02 39.60 3e66 s PHE 1880CO 0.02 -0.75 -0.13 0.99 -1.46 0.00 0.00 175.22 173.89 3e66 s THR 1881N 2.02 2.01 -0.05 0.12 2.01 -1.06 -0.72 115.64 119.98 3e66 s THR 1881Ca 0.09 -1.32 0.06 0.00 0.31 0.00 0.00 61.69 60.83 3e66 s THR 1881Cb -0.19 -2.04 -0.01 0.00 0.01 0.00 0.00 72.50 70.26 3e66 s THR 1881CO 0.11 0.15 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.74 3e66 s LEU 1882N 1.22 2.02 -0.46 4.42 2.96 -0.54 -0.07 118.68 128.24 3e66 s LEU 1882Ca -0.04 -0.45 -0.16 0.00 -0.22 0.00 0.00 54.13 53.25 3e66 s LEU 1882Cb -0.17 -1.24 0.05 0.00 0.50 0.00 0.00 46.19 45.33 3e66 s LEU 1882CO -0.08 0.23 0.42 0.21 -1.32 0.00 0.00 176.35 175.81 3e66 s ASN 1883N -0.17 6.16 0.45 3.68 3.84 0.02 -0.26 114.94 128.66 3e66 s ASN 1883Ca -0.02 -1.05 0.31 0.00 0.21 0.00 0.00 52.86 52.31 3e66 s ASN 1883Cb -0.12 -2.20 1.47 0.00 -0.55 0.00 0.00 41.25 39.84 3e66 s ASN 1883CO 0.03 -0.63 1.93 1.55 -2.79 0.00 0.00 177.10 177.18 3e66 h PRO 1884N 8.76 0.00 0.14 0.43 0.13 -1.87 0.15 132.00 139.74 3e66 h PRO 1884Ca -0.28 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.55 3e66 h PRO 1884Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3e66 h PRO 1884CO 0.85 0.00 -1.52 -0.22 -0.23 0.00 0.00 178.00 176.87 3e66 h LYS 1885N 0.00 0.29 0.00 0.86 3.64 -1.88 -3.39 116.57 116.09 3e66 h LYS 1885Ca 0.00 -0.50 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3e66 h LYS 1885Cb 0.25 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3e66 h LYS 1885CO 0.00 1.24 -1.24 0.25 -2.27 0.00 0.00 179.45 177.42 3e66 n THR 1886N -3.82 0.05 -0.54 1.00 -2.24 -1.20 -4.74 114.28 102.78 3e66 n THR 1886Ca -0.25 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 3e66 n THR 1886Cb 0.95 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 3e66 n THR 1886CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3e66 n GLY 1887N 1.40 1.35 3.71 3.38 0.00 0.53 -4.87 105.19 110.68 3e66 n GLY 1887Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3e66 n GLY 1887CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3e66 s HIS 1888N -3.33 2.90 -0.19 1.61 3.76 -1.22 -0.48 115.29 118.34 3e66 s HIS 1888Ca 0.00 0.58 0.00 0.00 -0.15 0.00 0.00 55.06 55.49 3e66 s HIS 1888Cb 0.00 -3.90 0.02 0.00 1.11 0.00 0.00 32.58 29.80 3e66 s HIS 1888CO 0.00 -3.41 -0.16 -1.17 -0.85 0.00 0.00 174.74 169.15 3e66 s LEU 1889N 1.59 2.35 -0.49 0.89 2.96 0.83 -0.80 118.68 126.01 3e66 s LEU 1889Ca 0.70 -0.64 -0.15 0.00 -0.22 0.00 0.00 54.13 53.82 3e66 s LEU 1889Cb -0.42 -1.53 0.09 0.00 0.50 0.00 0.00 46.19 44.83 3e66 s LEU 1889CO 0.31 -0.02 0.41 -0.36 -1.32 0.00 0.00 176.35 175.38 3e66 s PHE 1890N 1.32 3.26 -0.53 5.38 0.40 0.90 -1.54 117.98 127.16 3e66 s PHE 1890Ca 0.04 -1.13 -0.17 0.00 -0.60 0.00 0.00 56.93 55.08 3e66 s PHE 1890Cb -0.14 -3.36 0.10 0.00 0.51 0.00 0.00 43.02 40.13 3e66 s PHE 1890CO -0.11 -0.88 0.54 -1.17 0.70 0.00 0.00 175.22 174.30 3e66 s LEU 1891N 1.60 5.65 -0.33 -0.37 2.96 0.08 -2.55 118.68 125.71 3e66 s LEU 1891Ca 0.04 -1.44 -0.21 0.00 -0.22 0.00 0.00 54.13 52.29 3e66 s LEU 1891Cb -0.26 -2.26 0.00 0.00 0.50 0.00 0.00 46.19 44.17 3e66 s LEU 1891CO 0.05 -0.86 0.69 -0.75 -1.32 0.00 0.00 176.35 174.16 3e66 s LYS 1892N 2.03 3.81 -0.16 1.98 2.47 -1.02 -1.20 119.74 127.65 3e66 s LYS 1892Ca 0.07 0.28 -0.25 0.00 -1.56 0.00 0.00 55.97 54.51 3e66 s LYS 1892Cb -0.25 -3.77 -0.02 0.00 -1.46 0.00 0.00 37.83 32.33 3e66 s LYS 1892CO 0.06 -0.70 0.83 0.42 0.16 0.00 0.00 175.35 176.12 3e66 s ILE 1893N 2.81 4.88 -0.39 5.43 1.01 0.46 -0.26 121.20 135.13 3e66 s ILE 1893Ca 0.28 1.64 -0.17 0.00 0.00 0.00 0.00 60.65 62.39 3e66 s ILE 1893Cb -0.14 -4.14 0.01 0.00 0.01 0.00 0.00 42.46 38.20 3e66 s ILE 1893CO 0.14 0.03 0.46 -0.63 0.00 0.00 0.00 174.94 174.94 3e66 s ILE 1894N 2.10 5.06 0.28 2.92 -1.09 -0.06 -3.60 121.20 126.81 3e66 s ILE 1894Ca 0.39 -0.10 -0.23 0.00 -2.23 0.00 0.00 60.65 58.48 3e66 s ILE 1894Cb -0.17 -4.00 -0.09 0.00 -1.58 0.00 0.00 42.46 36.62 3e66 s ILE 1894CO 0.13 -0.34 0.84 -2.28 -1.23 0.00 0.00 174.94 172.06 3e66 s HIS 1895N 2.23 3.66 0.63 3.97 5.65 -1.26 -0.36 115.29 129.81 3e66 s HIS 1895Ca 0.14 1.59 0.28 0.00 0.25 0.00 0.00 55.06 57.33 3e66 s HIS 1895Cb -0.16 -2.78 1.50 0.00 -1.18 0.00 0.00 32.58 29.96 3e66 s HIS 1895CO 0.14 0.26 1.88 1.79 -0.65 0.00 0.00 174.74 178.15 3e66 h THR 1896N 2.65 0.17 0.00 0.89 1.35 -1.93 -1.21 112.91 114.82 3e66 h THR 1896Ca -0.47 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.38 3e66 h THR 1896Cb 1.19 0.62 -0.00 0.00 -1.73 0.00 0.00 68.15 68.23 3e66 h THR 1896CO 0.65 0.00 -0.01 0.77 -0.25 0.00 0.00 175.52 176.68 3e66 h SER 1897N 0.00 0.00 1.40 5.36 4.64 -1.97 -1.75 113.55 121.23 3e66 h SER 1897Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3e66 h SER 1897Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 3e66 h SER 1897CO -0.00 0.01 0.00 -0.37 -0.87 0.00 0.00 176.83 175.60 3e66 h VAL 1898N 0.00 0.00 0.00 0.95 -1.51 -1.61 -2.81 116.25 111.27 3e66 h VAL 1898Ca -0.00 -0.68 -0.25 0.00 -1.23 0.00 0.00 66.70 64.54 3e66 h VAL 1898Cb 0.05 1.67 -0.04 0.00 -2.13 0.00 0.00 31.29 30.84 3e66 h VAL 1898CO 0.00 0.00 -1.39 -0.50 -1.23 0.00 0.00 177.57 174.46 3e66 h TRP 1899N 0.00 0.00 0.00 5.19 -0.00 -1.52 -3.45 115.95 116.17 3e66 h TRP 1899Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 3e66 h TRP 1899Cb 0.70 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.86 3e66 h TRP 1899CO 0.00 0.95 0.00 0.00 -0.00 0.00 0.00 178.44 179.39 3e66 n ALA 1900N -2.46 0.00 -3.59 1.49 0.00 -1.06 -1.83 120.51 113.06 3e66 n ALA 1900Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.03 3e66 n ALA 1900Cb 0.98 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.35 3e66 n ALA 1900CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3e66 n GLY 1901N 0.00 4.42 3.21 0.00 0.00 -1.26 -5.05 105.19 106.51 3e66 n GLY 1901Ca 0.00 -2.66 -0.18 0.00 0.00 0.00 0.00 46.02 43.18 3e66 n GLY 1901CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3e66 s GLN 1902N -1.91 0.92 0.59 1.61 -1.52 -0.76 -5.16 119.66 113.44 3e66 s GLN 1902Ca 0.31 -1.11 0.09 0.00 -1.95 0.00 0.00 55.36 52.70 3e66 s GLN 1902Cb 0.02 -0.86 0.09 0.00 -0.22 0.00 0.00 33.01 32.04 3e66 s GLN 1902CO -0.08 0.18 0.72 0.15 -0.25 0.00 0.00 175.29 176.00 3e66 s LYS 1903N -2.25 2.22 -0.26 2.91 1.02 -1.26 -4.72 119.74 117.41 3e66 s LYS 1903Ca 0.04 -1.81 -0.05 0.00 0.02 0.00 0.00 55.97 54.17 3e66 s LYS 1903Cb -0.07 -2.48 0.01 0.00 -0.52 0.00 0.00 37.83 34.77 3e66 s LYS 1903CO 0.02 -0.89 0.16 -2.13 -0.92 0.00 0.00 175.35 171.60 3e66 n ARG 1904N -2.18 -0.66 0.22 1.68 0.63 -1.26 -4.71 116.66 110.38 3e66 n ARG 1904Ca 0.12 -0.16 0.09 0.00 -0.92 0.00 0.00 57.85 56.98 3e66 n ARG 1904Cb 0.63 -0.14 0.64 0.00 0.45 0.00 0.00 32.46 34.03 3e66 n ARG 1904CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 3e66 h LEU 1905N 1.30 0.02 -1.11 6.15 3.38 -1.99 -1.85 115.31 121.21 3e66 h LEU 1905Ca -0.17 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 3e66 h LEU 1905Cb 0.35 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3e66 h LEU 1905CO 0.11 0.02 -0.42 0.77 0.09 0.00 0.00 178.44 179.00 3e66 h SER 1906N 0.03 0.04 0.10 -0.43 4.64 -2.00 -0.51 113.55 115.41 3e66 h SER 1906Ca 0.04 -0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 61.12 3e66 h SER 1906Cb 0.12 -0.01 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 3e66 h SER 1906CO -0.00 0.46 -0.94 -0.61 -0.87 0.00 0.00 176.83 174.87 3e66 h GLN 1907N 0.03 0.45 -0.90 4.77 4.15 -1.73 -3.18 115.11 118.71 3e66 h GLN 1907Ca -0.00 -0.63 0.01 0.00 0.77 0.00 0.00 58.65 58.81 3e66 h GLN 1907Cb 0.77 0.21 -0.05 0.00 0.21 0.00 0.00 27.48 28.62 3e66 h GLN 1907CO 0.06 1.26 0.59 1.25 -1.93 0.00 0.00 178.83 180.06 3e66 h LEU 1908N -0.05 1.02 -0.93 -2.39 5.85 -1.13 -1.89 115.31 115.79 3e66 h LEU 1908Ca -0.15 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.48 3e66 h LEU 1908Cb 1.68 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 3e66 h LEU 1908CO 0.18 0.73 -0.01 0.00 -0.34 0.00 0.00 178.44 179.00 3e66 h ALA 1909N 1.45 1.12 -0.15 1.25 0.00 -1.16 0.20 119.26 121.96 3e66 h ALA 1909Ca 0.33 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 3e66 h ALA 1909Cb -0.12 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.49 3e66 h ALA 1909CO -0.08 0.56 -0.56 0.87 0.00 0.00 0.00 179.25 180.05 3e66 h LYS 1910N 0.71 0.64 -0.09 0.00 1.57 -1.41 -1.86 116.57 116.13 3e66 h LYS 1910Ca 0.14 -0.49 -0.14 0.00 -1.87 0.00 0.00 60.65 58.28 3e66 h LYS 1910Cb 0.45 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 3e66 h LYS 1910CO 0.02 1.11 -0.58 -1.49 -0.57 0.00 0.00 179.45 177.95 3e66 h TRP 1911N 0.31 0.36 -0.75 -1.35 4.06 -1.23 -1.99 115.95 115.36 3e66 h TRP 1911Ca -0.03 -0.13 -0.05 0.00 2.06 0.00 0.00 58.89 60.74 3e66 h TRP 1911Cb 1.19 -0.07 -0.03 0.00 -1.00 0.00 0.00 29.16 29.25 3e66 h TRP 1911CO 0.10 0.79 0.25 -0.22 -3.56 0.00 0.00 178.44 175.80 3e66 h LYS 1912N 0.21 1.14 -0.13 0.49 1.63 -0.60 0.39 116.57 119.71 3e66 h LYS 1912Ca -0.00 -0.23 -0.01 0.00 -0.85 0.00 0.00 60.65 59.56 3e66 h LYS 1912Cb 1.07 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 32.53 3e66 h LYS 1912CO 0.09 0.96 0.05 1.15 -3.45 0.00 0.00 179.45 178.25 3e66 h THR 1913N 1.10 1.15 -0.44 1.00 2.02 -0.99 -1.47 112.91 115.28 3e66 h THR 1913Ca 0.24 -0.45 -0.05 0.00 0.77 0.00 0.00 66.41 66.93 3e66 h THR 1913Cb 0.28 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 3e66 h THR 1913CO -0.01 0.14 0.08 0.00 0.37 0.00 0.00 175.52 176.10 3e66 h ALA 1914N 0.89 1.31 -0.02 6.16 0.00 -1.11 -1.32 119.26 125.17 3e66 h ALA 1914Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3e66 h ALA 1914Cb 0.17 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3e66 h ALA 1914CO -0.00 0.48 0.01 1.49 0.00 0.00 0.00 179.25 181.23 3e66 h GLU 1915N 0.65 0.03 -0.39 0.00 4.81 -0.64 -1.50 114.58 117.54 3e66 h GLU 1915Ca 0.14 -0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.22 3e66 h GLU 1915Cb 0.29 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3e66 h GLU 1915CO 0.00 0.02 -0.37 0.93 -0.73 0.00 0.00 179.01 178.86 3e66 h GLU 1916N 0.02 0.92 -0.19 1.92 4.39 -1.05 -1.97 114.58 118.62 3e66 h GLU 1916Ca 0.01 -0.48 -0.01 0.00 0.34 0.00 0.00 59.36 59.22 3e66 h GLU 1916Cb 0.00 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 3e66 h GLU 1916CO -0.00 1.13 0.09 0.28 -1.16 0.00 0.00 179.01 179.35 3e66 h VAL 1917N 0.76 1.14 -0.20 3.13 2.07 -1.17 -1.34 116.25 120.64 3e66 h VAL 1917Ca 0.06 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.09 3e66 h VAL 1917Cb 0.96 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 3e66 h VAL 1917CO 0.09 0.13 -0.28 0.77 0.02 0.00 0.00 177.57 178.31 3e66 h SER 1918N 0.17 0.38 -0.74 0.57 4.64 -1.28 -0.92 113.55 116.38 3e66 h SER 1918Ca 0.06 -0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.20 3e66 h SER 1918Cb 0.13 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.08 3e66 h SER 1918CO -0.01 0.65 0.23 0.00 -0.87 0.00 0.00 176.83 176.83 3e66 h ALA 1919N 1.38 1.00 -0.19 5.18 0.00 -1.18 0.16 119.26 125.61 3e66 h ALA 1919Ca 0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3e66 h ALA 1919Cb 0.66 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3e66 h ALA 1919CO 0.05 0.67 0.07 1.25 0.00 0.00 0.00 179.25 181.29 3e66 h LEU 1920N 1.10 0.26 -0.58 0.00 5.85 -0.59 -2.00 115.31 119.36 3e66 h LEU 1920Ca 0.24 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 3e66 h LEU 1920Cb 0.31 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 3e66 h LEU 1920CO -0.01 0.36 0.34 0.58 -0.34 0.00 0.00 178.44 179.37 3e66 h VAL 1921N 0.15 1.18 -0.29 1.05 2.07 -0.92 -2.64 116.25 116.84 3e66 h VAL 1921Ca 0.06 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3e66 h VAL 1921Cb 0.18 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 3e66 h VAL 1921CO -0.00 0.18 0.19 -0.09 0.02 0.00 0.00 177.57 177.87 3e66 h ARG 1922N 0.78 0.38 0.00 1.57 2.43 -0.49 -2.09 114.38 116.96 3e66 h ARG 1922Ca 0.21 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 3e66 h ARG 1922Cb -0.00 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 3e66 h ARG 1922CO -0.04 0.25 0.00 0.66 -1.51 0.00 0.00 179.97 179.34 3e66 h SER 1923N 0.39 0.00 -3.45 -3.80 4.64 -0.99 -3.45 113.55 106.89 3e66 h SER 1923Ca 0.11 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.89 3e66 h SER 1923Cb -0.04 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 3e66 h SER 1923CO -0.02 0.00 0.06 -0.76 -0.87 0.00 0.00 176.83 175.24 3e66 s LEU 1924N -5.77 4.43 0.76 5.97 1.43 -0.79 -5.06 118.68 119.65 3e66 s LEU 1924Ca 0.06 1.37 -0.12 0.00 -1.03 0.00 0.00 54.13 54.41 3e66 s LEU 1924Cb 0.08 -3.33 0.05 0.00 0.03 0.00 0.00 46.19 43.02 3e66 s LEU 1924CO 0.60 0.13 1.12 -2.16 0.23 0.00 0.00 176.35 176.27 3e66 s PRO 1925N -1.62 2.19 0.30 1.29 0.04 -1.26 -4.72 135.00 131.22 3e66 s PRO 1925Ca 0.38 1.36 0.06 0.00 0.04 0.00 0.00 61.00 62.84 3e66 s PRO 1925Cb -0.18 -1.88 0.78 0.00 0.04 0.00 0.00 34.50 33.26 3e66 s PRO 1925CO 0.21 -1.72 1.70 -0.22 0.04 0.00 0.00 177.00 177.02 3e66 h LYS 1926N -0.82 0.43 0.00 4.56 1.63 -1.95 0.69 116.57 121.11 3e66 h LYS 1926Ca -0.45 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.33 3e66 h LYS 1926Cb 1.25 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 3e66 h LYS 1926CO 0.50 0.29 0.00 1.05 -3.45 0.00 0.00 179.45 177.84 3e66 h GLU 1927N 0.44 0.00 -0.01 1.90 9.09 -2.03 -2.83 114.58 121.14 3e66 h GLU 1927Ca 0.59 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.00 3e66 h GLU 1927Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 3e66 h GLU 1927CO -0.52 0.00 -0.33 0.39 0.05 0.00 0.00 179.01 178.60 3e66 n GLU 1928N -2.92 1.89 -2.58 1.06 1.02 0.18 -4.99 120.64 114.30 3e66 n GLU 1928Ca -0.00 -0.66 -0.37 0.00 -0.02 0.00 0.00 57.16 56.11 3e66 n GLU 1928Cb 0.21 -1.21 -0.04 0.00 -0.02 0.00 0.00 31.44 30.38 3e66 n GLU 1928CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3e66 s GLN 1929N -1.79 4.25 0.53 3.49 -0.21 -0.88 -4.93 119.66 120.12 3e66 s GLN 1929Ca 0.11 1.50 -0.19 0.00 0.02 0.00 0.00 55.36 56.80 3e66 s GLN 1929Cb 0.11 -2.61 -0.07 0.00 1.00 0.00 0.00 33.01 31.45 3e66 s GLN 1929CO 0.38 -0.06 1.05 -1.25 -2.12 0.00 0.00 175.29 173.29 3e66 s PRO 1930N -2.39 3.62 0.12 2.91 0.04 -1.26 -4.82 135.00 133.22 3e66 s PRO 1930Ca 0.56 1.31 0.13 0.00 0.04 0.00 0.00 61.00 63.04 3e66 s PRO 1930Cb -0.22 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.14 3e66 s PRO 1930CO 0.28 -0.57 1.09 0.87 0.04 0.00 0.00 177.00 178.71 3e66 h LYS 1931N 1.15 0.00 -3.21 4.56 6.56 -1.00 -3.43 116.57 121.19 3e66 h LYS 1931Ca -0.49 0.00 -0.14 0.00 -1.06 0.00 0.00 60.65 58.96 3e66 h LYS 1931Cb 1.22 0.00 -0.22 0.00 -0.57 0.00 0.00 32.23 32.66 3e66 h LYS 1931CO 0.58 0.57 -0.39 1.14 -2.06 0.00 0.00 179.45 179.30 3e66 s GLN 1932N -2.82 0.50 -0.16 3.15 -2.07 -1.20 -0.65 119.66 116.41 3e66 s GLN 1932Ca -0.00 -0.09 0.02 0.00 -1.82 0.00 0.00 55.36 53.46 3e66 s GLN 1932Cb 0.09 0.22 0.02 0.00 -1.09 0.00 0.00 33.01 32.24 3e66 s GLN 1932CO 0.80 -0.12 -0.20 0.42 -1.32 0.00 0.00 175.29 174.87 3e66 s ILE 1933N -0.90 2.01 -0.27 3.63 1.01 0.23 -1.81 121.20 125.10 3e66 s ILE 1933Ca -0.10 -0.93 -0.09 0.00 0.00 0.00 0.00 60.65 59.53 3e66 s ILE 1933Cb -0.05 -1.80 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 3e66 s ILE 1933CO 0.02 0.54 0.13 -0.63 0.00 0.00 0.00 174.94 175.00 3e66 s ILE 1934N 1.08 4.71 -0.05 2.92 1.01 0.80 -0.80 121.20 130.87 3e66 s ILE 1934Ca -0.01 -0.11 -0.17 0.00 0.00 0.00 0.00 60.65 60.36 3e66 s ILE 1934Cb -0.14 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.02 3e66 s ILE 1934CO -0.08 0.25 0.46 0.68 0.00 0.00 0.00 174.94 176.25 3e66 s VAL 1935N 1.66 5.08 -0.61 2.92 -7.23 -0.29 -0.71 120.40 121.22 3e66 s VAL 1935Ca 0.06 0.93 0.25 0.00 -1.81 0.00 0.00 61.98 61.42 3e66 s VAL 1935Cb -0.16 -3.78 0.28 0.00 0.56 0.00 0.00 36.38 33.28 3e66 s VAL 1935CO 0.07 0.45 1.76 0.71 -0.31 0.00 0.00 175.10 177.77 3e66 h THR 1936N 4.19 0.00 -3.35 5.32 1.35 -1.75 -3.30 112.91 115.36 3e66 h THR 1936Ca -0.46 -0.44 -0.52 0.00 -0.55 0.00 0.00 66.41 64.44 3e66 h THR 1936Cb 1.20 1.36 -0.34 0.00 -1.73 0.00 0.00 68.15 68.63 3e66 h THR 1936CO 0.69 0.00 -0.81 -0.13 -0.25 0.00 0.00 175.52 175.01 3e66 s ARG 1937N -3.19 1.73 0.66 4.72 0.52 -1.26 -4.89 118.95 117.23 3e66 s ARG 1937Ca 0.08 -0.40 0.43 0.00 -0.52 0.00 0.00 55.73 55.32 3e66 s ARG 1937Cb 0.11 -1.50 2.35 0.00 0.52 0.00 0.00 34.95 36.43 3e66 s ARG 1937CO 0.54 -0.04 2.36 0.87 0.02 0.00 0.00 175.30 179.05 3e66 h LYS 1938N 7.26 0.00 0.00 3.54 1.57 -1.91 -1.13 116.57 125.90 3e66 h LYS 1938Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 3e66 h LYS 1938Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3e66 h LYS 1938CO 0.46 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.34 3e66 h ALA 1939N 2.00 1.00 0.00 3.86 0.00 -1.97 -2.00 119.26 122.15 3e66 h ALA 1939Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3e66 h ALA 1939Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3e66 h ALA 1939CO 0.00 0.00 -0.57 -1.33 0.00 0.00 0.00 179.25 177.35 3e66 n MET 1940N -2.85 0.21 0.01 0.00 2.81 -0.43 -4.36 117.12 112.52 3e66 n MET 1940Ca 0.01 0.06 -0.10 0.00 -1.81 0.00 0.00 57.70 55.86 3e66 n MET 1940Cb 0.26 -1.64 -0.03 0.00 -0.71 0.00 0.00 33.22 31.10 3e66 n MET 1940CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3e66 h LEU 1941N 0.00 -0.75 0.31 4.03 5.85 -1.45 -2.31 115.31 120.99 3e66 h LEU 1941Ca 0.00 0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3e66 h LEU 1941Cb 0.68 0.33 0.00 0.00 0.37 0.00 0.00 40.66 42.04 3e66 h LEU 1941CO 0.00 -0.30 -0.15 -0.78 -0.34 0.00 0.00 178.44 176.87 3e66 h ASP 1942N -0.33 -0.35 -0.42 1.25 3.58 -1.76 -1.19 116.42 117.19 3e66 h ASP 1942Ca 0.09 -0.16 0.08 0.00 0.42 0.00 0.00 57.03 57.46 3e66 h ASP 1942Cb 0.46 0.09 -0.07 0.00 1.72 0.00 0.00 39.33 41.53 3e66 h ASP 1942CO -0.29 -0.01 -0.03 -0.65 -2.88 0.00 0.00 179.24 175.38 3e66 h PRO 1943N -0.73 0.08 -0.81 0.28 0.11 -1.79 -1.02 132.00 128.12 3e66 h PRO 1943Ca -0.04 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.02 3e66 h PRO 1943Cb 0.49 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.55 3e66 h PRO 1943CO 0.07 0.05 0.34 1.25 -0.21 0.00 0.00 178.00 179.50 3e66 h LEU 1944N 0.08 1.10 -0.25 2.35 5.85 -1.46 -2.44 115.31 120.54 3e66 h LEU 1944Ca 0.21 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.81 3e66 h LEU 1944Cb 0.31 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 3e66 h LEU 1944CO -0.37 0.96 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.58 3e66 h GLU 1945N 1.17 0.03 -0.44 1.25 4.81 -0.13 -0.74 114.58 120.52 3e66 h GLU 1945Ca 0.27 -0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.55 3e66 h GLU 1945Cb 0.19 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.52 3e66 h GLU 1945CO -0.03 0.02 0.17 0.28 -0.73 0.00 0.00 179.01 178.73 3e66 h VAL 1946N 0.03 0.89 0.00 0.32 2.07 -0.92 -2.75 116.25 115.89 3e66 h VAL 1946Ca 0.12 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3e66 h VAL 1946Cb 0.17 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3e66 h VAL 1946CO -0.23 0.06 -0.25 0.45 0.02 0.00 0.00 177.57 177.62 3e66 h HIS 1947N 0.36 0.00 -0.28 1.57 3.86 -0.98 -3.03 115.15 116.65 3e66 h HIS 1947Ca 0.20 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 3e66 h HIS 1947Cb 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 3e66 h HIS 1947CO -0.14 0.25 0.00 -1.33 0.86 0.00 0.00 177.93 177.57 3e66 n MET 1948N -3.47 1.90 0.32 2.45 2.00 -0.33 -4.20 117.12 115.80 3e66 n MET 1948Ca -0.00 -1.37 0.20 0.00 0.00 0.00 0.00 57.70 56.53 3e66 n MET 1948Cb 0.43 -1.38 1.08 0.00 0.00 0.00 0.00 33.22 33.35 3e66 n MET 1948CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 3e66 h LEU 1949N 2.54 0.00 -0.25 4.03 3.38 -1.42 0.14 115.31 123.73 3e66 h LEU 1949Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3e66 h LEU 1949Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3e66 h LEU 1949CO 0.00 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.00 3e66 n ASP 1950N -2.96 0.43 -3.76 -0.43 8.00 -1.26 -4.07 116.55 112.49 3e66 n ASP 1950Ca -0.03 0.58 -0.28 0.00 0.71 0.00 0.00 54.79 55.77 3e66 n ASP 1950Cb 0.13 -0.68 -0.11 0.00 -0.02 0.00 0.00 41.12 40.44 3e66 n ASP 1950CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3e66 n PHE 1951N -1.94 2.23 -0.06 1.24 3.01 0.49 -4.97 117.46 117.46 3e66 n PHE 1951Ca 0.04 -4.06 0.24 0.00 1.01 0.00 0.00 57.45 54.68 3e66 n PHE 1951Cb 0.28 -0.41 0.72 0.00 -0.01 0.00 0.00 39.48 40.06 3e66 n PHE 1951CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 3e66 h PRO 1952N 5.40 0.00 -0.01 -1.08 0.13 -1.74 -1.37 132.00 133.33 3e66 h PRO 1952Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3e66 h PRO 1952Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3e66 h PRO 1952CO 0.64 0.00 -0.11 0.09 -0.23 0.00 0.00 178.00 178.39 3e66 n ASN 1953N -4.12 0.94 -4.56 1.44 5.03 -1.26 -4.79 115.26 107.94 3e66 n ASN 1953Ca 0.13 -1.02 -0.40 0.00 0.87 0.00 0.00 54.58 54.16 3e66 n ASN 1953Cb 0.79 0.02 -0.09 0.00 -1.02 0.00 0.00 39.78 39.48 3e66 n ASN 1953CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3e66 s ILE 1954N -2.28 5.15 0.12 2.41 1.01 -0.52 -4.83 121.20 122.25 3e66 s ILE 1954Ca 0.32 0.21 -0.24 0.00 0.00 0.00 0.00 60.65 60.94 3e66 s ILE 1954Cb 0.20 -3.81 -0.07 0.00 0.01 0.00 0.00 42.46 38.79 3e66 s ILE 1954CO 0.43 -0.05 0.75 0.00 0.00 0.00 0.00 174.94 176.07 3e66 s ALA 1955N 2.08 3.45 -0.23 9.38 0.00 0.18 -4.93 121.76 131.68 3e66 s ALA 1955Ca 0.13 0.30 -0.07 0.00 0.00 0.00 0.00 51.96 52.32 3e66 s ALA 1955Cb -0.16 -2.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.00 3e66 s ALA 1955CO 0.11 0.24 0.07 0.42 0.00 0.00 0.00 175.76 176.61 3e66 s ILE 1956N -0.84 4.47 -0.01 0.00 -1.09 -1.26 -0.60 121.20 121.87 3e66 s ILE 1956Ca 0.36 -0.13 0.07 0.00 -2.23 0.00 0.00 60.65 58.72 3e66 s ILE 1956Cb -0.22 -3.07 -0.02 0.00 -1.58 0.00 0.00 42.46 37.57 3e66 s ILE 1956CO 0.24 0.37 -0.23 -0.13 -1.23 0.00 0.00 174.94 173.96 3e66 s ARG 1957N 1.27 1.84 0.67 2.79 0.52 0.02 -4.96 118.95 121.10 3e66 s ARG 1957Ca 0.05 -0.85 -0.01 0.00 -0.52 0.00 0.00 55.73 54.40 3e66 s ARG 1957Cb -0.15 -1.80 0.09 0.00 0.52 0.00 0.00 34.95 33.61 3e66 s ARG 1957CO 0.04 0.49 0.93 -1.25 0.02 0.00 0.00 175.30 175.53 3e66 s PRO 1958N -0.62 2.00 0.01 3.54 0.04 -1.26 -1.13 135.00 137.58 3e66 s PRO 1958Ca 0.09 -0.87 -0.06 0.00 0.04 0.00 0.00 61.00 60.19 3e66 s PRO 1958Cb -0.09 -2.35 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 3e66 s PRO 1958CO -0.01 -1.20 0.11 -0.08 0.04 0.00 0.00 177.00 175.86 3e66 s THR 1959N -3.05 0.09 -0.49 1.26 -1.32 -1.24 -2.86 115.64 108.02 3e66 s THR 1959Ca 0.63 -0.73 0.23 0.00 -1.21 0.00 0.00 61.69 60.61 3e66 s THR 1959Cb -0.08 -0.41 0.00 0.00 -1.51 0.00 0.00 72.50 70.51 3e66 s THR 1959CO 0.43 -0.40 1.17 -0.33 -2.21 0.00 0.00 174.62 173.28 3e66 h GLU 1960N 4.32 0.00 -6.18 7.08 5.08 -1.51 -3.46 114.58 119.92 3e66 h GLU 1960Ca -0.31 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.48 3e66 h GLU 1960Cb 1.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 3e66 h GLU 1960CO 0.41 0.00 0.80 -0.51 -1.00 0.00 0.00 179.01 178.70 3e66 s LEU 1961N -4.58 4.19 -1.24 1.33 1.43 -1.24 -4.13 118.68 114.44 3e66 s LEU 1961Ca 0.03 1.63 -0.08 0.00 -1.03 0.00 0.00 54.13 54.68 3e66 s LEU 1961Cb 0.12 -3.54 0.20 0.00 0.03 0.00 0.00 46.19 42.99 3e66 s LEU 1961CO 0.76 -0.67 1.80 0.54 0.23 0.00 0.00 176.35 179.01 3e66 n ARG 1962N 6.05 3.80 -1.41 1.70 5.12 0.16 -4.98 116.66 127.09 3e66 n ARG 1962Ca 0.12 -3.73 -0.36 0.00 -1.93 0.00 0.00 57.85 51.95 3e66 n ARG 1962Cb 0.46 -2.84 0.08 0.00 -1.16 0.00 0.00 32.46 29.00 3e66 n ARG 1962CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3e66 n LEU 1963N 3.34 3.44 -1.62 0.55 4.77 -1.19 -4.34 117.00 121.95 3e66 n LEU 1963Ca 0.37 0.69 -0.11 0.00 -0.03 0.00 0.00 56.01 56.93 3e66 n LEU 1963Cb 0.36 -1.39 0.06 0.00 -2.33 0.00 0.00 43.42 40.11 3e66 n LEU 1963CO 0.80 -2.05 0.95 -0.81 -1.33 0.00 0.00 177.39 174.95 3e66 n PRO 1964N -1.63 1.58 0.28 3.23 -0.04 -1.26 -4.60 135.00 132.57 3e66 n PRO 1964Ca 0.13 -1.28 0.15 0.00 -0.04 0.00 0.00 63.50 62.45 3e66 n PRO 1964Cb 0.49 -1.50 0.84 0.00 -0.04 0.00 0.00 33.50 33.28 3e66 n PRO 1964CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3e66 h PHE 1965N 0.75 0.00 -0.22 0.54 0.05 -1.93 -2.33 116.94 113.80 3e66 h PHE 1965Ca 0.26 0.00 0.07 0.00 3.82 0.00 0.00 57.97 62.12 3e66 h PHE 1965Cb 1.49 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.43 3e66 h PHE 1965CO 0.69 0.06 0.17 0.66 -0.18 0.00 0.00 178.31 179.71 3e66 h SER 1966N 0.00 0.00 0.08 2.17 4.64 -1.97 0.48 113.55 118.95 3e66 h SER 1966Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3e66 h SER 1966Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 3e66 h SER 1966CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 3e66 n ALA 1967N -2.54 1.65 -0.25 5.18 0.00 -0.88 -2.81 120.51 120.86 3e66 n ALA 1967Ca 0.02 -0.04 0.09 0.00 0.00 0.00 0.00 53.44 53.51 3e66 n ALA 1967Cb 0.32 -1.13 0.34 0.00 0.00 0.00 0.00 19.45 18.97 3e66 n ALA 1967CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3e66 h ALA 1968N 2.43 1.72 0.00 0.00 0.00 -1.10 0.25 119.26 122.56 3e66 h ALA 1968Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3e66 h ALA 1968Cb 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3e66 h ALA 1968CO 0.00 0.10 0.00 -1.33 0.00 0.00 0.00 179.25 178.02 3e66 n MET 1969N -4.52 0.70 0.00 0.00 2.81 -1.12 -1.84 117.12 113.14 3e66 n MET 1969Ca 0.15 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.15 3e66 n MET 1969Cb 0.34 -1.40 0.08 0.00 -0.71 0.00 0.00 33.22 31.53 3e66 n MET 1969CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3e66 n SER 1970N -0.90 1.66 -4.54 7.83 7.64 0.89 -4.53 113.62 121.67 3e66 n SER 1970Ca 0.13 -1.29 -0.43 0.00 1.01 0.00 0.00 58.87 58.29 3e66 n SER 1970Cb 0.06 0.45 -0.05 0.00 -1.01 0.00 0.00 64.21 63.66 3e66 n SER 1970CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3e66 s ILE 1971N -2.55 4.55 0.25 0.44 1.01 -0.77 -4.96 121.20 119.18 3e66 s ILE 1971Ca 0.18 0.44 -0.12 0.00 0.00 0.00 0.00 60.65 61.16 3e66 s ILE 1971Cb 0.18 -4.40 0.34 0.00 0.01 0.00 0.00 42.46 38.60 3e66 s ILE 1971CO 0.60 -0.84 1.58 0.44 0.00 0.00 0.00 174.94 176.72 3e66 h ASP 1972N 9.08 -0.88 -0.54 3.58 3.32 -1.87 -0.60 116.42 128.52 3e66 h ASP 1972Ca -0.25 0.26 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 3e66 h ASP 1972Cb 1.08 0.55 -0.03 0.00 0.22 0.00 0.00 39.33 41.16 3e66 h ASP 1972CO 1.01 -0.29 0.28 0.11 -1.72 0.00 0.00 179.24 178.63 3e66 h LYS 1973N -0.01 0.79 -0.16 3.56 1.57 -1.92 -0.13 116.57 120.26 3e66 h LYS 1973Ca 0.39 -0.09 -0.12 0.00 -1.87 0.00 0.00 60.65 58.95 3e66 h LYS 1973Cb 0.62 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.78 3e66 h LYS 1973CO -0.88 0.61 -0.39 -0.07 -0.57 0.00 0.00 179.45 178.15 3e66 h LEU 1974N 0.79 0.61 -0.45 2.94 3.38 -1.48 -1.52 115.31 119.60 3e66 h LEU 1974Ca 0.20 -0.58 0.01 0.00 0.09 0.00 0.00 57.88 57.61 3e66 h LEU 1974Cb 0.07 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3e66 h LEU 1974CO -0.03 1.08 0.28 -1.28 0.09 0.00 0.00 178.44 178.58 3e66 h SER 1975N 0.17 0.46 -0.05 -0.43 0.87 -0.84 -1.54 113.55 112.19 3e66 h SER 1975Ca -0.00 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 3e66 h SER 1975Cb 1.00 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.85 3e66 h SER 1975CO 0.08 0.33 0.01 0.44 -0.53 0.00 0.00 176.83 177.17 3e66 h ASP 1976N 0.56 0.07 -0.81 6.23 3.32 -1.03 0.13 116.42 124.88 3e66 h ASP 1976Ca 0.17 -0.23 0.07 0.00 0.02 0.00 0.00 57.03 57.06 3e66 h ASP 1976Cb -0.02 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 3e66 h ASP 1976CO -0.06 0.28 0.53 1.62 -1.72 0.00 0.00 179.24 179.89 3e66 h VAL 1977N -0.15 1.03 -0.22 -1.35 3.04 -1.15 0.92 116.25 118.38 3e66 h VAL 1977Ca 0.01 -0.30 -0.07 0.00 -1.01 0.00 0.00 66.70 65.33 3e66 h VAL 1977Cb 0.24 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 29.59 3e66 h VAL 1977CO 0.00 0.16 -0.13 0.58 -1.01 0.00 0.00 177.57 177.17 3e66 h VAL 1978N 0.88 1.31 -0.73 1.51 2.07 -1.02 -3.07 116.25 117.20 3e66 h VAL 1978Ca 0.35 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 3e66 h VAL 1978Cb 0.25 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 3e66 h VAL 1978CO -0.13 0.38 0.40 -0.03 0.02 0.00 0.00 177.57 178.21 3e66 h MET 1979N 0.18 1.02 0.00 1.57 -1.53 0.36 -2.97 114.93 113.56 3e66 h MET 1979Ca 0.05 -0.12 0.00 0.00 -3.44 0.00 0.00 59.70 56.19 3e66 h MET 1979Cb 0.64 -0.20 0.00 0.00 -0.55 0.00 0.00 31.60 31.49 3e66 h MET 1979CO 0.04 0.76 0.00 0.87 0.14 0.00 0.00 176.91 178.72 3e66 h LYS 1980N 1.01 0.00 -6.33 0.39 1.57 -0.90 -3.46 116.57 108.85 3e66 h LYS 1980Ca 0.26 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.38 3e66 h LYS 1980Cb 0.04 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.40 3e66 h LYS 1980CO -0.04 0.00 0.66 0.00 -0.57 0.00 0.00 179.45 179.50 3e66 n ALA 1981N -1.99 -0.05 0.59 3.86 0.00 -1.12 -4.86 120.51 116.95 3e66 n ALA 1981Ca 0.02 0.46 0.07 0.00 0.00 0.00 0.00 53.44 54.00 3e66 n ALA 1981Cb 0.36 -2.21 0.06 0.00 0.00 0.00 0.00 19.45 17.66 3e66 n ALA 1981CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3e66 n THR 1982N 3.23 0.00 -3.53 0.00 -2.24 -1.26 -5.00 114.28 105.48 3e66 n THR 1982Ca 0.19 -0.50 -0.07 0.00 -2.27 0.00 0.00 64.05 61.40 3e66 n THR 1982Cb 0.22 1.29 -0.02 0.00 -2.10 0.00 0.00 70.33 69.72 3e66 n THR 1982CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3e66 s GLU 1983N -1.19 0.66 0.47 -0.78 -1.05 -1.26 -5.06 118.70 110.49 3e66 s GLU 1983Ca 0.17 -0.22 -0.21 0.00 -0.15 0.00 0.00 54.97 54.56 3e66 s GLU 1983Cb 0.12 0.30 -0.11 0.00 -0.44 0.00 0.00 34.13 34.00 3e66 s GLU 1983CO 0.18 -0.28 0.56 -2.30 0.95 0.00 0.00 175.26 174.36 3e66 n PRO 1984N -0.13 0.60 -3.65 -4.83 -0.02 -1.26 -4.83 135.00 120.88 3e66 n PRO 1984Ca -0.06 0.22 -0.02 0.00 -2.02 0.00 0.00 63.50 61.62 3e66 n PRO 1984Cb 0.60 -1.60 -0.03 0.00 -0.02 0.00 0.00 33.50 32.46 3e66 n PRO 1984CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3e66 s GLN 1985N -1.76 0.01 -0.06 -0.52 -2.07 -1.24 -5.04 119.66 108.98 3e66 s GLN 1985Ca 0.65 -0.00 0.04 0.00 -1.82 0.00 0.00 55.36 54.23 3e66 s GLN 1985Cb -0.54 0.00 -0.02 0.00 -1.09 0.00 0.00 33.01 31.36 3e66 s GLN 1985CO 0.57 -0.00 -0.17 1.41 -1.32 0.00 0.00 175.29 175.77 3e66 s MET 1986N -1.60 2.59 -0.03 9.60 -2.45 -1.26 -0.41 119.30 125.75 3e66 s MET 1986Ca 0.11 -0.76 0.04 0.00 -1.25 0.00 0.00 55.69 53.84 3e66 s MET 1986Cb -0.01 -2.34 -0.01 0.00 1.25 0.00 0.00 34.83 33.72 3e66 s MET 1986CO -0.05 0.51 -0.16 0.08 1.05 0.00 0.00 175.02 176.46 3e66 s VAL 1987N -0.46 1.28 0.01 10.11 1.01 -0.34 -4.98 120.40 127.03 3e66 s VAL 1987Ca 0.05 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.39 3e66 s VAL 1987Cb -0.12 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 3e66 s VAL 1987CO 0.02 0.37 -0.02 -0.76 0.00 0.00 0.00 175.10 174.71 3e66 s LEU 1988N -0.14 3.43 0.15 3.92 1.43 -1.26 -0.74 118.68 125.46 3e66 s LEU 1988Ca 0.01 -0.06 -0.06 0.00 -1.03 0.00 0.00 54.13 52.99 3e66 s LEU 1988Cb -0.09 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 3e66 s LEU 1988CO 0.01 0.27 0.21 -0.36 0.23 0.00 0.00 176.35 176.70 3e66 s PHE 1989N -1.09 0.55 -0.38 0.29 0.40 -0.59 -5.00 117.98 112.16 3e66 s PHE 1989Ca 0.20 -0.92 -0.05 0.00 -0.60 0.00 0.00 56.93 55.55 3e66 s PHE 1989Cb -0.11 -0.20 0.08 0.00 0.51 0.00 0.00 43.02 43.30 3e66 s PHE 1989CO 0.10 -0.65 0.17 1.21 0.70 0.00 0.00 175.22 176.75 3e66 s ASN 1990N -2.99 5.34 0.04 1.36 3.84 -1.26 -0.12 114.94 121.14 3e66 s ASN 1990Ca 0.19 -1.56 0.09 0.00 0.21 0.00 0.00 52.86 51.79 3e66 s ASN 1990Cb 0.05 -1.87 0.38 0.00 -0.55 0.00 0.00 41.25 39.26 3e66 s ASN 1990CO 0.01 -0.45 1.27 0.00 -2.79 0.00 0.00 177.10 175.13 3e66 n ILE 1991N 4.75 1.48 -0.36 -5.21 3.06 0.37 -0.91 119.36 122.55 3e66 n ILE 1991Ca -0.09 0.40 0.11 0.00 -2.50 0.00 0.00 62.75 60.68 3e66 n ILE 1991Cb 0.43 -1.30 0.31 0.00 0.54 0.00 0.00 39.64 39.62 3e66 n ILE 1991CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 3e66 n TYR 1992N -1.59 0.94 0.00 9.51 0.53 -1.26 -4.94 117.16 120.34 3e66 n TYR 1992Ca 0.01 -0.50 0.00 0.00 -1.02 0.00 0.00 57.90 56.39 3e66 n TYR 1992Cb 0.08 -0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.39 3e66 n TYR 1992CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 3e66 n ASP 1993N 1.55 0.00 -1.16 7.72 8.00 -0.08 -0.73 116.55 131.85 3e66 n ASP 1993Ca 0.23 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.81 3e66 n ASP 1993Cb 0.61 0.00 0.29 0.00 -0.02 0.00 0.00 41.12 41.99 3e66 n ASP 1993CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3e66 n ASP 1994N 2.97 4.22 -0.19 -2.24 3.85 -1.26 -4.70 116.55 119.19 3e66 n ASP 1994Ca 0.00 -2.71 0.12 0.00 -0.71 0.00 0.00 54.79 51.49 3e66 n ASP 1994Cb 0.00 -0.52 0.43 0.00 -1.35 0.00 0.00 41.12 39.68 3e66 n ASP 1994CO 0.00 0.00 0.00 -0.50 -1.01 0.00 0.00 177.20 175.69 3e66 h TRP 1995N 2.68 0.64 0.00 2.11 6.55 -1.34 -1.93 115.95 124.66 3e66 h TRP 1995Ca 0.00 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.86 3e66 h TRP 1995Cb 1.41 -0.20 0.00 0.00 -0.86 0.00 0.00 29.16 29.51 3e66 h TRP 1995CO 0.61 0.27 0.00 1.28 -1.05 0.00 0.00 178.44 179.55 3e66 n LEU 1996N -4.50 0.43 0.22 -4.49 4.77 -1.26 -0.51 117.00 111.66 3e66 n LEU 1996Ca 0.14 0.68 0.10 0.00 -0.03 0.00 0.00 56.01 56.90 3e66 n LEU 1996Cb 0.42 -0.72 0.47 0.00 -2.33 0.00 0.00 43.42 41.27 3e66 n LEU 1996CO 0.32 -0.78 0.81 0.44 -1.33 0.00 0.00 177.39 176.86 3e66 h ASP 1997N 0.00 0.00 0.00 -1.43 3.32 -1.73 -3.35 116.42 113.23 3e66 h ASP 1997Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3e66 h ASP 1997Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3e66 h ASP 1997CO 0.00 0.22 -0.98 0.54 -1.72 0.00 0.00 179.24 177.29 3e66 n ARG 1998N -3.39 0.24 -4.37 3.56 1.74 0.34 -5.08 116.66 109.70 3e66 n ARG 1998Ca 0.00 -0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.89 3e66 n ARG 1998Cb 0.42 -0.99 -0.10 0.00 -1.02 0.00 0.00 32.46 30.76 3e66 n ARG 1998CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 3e66 s ILE 1999N -1.99 1.06 0.79 0.55 -4.36 -0.08 -5.15 121.20 112.02 3e66 s ILE 1999Ca -0.00 -2.03 -0.12 0.00 -0.26 0.00 0.00 60.65 58.24 3e66 s ILE 1999Cb 0.00 -2.52 0.07 0.00 1.25 0.00 0.00 42.46 41.26 3e66 s ILE 1999CO 0.02 -0.18 1.14 -0.94 0.24 0.00 0.00 174.94 175.21 3e66 s SER 2000N -3.37 4.61 0.22 4.36 1.04 -1.26 -4.30 113.70 115.00 3e66 s SER 2000Ca 0.32 0.99 -0.06 0.00 0.48 0.00 0.00 55.95 57.68 3e66 s SER 2000Cb 0.07 -1.61 0.19 0.00 0.10 0.00 0.00 66.02 64.76 3e66 s SER 2000CO 0.12 -1.86 1.71 0.28 0.98 0.00 0.00 173.24 174.47 3e66 h SER 2001N -1.02 0.95 -0.51 7.02 0.02 -1.93 0.14 113.55 118.23 3e66 h SER 2001Ca -0.47 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.25 3e66 h SER 2001Cb 1.30 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.56 3e66 h SER 2001CO 0.64 0.98 0.32 0.22 -1.14 0.00 0.00 176.83 177.84 3e66 h TYR 2002N 0.92 0.66 -0.33 3.45 3.20 -1.93 0.17 116.97 123.10 3e66 h TYR 2002Ca 0.18 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.93 3e66 h TYR 2002Cb 0.47 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 3e66 h TYR 2002CO 0.03 0.44 -0.31 1.15 -1.64 0.00 0.00 178.16 177.83 3e66 h THR 2003N 0.68 1.28 -0.57 1.81 2.02 -1.83 -2.19 112.91 114.12 3e66 h THR 2003Ca 0.18 -1.44 -0.10 0.00 0.77 0.00 0.00 66.41 65.83 3e66 h THR 2003Cb -0.04 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 3e66 h THR 2003CO -0.04 0.47 -0.02 0.00 0.37 0.00 0.00 175.52 176.30 3e66 h ALA 2004N 1.05 0.88 -0.61 6.16 0.00 -0.14 -1.53 119.26 125.08 3e66 h ALA 2004Ca 0.07 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 3e66 h ALA 2004Cb 0.82 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3e66 h ALA 2004CO 0.07 0.65 0.03 0.35 0.00 0.00 0.00 179.25 180.36 3e66 h PHE 2005N 0.92 1.12 -0.62 0.00 3.57 -0.57 -0.31 116.94 121.05 3e66 h PHE 2005Ca 0.16 -0.18 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 3e66 h PHE 2005Cb 0.56 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 3e66 h PHE 2005CO 0.04 0.97 0.31 0.77 -2.23 0.00 0.00 178.31 178.18 3e66 h SER 2006N 0.96 0.79 -0.34 0.41 0.02 -1.12 -1.01 113.55 113.26 3e66 h SER 2006Ca 0.18 -0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 3e66 h SER 2006Cb 0.51 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 3e66 h SER 2006CO 0.02 0.69 0.06 -0.09 -1.14 0.00 0.00 176.83 176.37 3e66 h ARG 2007N 0.84 0.57 -0.09 3.45 2.43 -0.87 -1.78 114.38 118.93 3e66 h ARG 2007Ca 0.21 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3e66 h ARG 2007Cb 0.09 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3e66 h ARG 2007CO -0.03 0.64 0.05 1.25 -1.51 0.00 0.00 179.97 180.37 3e66 h LEU 2008N 0.40 0.12 -1.16 3.80 5.85 -0.90 -1.38 115.31 122.04 3e66 h LEU 2008Ca 0.11 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 3e66 h LEU 2008Cb 0.34 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 3e66 h LEU 2008CO 0.01 0.16 0.09 0.71 -0.34 0.00 0.00 178.44 179.07 3e66 h THR 2009N 0.06 1.20 -0.22 1.05 1.35 -1.18 -0.34 112.91 114.84 3e66 h THR 2009Ca 0.03 -0.75 -0.02 0.00 -0.55 0.00 0.00 66.41 65.12 3e66 h THR 2009Cb 0.07 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.26 3e66 h THR 2009CO -0.01 0.27 0.06 0.25 -0.25 0.00 0.00 175.52 175.84 3e66 h LEU 2010N 0.66 0.33 -0.11 3.87 5.85 -1.11 -0.19 115.31 124.60 3e66 h LEU 2010Ca 0.15 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 3e66 h LEU 2010Cb 0.28 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3e66 h LEU 2010CO 0.00 0.47 0.07 -0.07 -0.34 0.00 0.00 178.44 178.57 3e66 h LEU 2011N 0.18 0.14 -0.85 2.25 3.38 -0.76 -1.76 115.31 117.88 3e66 h LEU 2011Ca 0.07 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 3e66 h LEU 2011Cb 0.26 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3e66 h LEU 2011CO 0.00 0.15 0.14 -0.07 0.09 0.00 0.00 178.44 178.75 3e66 h LEU 2012N 0.12 0.94 -0.68 1.67 3.38 -1.04 -1.14 115.31 118.54 3e66 h LEU 2012Ca 0.04 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 3e66 h LEU 2012Cb 0.04 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 3e66 h LEU 2012CO -0.01 0.92 0.29 -0.09 0.09 0.00 0.00 178.44 179.63 3e66 h ARG 2013N 0.95 1.02 -0.48 1.13 9.65 -0.82 -0.41 114.38 125.41 3e66 h ARG 2013Ca 0.20 -0.18 -0.07 0.00 -1.10 0.00 0.00 59.98 58.84 3e66 h ARG 2013Cb 0.35 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 3e66 h ARG 2013CO 0.00 0.84 0.04 0.00 2.80 0.00 0.00 179.97 183.65 3e66 h ALA 2014N 1.13 0.64 -0.77 2.80 0.00 -1.04 0.57 119.26 122.59 3e66 h ALA 2014Ca 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3e66 h ALA 2014Cb 0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3e66 h ALA 2014CO -0.02 0.41 0.49 -0.07 0.00 0.00 0.00 179.25 180.06 3e66 h LEU 2015N 0.69 0.89 -0.41 0.00 3.38 -0.96 -0.29 115.31 118.62 3e66 h LEU 2015Ca 0.14 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 3e66 h LEU 2015Cb 0.45 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3e66 h LEU 2015CO 0.02 0.66 -0.80 0.50 0.09 0.00 0.00 178.44 178.91 3e66 h LYS 2016N 1.05 0.11 0.03 1.13 3.64 -0.75 -2.28 116.57 119.50 3e66 h LYS 2016Ca 0.28 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 3e66 h LYS 2016Cb -0.09 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3e66 h LYS 2016CO -0.06 0.85 -0.01 1.15 -2.27 0.00 0.00 179.45 179.10 3e66 h THR 2017N 0.07 1.40 -2.15 1.00 2.02 -0.18 -3.42 112.91 111.64 3e66 h THR 2017Ca -0.02 -1.72 -0.46 0.00 0.77 0.00 0.00 66.41 64.98 3e66 h THR 2017Cb 1.39 2.49 -0.34 0.00 -1.74 0.00 0.00 68.15 69.96 3e66 h THR 2017CO 0.11 0.42 -0.77 0.21 0.37 0.00 0.00 175.52 175.86 3e66 s ASN 2018N -5.90 1.57 0.19 4.18 3.84 -0.18 -5.02 114.94 113.61 3e66 s ASN 2018Ca -0.16 -2.04 -0.12 0.00 0.21 0.00 0.00 52.86 50.75 3e66 s ASN 2018Cb -0.01 0.19 0.18 0.00 -0.55 0.00 0.00 41.25 41.06 3e66 s ASN 2018CO 0.60 -0.24 1.75 -0.08 -2.79 0.00 0.00 177.10 176.34 3e66 h GLU 2019N 6.66 0.37 0.16 0.43 4.81 -1.54 -0.62 114.58 124.84 3e66 h GLU 2019Ca 0.09 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.32 3e66 h GLU 2019Cb 1.01 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 3e66 h GLU 2019CO 0.23 0.24 -0.34 0.93 -0.73 0.00 0.00 179.01 179.35 3e66 h GLU 2020N 0.38 -0.57 -0.38 1.92 3.07 -1.93 -1.11 114.58 115.96 3e66 h GLU 2020Ca 0.25 0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 59.05 3e66 h GLU 2020Cb 0.25 0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.28 3e66 h GLU 2020CO -0.24 -0.38 -0.17 0.77 -1.40 0.00 0.00 179.01 177.59 3e66 h SER 2021N -0.59 0.71 -0.35 1.42 0.02 -1.91 -1.93 113.55 110.92 3e66 h SER 2021Ca 0.02 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.70 3e66 h SER 2021Cb 0.61 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3e66 h SER 2021CO -0.18 0.89 0.07 0.00 -1.14 0.00 0.00 176.83 176.47 3e66 h ALA 2022N 1.17 0.47 -0.10 3.77 0.00 -0.93 -0.79 119.26 122.85 3e66 h ALA 2022Ca 0.10 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 3e66 h ALA 2022Cb 0.64 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3e66 h ALA 2022CO 0.05 0.16 -0.23 0.87 0.00 0.00 0.00 179.25 180.09 3e66 h LYS 2023N 0.42 0.17 -0.44 0.00 1.57 -1.11 -1.36 116.57 115.82 3e66 h LYS 2023Ca 0.11 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 3e66 h LYS 2023Cb 0.34 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 3e66 h LYS 2023CO 0.01 0.40 0.10 1.98 -0.57 0.00 0.00 179.45 181.36 3e66 h MET 2024N 0.15 0.71 0.12 3.15 4.05 -0.92 0.18 114.93 122.37 3e66 h MET 2024Ca 0.03 -0.18 -0.01 0.00 -0.28 0.00 0.00 59.70 59.27 3e66 h MET 2024Cb 0.50 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 3e66 h MET 2024CO 0.03 0.72 -0.06 0.82 0.23 0.00 0.00 176.91 178.66 3e66 h ILE 2025N 0.58 0.90 -0.37 1.77 1.08 -0.51 -2.75 117.51 118.21 3e66 h ILE 2025Ca 0.14 -0.05 -0.02 0.00 -0.39 0.00 0.00 64.86 64.54 3e66 h ILE 2025Cb 0.33 0.94 -0.02 0.00 -3.07 0.00 0.00 36.82 35.00 3e66 h ILE 2025CO 0.00 0.01 0.16 -0.07 -0.69 0.00 0.00 178.15 177.57 3e66 h LEU 2026N -0.18 0.46 -6.92 1.44 3.38 -1.05 -3.31 115.31 109.13 3e66 h LEU 2026Ca -0.02 -0.04 -0.66 0.00 0.09 0.00 0.00 57.88 57.25 3e66 h LEU 2026Cb 0.14 -0.12 -0.38 0.00 0.09 0.00 0.00 40.66 40.39 3e66 h LEU 2026CO 0.03 0.41 -0.27 0.18 0.09 0.00 0.00 178.44 178.88 3e66 n LEU 2027N -4.40 3.99 0.00 1.67 4.77 0.62 -4.68 117.00 118.97 3e66 n LEU 2027Ca 0.02 -5.25 0.00 0.00 -0.03 0.00 0.00 56.01 50.76 3e66 n LEU 2027Cb 0.13 -0.91 0.00 0.00 -2.33 0.00 0.00 43.42 40.31 3e66 n LEU 2027CO 0.37 1.76 0.08 -1.54 -1.33 0.00 0.00 177.39 176.72 3e66 n SER 2028N 1.73 0.30 -3.22 -1.43 3.41 -1.19 -4.74 113.62 108.47 3e66 n SER 2028Ca 0.24 -0.78 -0.21 0.00 -0.26 0.00 0.00 58.87 57.85 3e66 n SER 2028Cb 0.37 0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 64.36 3e66 n SER 2028CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3e66 n ASP 2029N -0.11 -1.26 0.09 4.04 -0.08 -1.26 -5.00 116.55 112.96 3e66 n ASP 2029Ca 0.00 -2.52 0.04 0.00 -1.51 0.00 0.00 54.79 50.80 3e66 n ASP 2029Cb 0.11 0.05 0.20 0.00 2.34 0.00 0.00 41.12 43.82 3e66 n ASP 2029CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 3e66 n PRO 2030N 2.84 0.05 0.20 -0.67 -0.02 -1.26 -0.60 135.00 135.54 3e66 n PRO 2030Ca 0.27 0.45 0.06 0.00 -2.02 0.00 0.00 63.50 62.26 3e66 n PRO 2030Cb 0.50 -1.92 0.39 0.00 -0.02 0.00 0.00 33.50 32.46 3e66 n PRO 2030CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3e66 h THR 2031N 0.00 0.90 -3.30 3.45 1.35 -2.02 -3.37 112.91 109.91 3e66 h THR 2031Ca 0.00 -1.36 -0.66 0.00 -0.55 0.00 0.00 66.41 63.84 3e66 h THR 2031Cb 0.51 1.82 -0.16 0.00 -1.73 0.00 0.00 68.15 68.58 3e66 h THR 2031CO 0.00 0.34 0.16 -0.63 -0.25 0.00 0.00 175.52 175.14 3e66 s ILE 2032N -3.77 4.77 0.41 6.82 1.01 0.24 -5.04 121.20 125.64 3e66 s ILE 2032Ca -0.01 -0.23 0.08 0.00 0.00 0.00 0.00 60.65 60.49 3e66 s ILE 2032Cb 0.12 -4.33 0.00 0.00 0.01 0.00 0.00 42.46 38.26 3e66 s ILE 2032CO 0.68 -0.83 0.52 0.42 0.00 0.00 0.00 174.94 175.73 3e66 s THR 2033N 2.92 2.99 -0.36 2.92 -4.23 -1.26 -4.73 115.64 113.89 3e66 s THR 2033Ca 0.19 -1.08 -0.12 0.00 -1.18 0.00 0.00 61.69 59.51 3e66 s THR 2033Cb -0.17 -3.02 0.01 0.00 1.34 0.00 0.00 72.50 70.66 3e66 s THR 2033CO 0.15 -0.01 0.22 -0.63 -0.54 0.00 0.00 174.62 173.81 3e66 s ILE 2034N -2.37 4.84 0.61 2.99 1.01 -1.26 -0.96 121.20 126.06 3e66 s ILE 2034Ca 0.53 -0.64 -0.18 0.00 0.00 0.00 0.00 60.65 60.37 3e66 s ILE 2034Cb -0.08 -3.62 -0.06 0.00 0.01 0.00 0.00 42.46 38.70 3e66 s ILE 2034CO 0.32 -0.16 0.68 0.29 0.00 0.00 0.00 174.94 176.07 3e66 n LYS 2035N 5.05 0.59 -0.08 2.79 4.76 -1.26 -4.83 118.16 125.18 3e66 n LYS 2035Ca -0.12 0.24 0.12 0.00 -2.87 0.00 0.00 58.31 55.68 3e66 n LYS 2035Cb 0.47 -1.88 0.51 0.00 -1.84 0.00 0.00 35.03 32.29 3e66 n LYS 2035CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 3e66 h SER 2036N 0.19 0.35 -0.55 4.39 4.64 -1.99 -1.13 113.55 119.46 3e66 h SER 2036Ca -0.47 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3e66 h SER 2036Cb 1.38 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3e66 h SER 2036CO 0.47 0.21 0.00 0.00 -0.87 0.00 0.00 176.83 176.64 3e66 n TYR 2037N -4.47 1.05 -4.50 4.77 0.18 -1.26 -4.95 117.16 107.99 3e66 n TYR 2037Ca 0.10 -0.45 -0.28 0.00 1.88 0.00 0.00 57.90 59.15 3e66 n TYR 2037Cb 0.39 -0.13 -0.09 0.00 -0.38 0.00 0.00 39.34 39.13 3e66 n TYR 2037CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 3e66 s HIS 2038N -1.58 2.36 -0.07 -3.48 3.76 -0.43 -4.83 115.29 111.03 3e66 s HIS 2038Ca 0.40 -0.72 0.07 0.00 -0.15 0.00 0.00 55.06 54.66 3e66 s HIS 2038Cb 0.24 -1.79 -0.10 0.00 1.11 0.00 0.00 32.58 32.04 3e66 s HIS 2038CO 0.22 0.30 0.05 1.28 -0.85 0.00 0.00 174.74 175.73 3e66 n LEU 2039N -1.13 0.00 -4.64 0.89 4.77 -1.26 -4.76 117.00 110.86 3e66 n LEU 2039Ca -0.07 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.68 3e66 n LEU 2039Cb 0.66 0.16 -0.07 0.00 -2.33 0.00 0.00 43.42 41.84 3e66 n LEU 2039CO 0.45 0.16 -0.33 0.26 -1.33 0.00 0.00 177.39 176.61 3e66 s TRP 2040N -2.23 2.70 0.55 -1.77 0.52 -1.26 -4.90 118.94 112.56 3e66 s TRP 2040Ca -0.04 -0.22 -0.20 0.00 0.02 0.00 0.00 56.10 55.67 3e66 s TRP 2040Cb 0.03 -1.21 -0.05 0.00 -1.15 0.00 0.00 33.47 31.09 3e66 s TRP 2040CO 0.31 0.61 1.16 -1.25 0.02 0.00 0.00 176.95 177.80 3e66 s PRO 2041N -3.60 3.26 -0.92 4.98 0.04 -1.26 -4.49 135.00 133.02 3e66 s PRO 2041Ca 0.31 1.71 -0.06 0.00 0.04 0.00 0.00 61.00 63.00 3e66 s PRO 2041Cb -0.07 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.38 3e66 s PRO 2041CO 0.20 -0.94 2.29 0.43 0.04 0.00 0.00 177.00 179.02 3e66 n SER 2042N -1.31 5.35 -4.77 6.66 7.64 -0.13 -4.93 113.62 122.13 3e66 n SER 2042Ca 0.12 -2.34 -0.37 0.00 1.01 0.00 0.00 58.87 57.29 3e66 n SER 2042Cb 0.50 -1.15 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 3e66 n SER 2042CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3e66 s PHE 2043N 3.00 2.74 0.95 1.43 2.99 -1.26 -4.88 117.98 122.96 3e66 s PHE 2043Ca 0.45 1.50 -0.15 0.00 0.00 0.00 0.00 56.93 58.72 3e66 s PHE 2043Cb 0.13 -3.48 0.18 0.00 0.00 0.00 0.00 43.02 39.84 3e66 s PHE 2043CO -0.03 -1.83 1.26 0.95 -0.00 0.00 0.00 175.22 175.57 3e66 s THR 2044N -1.48 1.96 0.18 0.64 -4.23 -1.26 -4.79 115.64 106.66 3e66 s THR 2044Ca 0.65 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 61.05 3e66 s THR 2044Cb -0.32 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 70.67 3e66 s THR 2044CO 0.38 0.00 1.71 0.44 -0.54 0.00 0.00 174.62 176.62 3e66 h ASP 2045N -1.60 0.92 -0.47 3.99 5.19 -2.00 -0.89 116.42 121.55 3e66 h ASP 2045Ca -0.45 -0.20 -0.08 0.00 -0.62 0.00 0.00 57.03 55.68 3e66 h ASP 2045Cb 1.27 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 40.51 3e66 h ASP 2045CO 0.45 0.88 0.01 -0.33 -3.12 0.00 0.00 179.24 177.12 3e66 h GLU 2046N 0.91 0.89 -0.31 3.56 3.07 -2.01 -2.78 114.58 117.92 3e66 h GLU 2046Ca 0.21 -0.25 -0.12 0.00 -0.50 0.00 0.00 59.36 58.69 3e66 h GLU 2046Cb 0.28 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.08 3e66 h GLU 2046CO -0.01 0.88 -0.32 1.96 -1.40 0.00 0.00 179.01 180.12 3e66 h GLN 2047N 0.83 0.66 -0.61 2.33 4.20 -1.83 -2.82 115.11 117.87 3e66 h GLN 2047Ca 0.16 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 3e66 h GLN 2047Cb 0.48 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.22 3e66 h GLN 2047CO 0.02 0.90 0.36 -1.49 -0.67 0.00 0.00 178.83 177.95 3e66 h TRP 2048N 0.56 0.79 -0.49 2.96 -0.00 -0.91 0.15 115.95 119.02 3e66 h TRP 2048Ca 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.94 3e66 h TRP 2048Cb 0.82 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 29.70 3e66 h TRP 2048CO 0.04 0.54 0.26 0.82 -0.00 0.00 0.00 178.44 180.10 3e66 h ILE 2049N 0.83 1.17 -0.36 1.49 2.04 -1.26 0.36 117.51 121.79 3e66 h ILE 2049Ca 0.22 -0.44 -0.11 0.00 1.00 0.00 0.00 64.86 65.53 3e66 h ILE 2049Cb -0.02 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3e66 h ILE 2049CO -0.04 0.18 -0.19 0.74 0.00 0.00 0.00 178.15 178.84 3e66 h THR 2050N 0.64 1.29 0.03 -0.27 2.02 -1.24 -1.62 112.91 113.77 3e66 h THR 2050Ca 0.17 -1.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.03 3e66 h THR 2050Cb 0.06 1.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3e66 h THR 2050CO -0.03 0.43 -0.02 0.40 0.37 0.00 0.00 175.52 176.68 3e66 h ILE 2051N 0.55 1.01 -0.03 3.11 1.08 -0.45 -1.10 117.51 121.67 3e66 h ILE 2051Ca 0.08 -0.12 -0.03 0.00 -0.39 0.00 0.00 64.86 64.39 3e66 h ILE 2051Cb 0.74 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 35.57 3e66 h ILE 2051CO 0.06 0.03 -0.14 -0.33 -0.69 0.00 0.00 178.15 177.08 3e66 h GLU 2052N -0.10 0.05 -0.39 2.37 5.08 -0.26 -0.52 114.58 120.80 3e66 h GLU 2052Ca -0.00 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 3e66 h GLU 2052Cb 0.09 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3e66 h GLU 2052CO 0.01 0.19 -0.15 1.03 -1.00 0.00 0.00 179.01 179.08 3e66 h SER 2053N 0.05 0.81 -0.33 1.42 0.87 -0.86 -1.77 113.55 113.73 3e66 h SER 2053Ca 0.01 -0.39 -0.13 0.00 -1.23 0.00 0.00 61.79 60.05 3e66 h SER 2053Cb 0.28 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 3e66 h SER 2053CO 0.02 1.02 -0.31 1.56 -0.53 0.00 0.00 176.83 178.59 3e66 h GLN 2054N 0.60 0.80 -0.67 2.24 4.20 -0.56 -1.28 115.11 120.44 3e66 h GLN 2054Ca 0.09 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.39 3e66 h GLN 2054Cb 0.70 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.45 3e66 h GLN 2054CO 0.05 1.05 0.42 1.98 -0.67 0.00 0.00 178.83 181.66 3e66 h MET 2055N 0.58 0.90 -0.64 1.46 4.05 -1.11 0.03 114.93 120.20 3e66 h MET 2055Ca 0.06 -0.07 -0.06 0.00 -0.28 0.00 0.00 59.70 59.34 3e66 h MET 2055Cb 0.89 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 31.47 3e66 h MET 2055CO 0.08 0.63 0.16 -0.09 0.23 0.00 0.00 176.91 177.91 3e66 h ARG 2056N 0.91 1.03 -0.24 0.39 2.43 -1.22 -2.31 114.38 115.37 3e66 h ARG 2056Ca 0.24 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3e66 h ARG 2056Cb -0.06 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 3e66 h ARG 2056CO -0.05 0.93 0.16 -0.44 -1.51 0.00 0.00 179.97 179.06 3e66 h ASP 2057N 0.95 0.28 -0.27 -3.80 3.32 -0.44 -0.28 116.42 116.18 3e66 h ASP 2057Ca 0.20 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.31 3e66 h ASP 2057Cb 0.36 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.77 3e66 h ASP 2057CO 0.00 0.20 -0.18 0.25 -1.72 0.00 0.00 179.24 177.79 3e66 h LEU 2058N 0.33 -0.60 0.40 1.55 6.46 -0.82 0.18 115.31 122.81 3e66 h LEU 2058Ca 0.09 0.12 -0.02 0.00 -0.12 0.00 0.00 57.88 57.95 3e66 h LEU 2058Cb -0.04 0.30 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 3e66 h LEU 2058CO -0.02 -0.22 -0.19 0.40 -0.62 0.00 0.00 178.44 177.79 3e66 h ILE 2059N -0.16 0.61 -0.25 4.05 2.04 -1.16 -2.85 117.51 119.78 3e66 h ILE 2059Ca 0.15 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 3e66 h ILE 2059Cb 0.39 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3e66 h ILE 2059CO -0.37 0.04 -0.15 -0.07 0.00 0.00 0.00 178.15 177.60 3e66 h LEU 2060N -0.65 0.41 -0.21 1.44 3.38 -0.88 -1.41 115.31 117.40 3e66 h LEU 2060Ca -0.05 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3e66 h LEU 2060Cb 0.47 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3e66 h LEU 2060CO 0.09 0.59 0.13 0.74 0.09 0.00 0.00 178.44 180.08 3e66 h THR 2061N 0.39 1.07 -0.20 0.22 2.02 -0.65 0.33 112.91 116.09 3e66 h THR 2061Ca 0.07 -0.15 0.04 0.00 0.77 0.00 0.00 66.41 67.14 3e66 h THR 2061Cb 0.50 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 3e66 h THR 2061CO 0.03 0.07 -0.05 -0.08 0.37 0.00 0.00 175.52 175.85 3e66 h GLU 2062N 0.27 -0.00 -0.27 6.66 4.57 -1.23 -0.71 114.58 123.87 3e66 h GLU 2062Ca 0.07 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.29 3e66 h GLU 2062Cb -0.01 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 3e66 h GLU 2062CO -0.02 -0.00 0.04 -0.92 -1.18 0.00 0.00 179.01 176.94 3e66 h TYR 2063N -0.01 0.07 -0.69 0.92 3.20 -0.80 -1.37 116.97 118.29 3e66 h TYR 2063Ca 0.10 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.01 3e66 h TYR 2063Cb 0.15 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.39 3e66 h TYR 2063CO -0.22 0.01 0.44 0.78 -1.64 0.00 0.00 178.16 177.53 3e66 h GLY 2064N 0.14 1.00 0.86 1.82 0.00 0.16 -0.51 103.07 106.53 3e66 h GLY 2064Ca 0.12 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 3e66 h GLY 2064CO -0.17 0.29 0.05 3.21 0.00 0.00 0.00 176.54 179.92 3e66 h ARG 2065N 0.87 0.35 -0.36 4.80 3.08 -0.83 0.32 114.38 122.61 3e66 h ARG 2065Ca 0.28 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 3e66 h ARG 2065Cb -0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3e66 h ARG 2065CO -0.10 0.48 0.14 -0.22 -1.07 0.00 0.00 179.97 179.21 3e66 h LYS 2066N 0.17 0.54 -0.02 0.04 3.64 -0.98 -3.18 116.57 116.78 3e66 h LYS 2066Ca 0.07 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3e66 h LYS 2066Cb 0.29 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3e66 h LYS 2066CO 0.00 0.53 -0.03 0.66 -2.27 0.00 0.00 179.45 178.34 3e66 n TYR 2067N -4.68 0.00 -3.65 1.91 4.02 -0.23 -4.98 117.16 109.55 3e66 n TYR 2067Ca -0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.61 3e66 n TYR 2067Cb 0.14 -0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.50 3e66 n TYR 2067CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3e66 n ASN 2068N 0.90 -4.54 -4.25 7.72 2.85 0.11 -5.00 115.26 113.05 3e66 n ASN 2068Ca 0.15 -0.95 -0.17 0.00 -0.11 0.00 0.00 54.58 53.50 3e66 n ASN 2068Cb 0.52 -3.69 -0.11 0.00 1.24 0.00 0.00 39.78 37.75 3e66 n ASN 2068CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 3e66 s VAL 2069N -3.52 1.32 -0.70 3.44 -7.23 -1.08 -5.06 120.40 107.57 3e66 s VAL 2069Ca 0.37 -1.83 -0.27 0.00 -1.81 0.00 0.00 61.98 58.44 3e66 s VAL 2069Cb -0.12 -1.64 0.03 0.00 0.56 0.00 0.00 36.38 35.22 3e66 s VAL 2069CO 0.84 -0.51 1.24 0.21 -0.31 0.00 0.00 175.10 176.58 3e66 s ASN 2070N -2.68 6.22 0.27 4.85 2.47 -1.26 -4.65 114.94 120.17 3e66 s ASN 2070Ca 0.12 -0.35 0.00 0.00 0.42 0.00 0.00 52.86 53.05 3e66 s ASN 2070Cb -0.03 -2.55 0.63 0.00 -1.45 0.00 0.00 41.25 37.85 3e66 s ASN 2070CO 0.03 -1.74 1.68 0.40 -3.72 0.00 0.00 177.10 173.75 3e66 h ILE 2071N 6.05 0.46 0.00 -5.21 1.08 -1.95 -0.44 117.51 117.51 3e66 h ILE 2071Ca -0.27 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.08 3e66 h ILE 2071Cb 1.05 0.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.91 3e66 h ILE 2071CO 1.25 0.06 0.00 -1.20 -0.69 0.00 0.00 178.15 177.57 3e66 n SER 2072N -5.11 0.00 -0.57 1.72 7.64 -1.26 -1.43 113.62 114.60 3e66 n SER 2072Ca 0.19 0.27 0.09 0.00 1.01 0.00 0.00 58.87 60.44 3e66 n SER 2072Cb 0.59 -0.34 0.03 0.00 -1.01 0.00 0.00 64.21 63.48 3e66 n SER 2072CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3e66 n ALA 2073N -1.34 2.95 -1.91 -0.43 0.00 -0.18 -4.96 120.51 114.63 3e66 n ALA 2073Ca 0.03 -0.61 -0.41 0.00 0.00 0.00 0.00 53.44 52.45 3e66 n ALA 2073Cb 0.06 -0.65 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 3e66 n ALA 2073CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3e66 s LEU 2074N -1.94 4.48 0.77 0.00 1.43 -0.52 -5.02 118.68 117.88 3e66 s LEU 2074Ca 0.18 2.33 -0.12 0.00 -1.03 0.00 0.00 54.13 55.50 3e66 s LEU 2074Cb 0.15 -3.62 0.06 0.00 0.03 0.00 0.00 46.19 42.81 3e66 s LEU 2074CO 0.37 -0.34 1.11 0.42 0.23 0.00 0.00 176.35 178.14 3e66 s THR 2075N -0.55 3.02 0.22 5.49 -4.23 -1.26 -4.89 115.64 113.44 3e66 s THR 2075Ca 0.50 0.33 -0.09 0.00 -1.18 0.00 0.00 61.69 61.25 3e66 s THR 2075Cb -0.34 -3.19 0.17 0.00 1.34 0.00 0.00 72.50 70.48 3e66 s THR 2075CO 0.41 -0.43 1.85 1.56 -0.54 0.00 0.00 174.62 177.46 3e66 h GLN 2076N -0.96 1.11 -0.56 3.99 1.08 -1.99 -2.02 115.11 115.76 3e66 h GLN 2076Ca -0.46 -0.11 -0.06 0.00 -1.45 0.00 0.00 58.65 56.57 3e66 h GLN 2076Cb 1.27 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 28.45 3e66 h GLN 2076CO 0.62 0.80 0.11 1.15 -0.95 0.00 0.00 178.83 180.55 3e66 h THR 2077N 1.12 1.24 -0.56 -0.54 2.02 -1.99 -0.29 112.91 113.91 3e66 h THR 2077Ca 0.29 -0.89 -0.10 0.00 0.77 0.00 0.00 66.41 66.48 3e66 h THR 2077Cb -0.02 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 3e66 h THR 2077CO -0.05 0.33 -0.04 -0.33 0.37 0.00 0.00 175.52 175.80 3e66 h GLU 2078N 0.84 1.02 -0.41 6.66 5.08 -1.82 -0.55 114.58 125.40 3e66 h GLU 2078Ca 0.18 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 3e66 h GLU 2078Cb 0.34 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 3e66 h GLU 2078CO 0.00 1.03 0.18 0.82 -1.00 0.00 0.00 179.01 180.05 3e66 h ILE 2079N 0.90 1.19 -0.76 3.13 2.04 -0.99 -1.74 117.51 121.28 3e66 h ILE 2079Ca 0.15 -0.55 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 3e66 h ILE 2079Cb 0.59 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 3e66 h ILE 2079CO 0.04 0.20 0.43 0.50 0.00 0.00 0.00 178.15 179.32 3e66 h LYS 2080N 0.52 1.05 -0.54 2.37 1.63 -0.83 -1.49 116.57 119.28 3e66 h LYS 2080Ca 0.14 -0.10 -0.06 0.00 -0.85 0.00 0.00 60.65 59.77 3e66 h LYS 2080Cb 0.15 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 3e66 h LYS 2080CO -0.01 0.75 0.09 -0.44 -3.45 0.00 0.00 179.45 176.39 3e66 h ASP 2081N 1.06 0.80 -0.47 4.20 5.19 -0.59 -0.19 116.42 126.42 3e66 h ASP 2081Ca 0.27 -0.16 -0.12 0.00 -0.62 0.00 0.00 57.03 56.40 3e66 h ASP 2081Cb -0.00 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.28 3e66 h ASP 2081CO -0.05 0.81 -0.17 0.40 -3.12 0.00 0.00 179.24 177.12 3e66 h ILE 2082N 0.81 1.27 -0.05 0.35 2.04 -0.55 0.11 117.51 121.48 3e66 h ILE 2082Ca 0.17 -1.31 -0.01 0.00 1.00 0.00 0.00 64.86 64.71 3e66 h ILE 2082Cb 0.35 1.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3e66 h ILE 2082CO 0.01 0.45 0.00 0.40 0.00 0.00 0.00 178.15 179.01 3e66 h ILE 2083N 0.79 1.24 0.00 -0.67 2.04 -0.84 -3.09 117.51 116.97 3e66 h ILE 2083Ca 0.11 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 3e66 h ILE 2083Cb 0.73 1.62 -0.00 0.00 -0.74 0.00 0.00 36.82 38.43 3e66 h ILE 2083CO 0.06 0.20 -0.10 -0.07 0.00 0.00 0.00 178.15 178.23 3e66 h LEU 2084N -0.18 0.00 -0.88 1.44 3.38 -1.08 -3.43 115.31 114.56 3e66 h LEU 2084Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3e66 h LEU 2084Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3e66 h LEU 2084CO 0.00 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.24 3e66 n GLY 2085N 0.61 0.93 3.63 0.83 0.00 0.18 -3.17 105.19 108.21 3e66 n GLY 2085Ca 0.02 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 3e66 n GLY 2085CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3e66 s GLN 2086N -4.07 4.02 0.00 1.61 2.00 -0.07 -0.67 119.66 122.48 3e66 s GLN 2086Ca 0.00 0.96 0.00 0.00 -2.00 0.00 0.00 55.36 54.32 3e66 s GLN 2086Cb 0.00 -3.75 0.00 0.00 0.80 0.00 0.00 33.01 30.06 3e66 s GLN 2086CO 0.00 -0.92 0.00 0.09 -0.50 0.00 0.00 175.29 173.96