#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b0h h ILE 1838N 0.00 0.00 -5.34 -0.61 2.04 -2.09 -3.50 117.51 108.01 2b0h h ILE 1838Ca 0.00 -0.76 0.01 0.00 1.00 0.00 0.00 64.86 65.10 2b0h h ILE 1838Cb 0.00 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 35.99 2b0h h ILE 1838CO 0.00 0.00 -1.17 0.47 0.00 0.00 0.00 178.15 177.45 2b0h n ASP 1839N -4.14 -2.75 -0.92 1.72 9.92 -1.26 -4.84 116.55 114.29 2b0h n ASP 1839Ca -0.00 1.24 -0.01 0.00 -0.53 0.00 0.00 54.79 55.49 2b0h n ASP 1839Cb 0.00 -4.27 0.06 0.00 -0.64 0.00 0.00 41.12 36.27 2b0h n ASP 1839CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2b0h n PRO 1840N 1.86 1.58 0.02 -0.24 -0.04 -1.26 -3.63 135.00 133.27 2b0h n PRO 1840Ca -0.29 -0.59 0.11 0.00 -0.04 0.00 0.00 63.50 62.70 2b0h n PRO 1840Cb 0.46 -1.51 0.04 0.00 -0.04 0.00 0.00 33.50 32.45 2b0h n PRO 1840CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2b0h n PHE 1841N 0.14 0.16 -2.53 0.54 3.72 -1.26 -4.81 117.46 113.42 2b0h n PHE 1841Ca 0.07 0.05 -0.41 0.00 -0.05 0.00 0.00 57.45 57.11 2b0h n PHE 1841Cb 0.53 -0.32 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 2b0h n PHE 1841CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2b0h s THR 1842N -3.12 3.72 -0.40 4.37 -4.23 -1.24 -4.81 115.64 109.93 2b0h s THR 1842Ca 0.06 0.30 0.01 0.00 -1.18 0.00 0.00 61.69 60.88 2b0h s THR 1842Cb 0.15 -4.89 0.19 0.00 1.34 0.00 0.00 72.50 69.29 2b0h s THR 1842CO 0.79 -1.83 0.83 -0.32 -0.54 0.00 0.00 174.62 173.56 2b0h s MET 1843N 5.73 0.62 0.02 3.99 0.00 -1.26 -4.90 119.30 123.50 2b0h s MET 1843Ca 0.37 -0.38 -0.19 0.00 0.00 0.00 0.00 55.69 55.49 2b0h s MET 1843Cb -0.08 0.03 -0.21 0.00 0.00 0.00 0.00 34.83 34.57 2b0h s MET 1843CO 0.13 -0.84 1.15 0.78 0.00 0.00 0.00 175.02 176.25 2b0h h GLY 1844N 5.72 0.48 -7.44 2.11 0.00 -1.87 -3.42 103.07 98.66 2b0h h GLY 1844Ca 0.02 -0.76 -0.67 0.00 0.00 0.00 0.00 47.33 45.92 2b0h h GLY 1844CO 0.00 0.67 -0.76 0.99 0.00 0.00 0.00 176.54 177.45 2b0h s ASP 1845N -6.67 4.41 -0.01 0.19 1.01 -1.26 -4.98 116.67 109.35 2b0h s ASP 1845Ca -0.13 -1.13 -0.03 0.00 0.71 0.00 0.00 52.55 51.97 2b0h s ASP 1845Cb 0.04 -1.62 -0.11 0.00 1.01 0.00 0.00 42.92 42.24 2b0h s ASP 1845CO 0.82 -0.17 2.68 -2.65 0.21 0.00 0.00 175.17 176.05 2b0h n PRO 1846N 4.58 1.44 -3.93 8.23 -0.02 -1.26 -4.44 135.00 139.59 2b0h n PRO 1846Ca -0.15 -0.47 0.04 0.00 -2.02 0.00 0.00 63.50 60.91 2b0h n PRO 1846Cb 0.45 -1.43 0.01 0.00 -0.02 0.00 0.00 33.50 32.50 2b0h n PRO 1846CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2b0h s GLU 1847N 0.35 0.05 0.00 -0.52 -1.05 -1.19 -3.14 118.70 113.20 2b0h s GLU 1847Ca 0.29 -0.03 0.00 0.00 -0.15 0.00 0.00 54.97 55.08 2b0h s GLU 1847Cb 0.14 0.01 0.00 0.00 -0.44 0.00 0.00 34.13 33.84 2b0h s GLU 1847CO -0.00 -0.02 0.00 0.41 0.95 0.00 0.00 175.26 176.60 2b0h n GLY 1848N -0.88 0.29 1.35 -3.83 0.00 -1.26 -4.77 105.19 96.11 2b0h n GLY 1848Ca 0.03 -1.21 -0.06 0.00 0.00 0.00 0.00 46.02 44.78 2b0h n GLY 1848CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2b0h n SER 1849N 0.00 3.16 0.02 1.61 7.64 -1.26 -4.20 113.62 120.59 2b0h n SER 1849Ca 0.00 -2.53 0.20 0.00 1.01 0.00 0.00 58.87 57.56 2b0h n SER 1849Cb 0.00 -0.61 0.71 0.00 -1.01 0.00 0.00 64.21 63.30 2b0h n SER 1849CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 2b0h h PHE 1850N 0.57 0.00 -0.30 1.43 3.57 -1.86 -1.51 116.94 118.83 2b0h h PHE 1850Ca 0.18 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.71 2b0h h PHE 1850Cb 1.55 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.27 2b0h h PHE 1850CO 0.54 0.00 0.20 -0.39 -2.23 0.00 0.00 178.31 176.43 2b0h h VAL 1851N 0.00 1.01 -0.02 1.41 -1.51 -1.93 0.14 116.25 115.35 2b0h h VAL 1851Ca 0.24 -0.10 -0.06 0.00 -1.23 0.00 0.00 66.70 65.55 2b0h h VAL 1851Cb 1.02 0.69 0.00 0.00 -2.13 0.00 0.00 31.29 30.87 2b0h h VAL 1851CO -0.00 0.05 -0.22 -0.78 -1.23 0.00 0.00 177.57 175.40 2b0h h ASP 1852N 0.30 0.23 -0.46 4.19 3.58 -1.63 -0.90 116.42 121.72 2b0h h ASP 1852Ca 0.12 -0.71 -0.02 0.00 0.42 0.00 0.00 57.03 56.84 2b0h h ASP 1852Cb 0.12 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 2b0h h ASP 1852CO -0.03 0.91 0.19 1.88 -2.88 0.00 0.00 179.24 179.31 2b0h h TYR 1853N -0.43 0.69 0.03 0.28 0.05 -1.58 -0.21 116.97 115.79 2b0h h TYR 1853Ca -0.02 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.73 2b0h h TYR 1853Cb 0.92 -0.21 -0.05 0.00 1.01 0.00 0.00 36.73 38.40 2b0h h TYR 1853CO 0.16 0.58 -0.54 0.37 -1.05 0.00 0.00 178.16 177.68 2b0h h GLN 1854N 0.60 -0.67 -0.68 4.88 4.15 -0.74 -0.52 115.11 122.12 2b0h h GLN 1854Ca 0.15 0.05 0.04 0.00 0.77 0.00 0.00 58.65 59.66 2b0h h GLN 1854Cb 0.18 0.15 -0.04 0.00 0.21 0.00 0.00 27.48 27.98 2b0h h GLN 1854CO -0.01 -0.45 0.45 1.15 -1.93 0.00 0.00 178.83 178.04 2b0h h THR 1855N -0.70 1.09 0.69 2.39 2.02 -0.99 -2.06 112.91 115.35 2b0h h THR 1855Ca 0.01 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 2b0h h THR 1855Cb 0.74 0.22 0.01 0.00 -1.74 0.00 0.00 68.15 67.37 2b0h h THR 1855CO -0.34 0.15 -0.33 0.74 0.37 0.00 0.00 175.52 176.10 2b0h h THR 1856N 0.80 0.20 0.00 3.16 2.02 -0.28 -2.80 112.91 116.02 2b0h h THR 1856Ca 0.27 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 67.24 2b0h h THR 1856Cb 0.09 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 66.75 2b0h h THR 1856CO -0.08 0.02 0.00 0.00 0.37 0.00 0.00 175.52 175.83 2b0h h MET 1857N -1.10 0.00 -0.04 6.66 -0.00 -0.98 -1.27 114.93 118.20 2b0h h MET 1857Ca -0.10 0.00 -0.14 0.00 -0.00 0.00 0.00 59.70 59.46 2b0h h MET 1857Cb 0.74 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.33 2b0h h MET 1857CO 0.16 0.00 -0.62 -0.39 -0.00 0.00 0.00 176.91 176.06 2b0h h VAL 1858N 0.00 1.41 -0.20 -0.10 -1.51 -1.41 -0.55 116.25 113.88 2b0h h VAL 1858Ca 0.00 -2.06 -0.16 0.00 -1.23 0.00 0.00 66.70 63.26 2b0h h VAL 1858Cb 0.77 2.07 -0.01 0.00 -2.13 0.00 0.00 31.29 32.00 2b0h h VAL 1858CO 0.00 0.60 -0.53 0.03 -1.23 0.00 0.00 177.57 176.44 2b0h h ARG 1859N 0.11 0.58 -0.45 5.19 2.47 -1.01 -2.39 114.38 118.87 2b0h h ARG 1859Ca -0.01 -0.36 -0.01 0.00 -1.26 0.00 0.00 59.98 58.35 2b0h h ARG 1859Cb 1.12 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.45 2b0h h ARG 1859CO 0.09 0.97 0.25 1.15 0.56 0.00 0.00 179.97 182.99 2b0h h THR 1860N 0.45 1.16 -0.92 2.04 2.02 -1.06 0.49 112.91 117.09 2b0h h THR 1860Ca 0.01 -0.41 0.02 0.00 0.77 0.00 0.00 66.41 66.81 2b0h h THR 1860Cb 1.07 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 68.03 2b0h h THR 1860CO 0.10 0.17 0.61 0.00 0.37 0.00 0.00 175.52 176.77 2b0h h ALA 1861N 1.10 1.19 -0.49 6.16 0.00 -1.01 0.12 119.26 126.33 2b0h h ALA 1861Ca 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2b0h h ALA 1861Cb 0.05 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2b0h h ALA 1861CO -0.03 0.53 0.11 0.87 0.00 0.00 0.00 179.25 180.74 2b0h h LYS 1862N 1.22 0.79 -0.74 0.00 1.57 -1.00 0.90 116.57 119.31 2b0h h LYS 1862Ca 0.35 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2b0h h LYS 1862Cb -0.09 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.08 2b0h h LYS 1862CO -0.09 0.77 0.41 0.00 -0.57 0.00 0.00 179.45 179.97 2b0h h ALA 1863N 0.98 0.95 -0.30 3.86 0.00 -0.23 -1.05 119.26 123.47 2b0h h ALA 1863Ca 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2b0h h ALA 1863Cb 0.34 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2b0h h ALA 1863CO 0.00 0.46 0.10 0.82 0.00 0.00 0.00 179.25 180.63 2b0h h ILE 1864N 1.02 1.20 -0.92 0.00 2.04 -0.57 -2.17 117.51 118.12 2b0h h ILE 1864Ca 0.26 -0.64 0.04 0.00 1.00 0.00 0.00 64.86 65.52 2b0h h ILE 1864Cb 0.03 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 2b0h h ILE 1864CO -0.04 0.21 0.59 0.00 0.00 0.00 0.00 178.15 178.92 2b0h h ALA 1865N 0.93 1.21 -0.05 1.87 0.00 -0.32 0.12 119.26 123.02 2b0h h ALA 1865Ca 0.10 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 2b0h h ALA 1865Cb 0.24 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2b0h h ALA 1865CO -0.00 0.46 -0.66 -0.24 0.00 0.00 0.00 179.25 178.80 2b0h h VAL 1866N 1.15 1.41 0.37 0.00 3.04 -1.17 -2.58 116.25 118.48 2b0h h VAL 1866Ca 0.37 -2.11 -0.02 0.00 -1.01 0.00 0.00 66.70 63.93 2b0h h VAL 1866Cb 0.01 2.10 0.00 0.00 -2.01 0.00 0.00 31.29 31.39 2b0h h VAL 1866CO -0.12 0.62 -0.18 0.74 -1.01 0.00 0.00 177.57 177.62 2b0h h THR 1867N 0.16 0.64 -0.41 3.17 2.02 -0.58 0.16 112.91 118.07 2b0h h THR 1867Ca -0.01 -0.29 0.05 0.00 0.77 0.00 0.00 66.41 66.93 2b0h h THR 1867Cb 1.19 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.36 2b0h h THR 1867CO 0.10 0.06 0.28 -0.37 0.37 0.00 0.00 175.52 175.96 2b0h h VAL 1868N -0.66 0.97 0.06 3.16 -1.51 -1.04 0.18 116.25 117.41 2b0h h VAL 1868Ca -0.05 -0.11 -0.24 0.00 -1.23 0.00 0.00 66.70 65.07 2b0h h VAL 1868Cb 0.47 0.61 -0.00 0.00 -2.13 0.00 0.00 31.29 30.24 2b0h h VAL 1868CO 0.08 0.06 -1.06 -0.61 -1.23 0.00 0.00 177.57 174.81 2b0h h GLN 1869N 0.33 0.24 -0.62 5.19 5.75 -1.27 -2.54 115.11 122.19 2b0h h GLN 1869Ca 0.18 -0.33 -0.07 0.00 -0.15 0.00 0.00 58.65 58.27 2b0h h GLN 1869Cb 0.29 0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.93 2b0h h GLN 1869CO -0.04 1.10 0.10 0.93 -2.65 0.00 0.00 178.83 178.27 2b0h h GLU 1870N 0.10 1.03 -0.79 1.69 5.08 0.11 -1.57 114.58 120.24 2b0h h GLU 1870Ca -0.08 -0.28 0.04 0.00 -1.00 0.00 0.00 59.36 58.04 2b0h h GLU 1870Cb 1.75 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.83 2b0h h GLU 1870CO 0.17 0.96 0.49 0.52 -1.00 0.00 0.00 179.01 180.15 2b0h h MET 1871N 0.94 0.90 0.00 2.33 2.86 -0.56 0.46 114.93 121.86 2b0h h MET 1871Ca 0.19 -0.05 -0.15 0.00 -2.06 0.00 0.00 59.70 57.62 2b0h h MET 1871Cb 0.43 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2b0h h MET 1871CO 0.01 0.60 -0.73 -0.39 1.06 0.00 0.00 176.91 177.47 2b0h h VAL 1872N 0.93 1.37 -0.08 -2.22 -1.51 -1.39 -2.52 116.25 110.84 2b0h h VAL 1872Ca 0.33 -2.62 -0.12 0.00 -1.23 0.00 0.00 66.70 63.06 2b0h h VAL 1872Cb 0.08 2.47 0.01 0.00 -2.13 0.00 0.00 31.29 31.72 2b0h h VAL 1872CO -0.14 0.71 -0.41 0.74 -1.23 0.00 0.00 177.57 177.25 2b0h h THR 1873N 0.00 1.40 -0.48 7.19 2.02 -0.39 -3.31 112.91 119.35 2b0h h THR 1873Ca -0.01 -1.79 -0.10 0.00 0.77 0.00 0.00 66.41 65.28 2b0h h THR 1873Cb 1.42 2.29 -0.02 0.00 -1.74 0.00 0.00 68.15 70.10 2b0h h THR 1873CO 0.09 0.52 -0.12 0.11 0.37 0.00 0.00 175.52 176.50 2b0h h LYS 1874N -0.05 0.89 0.00 6.66 1.79 -0.17 -3.13 116.57 122.56 2b0h h LYS 1874Ca -0.03 -0.31 0.00 0.00 -2.18 0.00 0.00 60.65 58.13 2b0h h LYS 1874Cb 1.06 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.65 2b0h h LYS 1874CO 0.08 0.96 0.00 -1.13 -1.08 0.00 0.00 179.45 178.28 2b0h n SER 1875N -4.15 0.00 0.17 0.86 3.41 -0.95 0.67 113.62 113.63 2b0h n SER 1875Ca 0.01 0.50 0.01 0.00 -0.26 0.00 0.00 58.87 59.13 2b0h n SER 1875Cb 0.39 -0.50 0.28 0.00 -0.26 0.00 0.00 64.21 64.12 2b0h n SER 1875CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2b0h h ASN 1876N 0.00 0.00 0.00 4.04 2.35 -1.70 -3.39 115.58 116.88 2b0h h ASN 1876Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2b0h h ASN 1876Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 2b0h h ASN 1876CO 0.00 0.48 -0.34 0.35 -1.65 0.00 0.00 177.43 176.27 2b0h n THR 1877N -3.94 0.00 -3.97 2.81 -2.24 -0.36 -5.06 114.28 101.53 2b0h n THR 1877Ca -0.01 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.46 2b0h n THR 1877Cb 0.50 -0.29 -0.15 0.00 -2.10 0.00 0.00 70.33 68.29 2b0h n THR 1877CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2b0h s SER 1878N -2.13 4.06 0.07 3.42 0.01 0.21 -4.95 113.70 114.40 2b0h s SER 1878Ca 0.00 -1.30 0.23 0.00 1.31 0.00 0.00 55.95 56.20 2b0h s SER 1878Cb 0.00 -1.29 0.18 0.00 0.21 0.00 0.00 66.02 65.12 2b0h s SER 1878CO 0.00 -0.23 1.16 -0.81 0.41 0.00 0.00 173.24 173.76 2b0h n PRO 1879N 4.59 0.27 0.08 12.44 -0.04 -1.26 -3.49 135.00 147.59 2b0h n PRO 1879Ca -0.11 0.03 -0.10 0.00 -0.04 0.00 0.00 63.50 63.28 2b0h n PRO 1879Cb 0.43 -1.62 -0.04 0.00 -0.04 0.00 0.00 33.50 32.23 2b0h n PRO 1879CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2b0h h GLU 1880N 0.00 0.20 0.00 0.54 4.39 -1.92 -2.97 114.58 114.82 2b0h h GLU 1880Ca 0.00 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.45 2b0h h GLU 1880Cb 0.72 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 2b0h h GLU 1880CO 0.00 1.01 0.00 0.93 -1.16 0.00 0.00 179.01 179.79 2b0h h GLU 1881N 0.10 0.00 -0.00 2.33 4.39 -1.95 -1.96 114.58 117.48 2b0h h GLU 1881Ca -0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2b0h h GLU 1881Cb 1.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.26 2b0h h GLU 1881CO 0.15 0.00 -0.07 1.28 -1.16 0.00 0.00 179.01 179.21 2b0h n LEU 1882N -2.35 0.14 0.19 1.33 4.77 -1.12 -3.41 117.00 116.55 2b0h n LEU 1882Ca -0.01 0.28 -0.08 0.00 -0.03 0.00 0.00 56.01 56.17 2b0h n LEU 1882Cb 0.07 -0.34 -0.04 0.00 -2.33 0.00 0.00 43.42 40.78 2b0h n LEU 1882CO 0.12 0.03 0.22 1.23 -1.33 0.00 0.00 177.39 177.67 2b0h h GLY 1883N 4.99 -0.57 0.75 -0.72 0.00 -1.53 -2.17 103.07 103.82 2b0h h GLY 1883Ca 0.00 0.21 0.11 0.00 0.00 0.00 0.00 47.33 47.65 2b0h h GLY 1883CO 0.00 -0.21 0.54 -2.55 0.00 0.00 0.00 176.54 174.32 2b0h h PRO 1884N -1.11 0.72 -0.39 4.80 0.11 -1.77 -2.09 132.00 132.26 2b0h h PRO 1884Ca -0.06 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.92 2b0h h PRO 1884Cb 0.42 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2b0h h PRO 1884CO 0.09 0.47 -0.12 -0.07 -0.21 0.00 0.00 178.00 178.17 2b0h h LEU 1885N 0.74 0.78 -0.29 2.35 3.38 -1.63 0.14 115.31 120.77 2b0h h LEU 1885Ca 0.39 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2b0h h LEU 1885Cb 0.51 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2b0h h LEU 1885CO -0.16 0.97 0.14 0.00 0.09 0.00 0.00 178.44 179.49 2b0h h ALA 1886N 0.83 0.37 -0.41 1.53 0.00 -0.92 0.55 119.26 121.21 2b0h h ALA 1886Ca 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2b0h h ALA 1886Cb 0.65 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2b0h h ALA 1886CO 0.04 -0.07 0.15 -0.91 0.00 0.00 0.00 179.25 178.46 2b0h h ASN 1887N 0.34 0.54 -0.04 0.00 4.21 -1.29 -1.83 115.58 117.52 2b0h h ASN 1887Ca 0.10 -0.06 -0.02 0.00 1.21 0.00 0.00 56.30 57.53 2b0h h ASN 1887Cb 0.11 -0.14 -0.00 0.00 -1.12 0.00 0.00 38.32 37.17 2b0h h ASN 1887CO -0.01 0.50 -0.05 -0.61 -1.29 0.00 0.00 177.43 175.97 2b0h h GLN 1888N 0.59 0.10 -0.39 0.81 5.75 -0.13 0.32 115.11 122.15 2b0h h GLN 1888Ca 0.14 -0.06 0.04 0.00 -0.15 0.00 0.00 58.65 58.63 2b0h h GLN 1888Cb 0.15 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.66 2b0h h GLN 1888CO -0.01 0.59 0.16 1.25 -2.65 0.00 0.00 178.83 178.17 2b0h h LEU 1889N -0.39 0.19 -0.69 -2.39 6.46 -0.80 0.23 115.31 117.92 2b0h h LEU 1889Ca 0.00 0.04 0.02 0.00 -0.12 0.00 0.00 57.88 57.82 2b0h h LEU 1889Cb 0.58 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.48 2b0h h LEU 1889CO 0.01 0.15 0.45 0.74 -0.62 0.00 0.00 178.44 179.16 2b0h h THR 1890N 0.33 1.14 -0.16 1.05 2.02 -1.29 -0.78 112.91 115.23 2b0h h THR 1890Ca 0.18 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 2b0h h THR 1890Cb 0.14 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2b0h h THR 1890CO -0.16 0.16 0.02 -1.28 0.37 0.00 0.00 175.52 174.63 2b0h h SER 1891N 0.89 0.26 -0.24 4.18 0.87 -0.20 -2.61 113.55 116.69 2b0h h SER 1891Ca 0.26 -0.27 -0.09 0.00 -1.23 0.00 0.00 61.79 60.46 2b0h h SER 1891Cb -0.06 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 2b0h h SER 1891CO -0.08 0.46 -0.15 0.44 -0.53 0.00 0.00 176.83 176.98 2b0h h ASP 1892N 0.04 0.66 -0.94 6.23 3.32 -0.81 -2.42 116.42 122.51 2b0h h ASP 1892Ca 0.05 -0.20 0.02 0.00 0.02 0.00 0.00 57.03 56.92 2b0h h ASP 1892Cb 0.32 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.64 2b0h h ASP 1892CO 0.00 0.83 0.61 0.22 -1.72 0.00 0.00 179.24 179.19 2b0h h TYR 1893N 0.60 1.16 -0.76 4.55 3.20 -1.06 -0.06 116.97 124.60 2b0h h TYR 1893Ca 0.10 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.04 2b0h h TYR 1893Cb 0.60 -0.39 -0.04 0.00 1.54 0.00 0.00 36.73 38.44 2b0h h TYR 1893CO 0.03 0.70 0.50 0.78 -1.64 0.00 0.00 178.16 178.52 2b0h h GLY 1894N 1.22 1.05 0.70 1.82 0.00 -1.05 0.13 103.07 106.95 2b0h h GLY 1894Ca 0.36 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 2b0h h GLY 1894CO -0.10 0.29 -0.14 -0.09 0.00 0.00 0.00 176.54 176.49 2b0h h ARG 1895N 0.88 0.30 -0.11 4.80 2.43 -1.16 -2.93 114.38 118.61 2b0h h ARG 1895Ca 0.31 -0.17 0.03 0.00 -0.81 0.00 0.00 59.98 59.34 2b0h h ARG 1895Cb 0.12 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 2b0h h ARG 1895CO -0.10 0.73 -0.07 1.25 -1.51 0.00 0.00 179.97 180.27 2b0h h LEU 1896N -0.10 -0.23 -2.00 3.80 5.85 -0.35 -2.24 115.31 120.03 2b0h h LEU 1896Ca 0.02 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 2b0h h LEU 1896Cb 0.69 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.84 2b0h h LEU 1896CO 0.03 -0.10 -0.09 0.00 -0.34 0.00 0.00 178.44 177.94 2b0h h ALA 1897N 1.01 1.27 0.20 1.25 0.00 -0.82 -2.84 119.26 119.33 2b0h h ALA 1897Ca 0.07 -0.09 -0.29 0.00 0.00 0.00 0.00 54.91 54.60 2b0h h ALA 1897Cb 0.17 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 17.97 2b0h h ALA 1897CO -0.15 0.12 -1.31 0.77 0.00 0.00 0.00 179.25 178.68 2b0h h SER 1898N 0.00 0.66 0.57 0.00 0.02 -1.23 -3.21 113.55 110.37 2b0h h SER 1898Ca -0.00 -0.93 0.00 0.00 -0.84 0.00 0.00 61.79 60.02 2b0h h SER 1898Cb 0.30 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.62 2b0h h SER 1898CO 0.01 1.62 0.00 0.00 -1.14 0.00 0.00 176.83 177.32 2b0h n GLN 1899N -3.85 0.10 0.22 3.45 1.13 -0.90 -1.99 117.38 115.55 2b0h n GLN 1899Ca -0.18 0.36 0.08 0.00 -1.94 0.00 0.00 57.00 55.32 2b0h n GLN 1899Cb 0.99 -1.70 0.52 0.00 0.11 0.00 0.00 30.24 30.17 2b0h n GLN 1899CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2b0h h ALA 1900N 2.35 1.32 0.19 -1.58 0.00 -1.51 -2.47 119.26 117.56 2b0h h ALA 1900Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2b0h h ALA 1900Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2b0h h ALA 1900CO 0.00 0.30 -0.09 -0.22 0.00 0.00 0.00 179.25 179.24 2b0h h LYS 1901N 0.00 -0.24 0.00 0.00 3.11 -1.57 -2.67 116.57 115.20 2b0h h LYS 1901Ca -0.00 0.02 -0.02 0.00 -2.81 0.00 0.00 60.65 57.83 2b0h h LYS 1901Cb 0.52 0.06 -0.00 0.00 -1.00 0.00 0.00 32.23 31.80 2b0h h LYS 1901CO 0.03 -0.04 -0.11 -1.00 -2.81 0.00 0.00 179.45 175.53 2b0h h PRO 1902N -1.03 0.00 0.00 1.90 0.13 -1.71 -1.79 132.00 129.49 2b0h h PRO 1902Ca -0.03 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.92 2b0h h PRO 1902Cb 0.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.43 2b0h h PRO 1902CO 0.04 0.11 -0.85 0.00 -0.23 0.00 0.00 178.00 177.07 2b0h h ALA 1903N 1.89 0.57 -0.03 -0.56 0.00 -1.54 -3.09 119.26 116.51 2b0h h ALA 1903Ca -0.00 -0.73 -0.13 0.00 0.00 0.00 0.00 54.91 54.05 2b0h h ALA 1903Cb 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2b0h h ALA 1903CO 0.01 0.95 -0.59 0.00 0.00 0.00 0.00 179.25 179.62 2b0h h ALA 1904N 1.05 0.97 -0.13 0.00 0.00 -0.96 -1.63 119.26 118.56 2b0h h ALA 1904Ca -0.03 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2b0h h ALA 1904Cb 1.48 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.17 2b0h h ALA 1904CO 0.12 0.73 0.00 1.33 0.00 0.00 0.00 179.25 181.43 2b0h n VAL 1905N -3.86 0.15 0.04 0.00 0.24 -1.10 -3.67 118.33 110.13 2b0h n VAL 1905Ca -0.02 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 2b0h n VAL 1905Cb 0.60 0.62 0.00 0.00 -1.47 0.00 0.00 33.84 33.59 2b0h n VAL 1905CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b0h n ALA 1906N 0.54 2.40 -1.99 2.33 0.00 -0.99 -4.60 120.51 118.20 2b0h n ALA 1906Ca 0.17 -0.39 -0.41 0.00 0.00 0.00 0.00 53.44 52.81 2b0h n ALA 1906Cb 0.40 -0.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.78 2b0h n ALA 1906CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b0h s ALA 1907N -0.32 3.39 0.55 0.00 0.00 -0.65 -3.14 121.76 121.59 2b0h s ALA 1907Ca 0.01 0.85 0.27 0.00 0.00 0.00 0.00 51.96 53.08 2b0h s ALA 1907Cb 0.01 -3.35 1.66 0.00 0.00 0.00 0.00 23.12 21.43 2b0h s ALA 1907CO 0.02 -0.21 2.20 0.93 0.00 0.00 0.00 175.76 178.70 2b0h h GLU 1908N 4.82 0.00 -4.42 0.00 3.07 -1.90 -3.37 114.58 112.78 2b0h h GLU 1908Ca -0.45 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 58.18 2b0h h GLU 1908Cb 1.21 0.00 -0.20 0.00 -0.84 0.00 0.00 28.75 28.92 2b0h h GLU 1908CO 0.71 0.03 -0.72 1.21 -1.40 0.00 0.00 179.01 178.84 2b0h s ASN 1909N -6.32 0.72 0.17 1.42 3.84 -1.26 -4.85 114.94 108.66 2b0h s ASN 1909Ca -0.05 -0.61 -0.21 0.00 0.21 0.00 0.00 52.86 52.20 2b0h s ASN 1909Cb 0.15 0.07 0.09 0.00 -0.55 0.00 0.00 41.25 41.01 2b0h s ASN 1909CO 0.58 -0.27 1.60 -0.08 -2.79 0.00 0.00 177.10 176.13 2b0h h GLU 1910N 4.31 -0.20 0.25 0.43 4.57 -1.96 -1.77 114.58 120.22 2b0h h GLU 1910Ca -0.35 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 57.85 2b0h h GLU 1910Cb 1.20 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.80 2b0h h GLU 1910CO 0.44 -0.13 -0.37 0.93 -1.18 0.00 0.00 179.01 178.71 2b0h h GLU 1911N -0.20 -0.65 -0.99 1.92 5.08 -1.97 0.43 114.58 118.18 2b0h h GLU 1911Ca 0.20 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.75 2b0h h GLU 1911Cb 0.53 0.15 -0.09 0.00 0.50 0.00 0.00 28.75 29.83 2b0h h GLU 1911CO -0.57 -0.43 0.62 0.82 -1.00 0.00 0.00 179.01 178.44 2b0h h ILE 1912N -0.68 0.82 0.00 3.13 2.04 -1.83 0.20 117.51 121.20 2b0h h ILE 1912Ca -0.00 -0.30 -0.22 0.00 1.00 0.00 0.00 64.86 65.34 2b0h h ILE 1912Cb 0.65 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 2b0h h ILE 1912CO -0.14 0.16 -1.09 1.23 0.00 0.00 0.00 178.15 178.31 2b0h h GLY 1913N 0.87 0.00 1.28 5.37 0.00 -0.77 -3.31 103.07 106.50 2b0h h GLY 1913Ca 0.52 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.62 2b0h h GLY 1913CO -0.30 0.00 -0.88 0.00 0.00 0.00 0.00 176.54 175.36 2b0h h ALA 1914N 1.00 0.29 -0.15 3.60 0.00 0.16 -3.14 119.26 121.03 2b0h h ALA 1914Ca -0.05 -0.65 -0.03 0.00 0.00 0.00 0.00 54.91 54.19 2b0h h ALA 1914Cb 1.80 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 2b0h h ALA 1914CO 0.12 0.71 -0.03 0.45 0.00 0.00 0.00 179.25 180.50 2b0h h HIS 1915N 0.43 0.21 0.49 0.00 3.86 -0.80 -2.56 115.15 116.78 2b0h h HIS 1915Ca -0.08 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.11 2b0h h HIS 1915Cb 1.51 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 29.90 2b0h h HIS 1915CO 0.08 0.25 -0.44 0.82 0.86 0.00 0.00 177.93 179.51 2b0h h ILE 1916N 0.21 0.13 0.00 2.45 2.04 -1.63 -0.54 117.51 120.17 2b0h h ILE 1916Ca 0.05 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.87 2b0h h ILE 1916Cb 0.20 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 2b0h h ILE 1916CO 0.01 0.00 -0.17 0.11 0.00 0.00 0.00 178.15 178.09 2b0h h LYS 1917N -0.92 0.00 -0.19 2.37 6.56 -1.58 -1.79 116.57 121.02 2b0h h LYS 1917Ca -0.05 0.00 -0.18 0.00 -1.06 0.00 0.00 60.65 59.36 2b0h h LYS 1917Cb 0.80 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.46 2b0h h LYS 1917CO -0.03 0.17 -0.58 1.25 -2.06 0.00 0.00 179.45 178.20 2b0h h HIS 1918N 0.00 0.95 0.00 -1.35 2.76 -1.09 -3.02 115.15 113.40 2b0h h HIS 1918Ca -0.00 -0.38 -0.14 0.00 -2.20 0.00 0.00 60.37 57.65 2b0h h HIS 1918Cb 0.39 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.17 2b0h h HIS 1918CO 0.00 1.19 -0.76 0.00 -1.30 0.00 0.00 177.93 177.05 2b0h h ARG 1919N 0.44 0.00 -0.04 5.26 2.47 -0.61 -2.88 114.38 119.02 2b0h h ARG 1919Ca -0.02 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.56 2b0h h ARG 1919Cb 1.20 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.50 2b0h h ARG 1919CO 0.12 0.59 -0.63 -0.39 0.56 0.00 0.00 179.97 180.23 2b0h h VAL 1920N 0.00 1.41 0.00 2.04 -1.51 -1.43 -2.70 116.25 114.07 2b0h h VAL 1920Ca -0.03 -2.08 -0.07 0.00 -1.23 0.00 0.00 66.70 63.29 2b0h h VAL 1920Cb 1.52 2.09 -0.01 0.00 -2.13 0.00 0.00 31.29 32.75 2b0h h VAL 1920CO 0.08 0.61 -0.34 -0.61 -1.23 0.00 0.00 177.57 176.07 2b0h h GLN 1921N 0.11 0.00 0.35 5.19 5.75 -1.45 -1.45 115.11 123.62 2b0h h GLN 1921Ca -0.01 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 2b0h h GLN 1921Cb 1.14 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.69 2b0h h GLN 1921CO 0.09 0.34 -0.17 0.93 -2.65 0.00 0.00 178.83 177.37 2b0h h GLU 1922N 0.00 -0.46 0.00 1.69 4.39 -1.26 -2.26 114.58 116.68 2b0h h GLU 1922Ca -0.00 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 2b0h h GLU 1922Cb 0.61 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.36 2b0h h GLU 1922CO 0.04 -0.31 -0.14 -0.07 -1.16 0.00 0.00 179.01 177.38 2b0h h LEU 1923N -0.48 0.00 -0.92 1.33 3.38 -1.39 -1.97 115.31 115.26 2b0h h LEU 1923Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2b0h h LEU 1923Cb 0.37 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 2b0h h LEU 1923CO 0.08 0.14 0.58 1.23 0.09 0.00 0.00 178.44 180.56 2b0h h GLY 1924N 1.28 1.32 1.74 0.83 0.00 -0.71 0.31 103.07 107.84 2b0h h GLY 1924Ca -0.00 -0.53 -0.20 0.00 0.00 0.00 0.00 47.33 46.60 2b0h h GLY 1924CO 0.02 0.51 -0.89 0.45 0.00 0.00 0.00 176.54 176.63 2b0h h HIS 1925N 1.26 0.35 0.10 5.60 3.86 -0.93 -3.23 115.15 122.17 2b0h h HIS 1925Ca 0.33 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.35 2b0h h HIS 1925Cb -0.09 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.34 2b0h h HIS 1925CO -0.00 1.01 -0.05 0.78 0.86 0.00 0.00 177.93 180.53 2b0h h GLY 1926N 1.75 -0.15 1.00 2.45 0.00 -0.84 -2.96 103.07 104.32 2b0h h GLY 1926Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2b0h h GLY 1926CO 0.14 -0.05 0.35 0.00 0.00 0.00 0.00 176.54 176.98 2b0h h SER 1928N 0.72 0.82 -0.21 0.00 0.87 -1.66 0.20 113.55 114.29 2b0h h SER 1928Ca 0.20 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.65 2b0h h SER 1928Cb -0.07 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.71 2b0h h SER 1928CO -0.04 0.56 -0.29 0.00 -0.53 0.00 0.00 176.83 176.52 2b0h h ALA 1929N 1.34 0.32 -0.13 6.23 0.00 -1.24 -2.91 119.26 122.87 2b0h h ALA 1929Ca 0.32 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2b0h h ALA 1929Cb 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2b0h h ALA 1929CO -0.12 0.33 0.05 1.25 0.00 0.00 0.00 179.25 180.76 2b0h h LEU 1930N 0.25 0.18 -1.60 0.00 6.46 -0.02 -1.64 115.31 118.95 2b0h h LEU 1930Ca 0.02 -0.17 -0.05 0.00 -0.12 0.00 0.00 57.88 57.57 2b0h h LEU 1930Cb 0.87 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.74 2b0h h LEU 1930CO 0.07 0.30 -0.22 -0.37 -0.62 0.00 0.00 178.44 177.60 2b0h h VAL 1931N 0.05 1.04 -0.41 1.05 -1.51 -0.71 0.29 116.25 116.06 2b0h h VAL 1931Ca 0.04 -0.77 -0.13 0.00 -1.23 0.00 0.00 66.70 64.61 2b0h h VAL 1931Cb 0.18 1.43 -0.01 0.00 -2.13 0.00 0.00 31.29 30.75 2b0h h VAL 1931CO -0.00 0.21 -0.27 0.74 -1.23 0.00 0.00 177.57 177.02 2b0h h THR 1932N 0.00 1.28 -0.15 7.19 2.02 -1.26 0.21 112.91 122.18 2b0h h THR 1932Ca -0.00 -1.43 -0.16 0.00 0.77 0.00 0.00 66.41 65.59 2b0h h THR 1932Cb 0.41 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 2b0h h THR 1932CO 0.03 0.48 -0.58 0.11 0.37 0.00 0.00 175.52 175.93 2b0h h LYS 1933N 0.72 0.50 -0.15 6.66 1.79 -0.32 0.12 116.57 125.88 2b0h h LYS 1933Ca 0.08 -0.33 -0.00 0.00 -2.18 0.00 0.00 60.65 58.22 2b0h h LYS 1933Cb 0.85 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.53 2b0h h LYS 1933CO 0.07 0.94 0.08 0.00 -1.08 0.00 0.00 179.45 179.46 2b0h h ALA 1934N 0.99 0.19 -0.14 3.86 0.00 -0.36 0.10 119.26 123.91 2b0h h ALA 1934Ca 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2b0h h ALA 1934Cb 1.12 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2b0h h ALA 1934CO 0.11 -0.27 -0.33 0.78 0.00 0.00 0.00 179.25 179.53 2b0h h GLY 1935N 0.14 0.29 0.75 0.00 0.00 -0.84 0.07 103.07 103.49 2b0h h GLY 1935Ca 0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 2b0h h GLY 1935CO -0.01 0.23 -0.05 0.00 0.00 0.00 0.00 176.54 176.71 2b0h h ALA 1936N 1.42 0.20 0.00 3.60 0.00 -0.50 -1.88 119.26 122.11 2b0h h ALA 1936Ca 0.03 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2b0h h ALA 1936Cb 0.70 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2b0h h ALA 1936CO 0.05 -0.02 -0.45 1.25 0.00 0.00 0.00 179.25 180.08 2b0h h LEU 1937N -0.02 0.00 -1.20 0.00 5.85 -0.70 0.30 115.31 119.55 2b0h h LEU 1937Ca 0.04 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.68 2b0h h LEU 1937Cb 0.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2b0h h LEU 1937CO 0.02 0.45 -0.38 -0.61 -0.34 0.00 0.00 178.44 177.58 2b0h h GLN 1938N 0.00 0.00 0.04 1.25 4.15 -0.88 -2.10 115.11 117.57 2b0h h GLN 1938Ca -0.00 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 2b0h h GLN 1938Cb 0.85 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.54 2b0h h GLN 1938CO 0.06 0.38 -0.35 0.00 -1.93 0.00 0.00 178.83 176.99 2b0h s SER 1940N -6.49 5.19 0.00 0.00 0.01 1.00 -4.94 113.70 108.46 2b0h s SER 1940Ca -0.18 -2.85 0.29 0.00 1.31 0.00 0.00 55.95 54.52 2b0h s SER 1940Cb -0.01 -1.84 1.32 0.00 0.21 0.00 0.00 66.02 65.70 2b0h s SER 1940CO 0.73 -0.36 1.96 -0.81 0.41 0.00 0.00 173.24 175.16 2b0h n PRO 1941N 3.48 0.19 0.00 12.44 -0.04 -0.80 -3.26 135.00 147.01 2b0h n PRO 1941Ca 0.08 -0.01 0.07 0.00 -0.04 0.00 0.00 63.50 63.59 2b0h n PRO 1941Cb 0.38 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.31 2b0h n PRO 1941CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2b0h n SER 1942N -1.39 1.21 -4.57 3.54 2.88 -1.26 -4.89 113.62 109.13 2b0h n SER 1942Ca 0.10 -1.10 -0.43 0.00 -1.33 0.00 0.00 58.87 56.11 2b0h n SER 1942Cb 0.30 0.66 -0.03 0.00 -0.75 0.00 0.00 64.21 64.40 2b0h n SER 1942CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2b0h s ASP 1943N -1.97 6.48 0.30 -3.46 -1.08 -1.20 -4.89 116.67 110.84 2b0h s ASP 1943Ca 0.10 0.11 0.04 0.00 -0.52 0.00 0.00 52.55 52.28 2b0h s ASP 1943Cb 0.11 -2.52 0.46 0.00 -1.46 0.00 0.00 42.92 39.52 2b0h s ASP 1943CO 0.44 -1.33 1.73 1.62 0.52 0.00 0.00 175.17 178.15 2b0h h VAL 1944N 6.14 1.27 -0.62 1.11 3.04 -1.90 -2.86 116.25 122.44 2b0h h VAL 1944Ca -0.25 -1.31 0.00 0.00 -1.01 0.00 0.00 66.70 64.14 2b0h h VAL 1944Cb 1.06 1.45 -0.03 0.00 -2.01 0.00 0.00 31.29 31.77 2b0h h VAL 1944CO 1.14 0.40 0.39 1.88 -1.01 0.00 0.00 177.57 180.37 2b0h h TYR 1945N 0.33 0.80 -0.89 3.17 0.05 -1.98 -0.09 116.97 118.35 2b0h h TYR 1945Ca 0.04 0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.84 2b0h h TYR 1945Cb 0.69 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 38.12 2b0h h TYR 1945CO 0.02 0.52 0.58 1.15 -1.05 0.00 0.00 178.16 179.38 2b0h h THR 1946N 0.84 1.23 -0.43 -2.88 2.02 -1.89 -2.50 112.91 109.30 2b0h h THR 1946Ca 0.22 -0.44 -0.03 0.00 0.77 0.00 0.00 66.41 66.94 2b0h h THR 1946Cb -0.06 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.26 2b0h h THR 1946CO -0.05 0.23 0.17 0.50 0.37 0.00 0.00 175.52 176.74 2b0h h LYS 1947N 1.22 0.64 -0.77 6.66 3.64 -1.00 -2.75 116.57 124.20 2b0h h LYS 1947Ca 0.33 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 2b0h h LYS 1947Cb -0.12 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.56 2b0h h LYS 1947CO -0.07 0.60 0.46 0.87 -2.27 0.00 0.00 179.45 179.04 2b0h h LYS 1948N 0.54 1.05 0.00 1.90 1.57 -0.78 -0.22 116.57 120.63 2b0h h LYS 1948Ca 0.14 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2b0h h LYS 1948Cb 0.20 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 2b0h h LYS 1948CO -0.01 0.74 -0.03 0.93 -0.57 0.00 0.00 179.45 180.51 2b0h h GLU 1949N 1.06 0.00 0.13 3.15 5.08 -1.28 0.12 114.58 122.84 2b0h h GLU 1949Ca 0.28 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.63 2b0h h GLU 1949Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2b0h h GLU 1949CO -0.05 0.03 -0.06 1.25 -1.00 0.00 0.00 179.01 179.18 2b0h h LEU 1950N 0.00 -0.15 -0.17 1.33 6.46 -0.80 -2.89 115.31 119.09 2b0h h LEU 1950Ca -0.00 -0.37 -0.00 0.00 -0.12 0.00 0.00 57.88 57.38 2b0h h LEU 1950Cb 0.06 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.02 2b0h h LEU 1950CO 0.00 0.45 0.09 0.40 -0.62 0.00 0.00 178.44 178.77 2b0h h ILE 1951N -0.91 1.11 0.00 4.05 5.03 -0.93 -1.64 117.51 124.21 2b0h h ILE 1951Ca -0.02 -0.29 0.00 0.00 -0.12 0.00 0.00 64.86 64.43 2b0h h ILE 1951Cb 0.51 0.99 0.00 0.00 -3.03 0.00 0.00 36.82 35.29 2b0h h ILE 1951CO 0.03 0.10 0.00 -0.33 -0.68 0.00 0.00 178.15 177.27 2b0h h GLU 1952N 0.17 0.00 0.10 2.37 5.08 -0.92 -2.54 114.58 118.84 2b0h h GLU 1952Ca 0.06 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.09 2b0h h GLU 1952Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2b0h h GLU 1952CO -0.01 0.00 -1.77 0.00 -1.00 0.00 0.00 179.01 176.23 2b0h h ALA 1954N 0.40 1.50 0.00 0.00 0.00 -0.89 -0.08 119.26 120.19 2b0h h ALA 1954Ca -0.33 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 2b0h h ALA 1954Cb 2.03 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.69 2b0h h ALA 1954CO 0.12 0.36 -0.16 0.07 0.00 0.00 0.00 179.25 179.64 2b0h h ARG 1955N 0.42 0.00 -0.03 0.00 0.11 -1.65 -1.01 114.38 112.21 2b0h h ARG 1955Ca 0.10 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 59.93 2b0h h ARG 1955Cb 0.24 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.34 2b0h h ARG 1955CO 0.00 0.16 -0.96 0.00 0.10 0.00 0.00 179.97 179.27 2b0h h ARG 1956N 0.00 0.65 0.00 0.08 2.47 -1.13 -3.27 114.38 113.18 2b0h h ARG 1956Ca -0.00 -0.65 -0.13 0.00 -1.26 0.00 0.00 59.98 57.93 2b0h h ARG 1956Cb 0.73 0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 29.21 2b0h h ARG 1956CO 0.02 1.25 -0.62 -0.39 0.56 0.00 0.00 179.97 180.79 2b0h h VAL 1957N 0.38 1.08 0.00 2.04 -1.51 -1.14 -3.03 116.25 114.07 2b0h h VAL 1957Ca -0.10 -2.51 -0.02 0.00 -1.23 0.00 0.00 66.70 62.84 2b0h h VAL 1957Cb 1.60 2.52 -0.00 0.00 -2.13 0.00 0.00 31.29 33.28 2b0h h VAL 1957CO 0.18 0.61 -0.10 0.77 -1.23 0.00 0.00 177.57 177.80 2b0h h SER 1958N 0.00 0.00 -0.34 4.19 4.64 -1.26 0.09 113.55 120.88 2b0h h SER 1958Ca -0.01 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.16 2b0h h SER 1958Cb 1.47 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.56 2b0h h SER 1958CO 0.08 0.10 -0.37 -0.33 -0.87 0.00 0.00 176.83 175.44 2b0h h GLU 1959N 0.00 0.85 -0.47 4.77 4.39 -1.58 -3.19 114.58 119.34 2b0h h GLU 1959Ca -0.00 -0.46 -0.09 0.00 0.34 0.00 0.00 59.36 59.14 2b0h h GLU 1959Cb 0.30 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 2b0h h GLU 1959CO 0.01 1.10 -0.09 0.87 -1.16 0.00 0.00 179.01 179.74 2b0h h LYS 1960N 0.63 0.84 -0.40 2.33 1.79 -1.04 -2.29 116.57 118.43 2b0h h LYS 1960Ca 0.05 -0.28 -0.04 0.00 -2.18 0.00 0.00 60.65 58.20 2b0h h LYS 1960Cb 0.96 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.52 2b0h h LYS 1960CO 0.09 0.90 0.06 -0.39 -1.08 0.00 0.00 179.45 179.03 2b0h h VAL 1961N 0.76 1.20 0.00 0.50 -1.51 -1.33 -0.49 116.25 115.38 2b0h h VAL 1961Ca 0.13 -0.74 -0.07 0.00 -1.23 0.00 0.00 66.70 64.78 2b0h h VAL 1961Cb 0.59 0.83 -0.01 0.00 -2.13 0.00 0.00 31.29 30.57 2b0h h VAL 1961CO 0.04 0.26 -0.35 -1.28 -1.23 0.00 0.00 177.57 175.01 2b0h h SER 1962N 0.59 0.00 0.67 4.19 0.87 -1.42 -2.21 113.55 116.24 2b0h h SER 1962Ca 0.13 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.51 2b0h h SER 1962Cb 0.28 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 2b0h h SER 1962CO 0.00 0.35 -0.81 0.45 -0.53 0.00 0.00 176.83 176.29 2b0h h HIS 1963N 0.00 0.15 -0.51 2.24 -0.00 -0.60 -1.08 115.15 115.35 2b0h h HIS 1963Ca -0.00 -0.08 -0.04 0.00 -0.00 0.00 0.00 60.37 60.25 2b0h h HIS 1963Cb 0.74 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 28.11 2b0h h HIS 1963CO 0.00 0.87 0.18 0.28 -0.00 0.00 0.00 177.93 179.26 2b0h h VAL 1964N 0.06 1.22 -0.34 2.45 2.07 -0.90 0.64 116.25 121.45 2b0h h VAL 1964Ca -0.02 -0.73 0.03 0.00 0.82 0.00 0.00 66.70 66.80 2b0h h VAL 1964Cb 1.42 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 2b0h h VAL 1964CO 0.12 0.27 0.14 -0.07 0.02 0.00 0.00 177.57 178.05 2b0h h LEU 1965N 0.70 0.19 -0.38 2.57 3.38 -1.11 -1.60 115.31 119.05 2b0h h LEU 1965Ca 0.17 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 2b0h h LEU 1965Cb 0.24 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2b0h h LEU 1965CO -0.01 0.14 -0.13 0.00 0.09 0.00 0.00 178.44 178.54 2b0h h ALA 1966N 1.19 0.53 -0.33 1.53 0.00 -1.06 -1.83 119.26 119.28 2b0h h ALA 1966Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2b0h h ALA 1966Cb 0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2b0h h ALA 1966CO -0.13 0.42 0.21 0.00 0.00 0.00 0.00 179.25 179.75 2b0h h ALA 1967N 0.82 0.42 -0.14 0.00 0.00 -0.61 -2.62 119.26 117.13 2b0h h ALA 1967Ca 0.09 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 2b0h h ALA 1967Cb 0.66 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2b0h h ALA 1967CO 0.05 -0.09 -0.75 -0.07 0.00 0.00 0.00 179.25 178.39 2b0h h LEU 1968N 0.44 0.80 -2.80 0.00 -0.00 -1.32 -3.17 115.31 109.26 2b0h h LEU 1968Ca 0.12 -0.52 -0.20 0.00 -0.00 0.00 0.00 57.88 57.28 2b0h h LEU 1968Cb -0.01 -0.24 -0.12 0.00 -0.00 0.00 0.00 40.66 40.29 2b0h h LEU 1968CO -0.02 1.30 0.25 0.00 -0.00 0.00 0.00 178.44 179.97 2b0h n GLN 1969N -3.91 1.77 -1.60 1.13 6.02 -0.69 -4.91 117.38 115.18 2b0h n GLN 1969Ca -0.06 -1.39 -0.29 0.00 -0.01 0.00 0.00 57.00 55.25 2b0h n GLN 1969Cb 0.73 -1.59 0.11 0.00 1.02 0.00 0.00 30.24 30.51 2b0h n GLN 1969CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b0h s ALA 1970N -1.56 2.09 0.00 -1.58 0.00 -1.00 -4.88 121.76 114.83 2b0h s ALA 1970Ca 0.26 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.80 2b0h s ALA 1970Cb 0.22 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 20.29 2b0h s ALA 1970CO 0.05 -1.97 0.00 0.41 0.00 0.00 0.00 175.76 174.25 2b0h n GLY 1971N -2.33 -0.03 0.12 0.00 0.00 -1.26 -4.63 105.19 97.05 2b0h n GLY 1971Ca 0.07 -1.67 -0.25 0.00 0.00 0.00 0.00 46.02 44.17 2b0h n GLY 1971CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2b0h n ASN 1972N 0.24 1.91 -0.30 1.61 4.05 -1.26 -5.26 115.26 116.24 2b0h n ASN 1972Ca 0.00 0.38 0.04 0.00 0.45 0.00 0.00 54.58 55.45 2b0h n ASN 1972Cb 0.00 -0.88 0.03 0.00 1.23 0.00 0.00 39.78 40.16 2b0h n ASN 1972CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 177.26 172.10