#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b0h s ILE 1838N 0.00 4.13 0.20 -0.61 -1.16 -1.26 -5.11 121.20 117.39 2b0h s ILE 1838Ca 0.00 -0.85 -0.19 0.00 -0.51 0.00 0.00 60.65 59.11 2b0h s ILE 1838Cb 0.00 -2.94 -0.08 0.00 0.61 0.00 0.00 42.46 40.05 2b0h s ILE 1838CO 0.00 0.19 0.68 -0.62 -2.81 0.00 0.00 174.94 172.38 2b0h s ASP 1839N -2.11 7.02 0.37 4.50 2.15 -1.26 -4.95 116.67 122.39 2b0h s ASP 1839Ca 0.25 1.35 0.26 0.00 0.43 0.00 0.00 52.55 54.83 2b0h s ASP 1839Cb -0.12 -2.39 1.33 0.00 -0.30 0.00 0.00 42.92 41.44 2b0h s ASP 1839CO 0.17 0.07 1.80 1.55 -0.17 0.00 0.00 175.17 178.58 2b0h h PRO 1840N 3.53 0.00 0.00 4.34 0.13 -2.03 -3.44 132.00 134.54 2b0h h PRO 1840Ca -0.48 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.40 2b0h h PRO 1840Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 2b0h h PRO 1840CO 0.65 0.00 -0.17 1.97 -0.23 0.00 0.00 178.00 180.22 2b0h n PHE 1841N -2.42 -1.03 -4.29 1.56 -1.74 -1.26 -4.80 117.46 103.47 2b0h n PHE 1841Ca -0.01 -1.85 -0.20 0.00 -0.56 0.00 0.00 57.45 54.83 2b0h n PHE 1841Cb 0.10 0.36 -0.11 0.00 1.52 0.00 0.00 39.48 41.35 2b0h n PHE 1841CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 2b0h s THR 1842N -2.80 1.61 0.48 1.97 -4.23 -1.26 -4.98 115.64 106.43 2b0h s THR 1842Ca 0.24 -1.82 -0.06 0.00 -1.18 0.00 0.00 61.69 58.87 2b0h s THR 1842Cb -0.00 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.10 2b0h s THR 1842CO 0.17 -0.35 0.80 0.00 -0.54 0.00 0.00 174.62 174.70 2b0h s MET 1843N -2.72 3.56 0.48 3.99 0.23 -1.26 -3.97 119.30 119.62 2b0h s MET 1843Ca 0.12 0.25 0.00 0.00 -1.03 0.00 0.00 55.69 55.03 2b0h s MET 1843Cb -0.05 -2.36 0.00 0.00 -1.53 0.00 0.00 34.83 30.88 2b0h s MET 1843CO 0.05 -0.21 0.00 0.41 -2.03 0.00 0.00 175.02 173.24 2b0h n GLY 1844N -2.20 2.31 2.92 3.16 0.00 -1.26 -4.65 105.19 105.46 2b0h n GLY 1844Ca 0.01 -0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 2b0h n GLY 1844CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b0h s ASP 1845N -4.00 1.19 -0.91 1.61 -1.08 -1.26 -5.10 116.67 107.12 2b0h s ASP 1845Ca 0.00 -0.17 -0.17 0.00 -0.52 0.00 0.00 52.55 51.69 2b0h s ASP 1845Cb 0.00 -0.54 0.16 0.00 -1.46 0.00 0.00 42.92 41.08 2b0h s ASP 1845CO 0.00 -0.04 1.03 -2.16 0.52 0.00 0.00 175.17 174.52 2b0h s PRO 1846N 0.92 3.62 0.19 4.34 0.04 -1.25 -4.73 135.00 138.12 2b0h s PRO 1846Ca -0.11 -1.99 0.23 0.00 0.04 0.00 0.00 61.00 59.17 2b0h s PRO 1846Cb -0.15 -4.78 0.13 0.00 0.04 0.00 0.00 34.50 29.75 2b0h s PRO 1846CO 0.00 -1.63 1.17 1.05 0.04 0.00 0.00 177.00 177.63 2b0h h GLU 1847N 8.48 0.00 0.00 4.56 9.09 -1.95 -3.47 114.58 131.28 2b0h h GLU 1847Ca 0.15 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.56 2b0h h GLU 1847Cb 1.02 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.12 2b0h h GLU 1847CO 1.01 0.00 0.00 0.41 0.05 0.00 0.00 179.01 180.48 2b0h n GLY 1848N 1.23 1.16 0.00 1.06 0.00 -1.26 -3.12 105.19 104.26 2b0h n GLY 1848Ca 0.01 -0.75 0.02 0.00 0.00 0.00 0.00 46.02 45.30 2b0h n GLY 1848CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b0h n SER 1849N 2.10 0.00 0.30 1.61 3.41 -1.26 -3.43 113.62 116.35 2b0h n SER 1849Ca 0.00 -1.78 0.17 0.00 -0.26 0.00 0.00 58.87 57.00 2b0h n SER 1849Cb 0.00 0.00 0.98 0.00 -0.26 0.00 0.00 64.21 64.93 2b0h n SER 1849CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2b0h h PHE 1850N 0.00 0.00 -0.12 7.33 3.57 -1.79 -0.89 116.94 125.03 2b0h h PHE 1850Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2b0h h PHE 1850Cb 0.00 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 2b0h h PHE 1850CO 0.00 0.00 0.08 -0.39 -2.23 0.00 0.00 178.31 175.77 2b0h h VAL 1851N 0.00 1.03 -0.05 1.41 -1.51 -1.83 0.16 116.25 115.47 2b0h h VAL 1851Ca 0.01 -0.07 -0.10 0.00 -1.23 0.00 0.00 66.70 65.31 2b0h h VAL 1851Cb 0.06 0.86 0.01 0.00 -2.13 0.00 0.00 31.29 30.09 2b0h h VAL 1851CO -0.00 0.03 -0.36 -0.78 -1.23 0.00 0.00 177.57 175.24 2b0h h ASP 1852N 0.17 0.40 0.76 4.19 3.58 -1.46 -0.97 116.42 123.08 2b0h h ASP 1852Ca 0.05 -0.68 -0.04 0.00 0.42 0.00 0.00 57.03 56.77 2b0h h ASP 1852Cb -0.01 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 2b0h h ASP 1852CO -0.01 1.02 -0.20 1.88 -2.88 0.00 0.00 179.24 179.05 2b0h h TYR 1853N -0.20 0.00 0.18 0.28 0.05 -1.46 -1.39 116.97 114.43 2b0h h TYR 1853Ca -0.03 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.74 2b0h h TYR 1853Cb 1.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.77 2b0h h TYR 1853CO 0.14 0.20 -0.09 0.37 -1.05 0.00 0.00 178.16 177.73 2b0h h GLN 1854N 0.00 -0.24 -0.89 4.88 4.15 -0.65 -3.32 115.11 119.04 2b0h h GLN 1854Ca -0.00 0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.46 2b0h h GLN 1854Cb 0.63 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.32 2b0h h GLN 1854CO 0.03 0.15 0.59 1.15 -1.93 0.00 0.00 178.83 178.81 2b0h h THR 1855N -0.92 1.17 -0.03 2.39 2.02 -0.95 -2.01 112.91 114.59 2b0h h THR 1855Ca -0.03 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 66.78 2b0h h THR 1855Cb 0.49 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 2b0h h THR 1855CO 0.04 0.21 -0.04 0.00 0.37 0.00 0.00 175.52 176.10 2b0h h THR 1856N 1.13 0.89 0.03 3.16 1.03 -1.40 -2.13 112.91 115.62 2b0h h THR 1856Ca 0.35 0.00 -0.24 0.00 -0.01 0.00 0.00 66.41 66.51 2b0h h THR 1856Cb -0.01 0.89 -0.03 0.00 -1.07 0.00 0.00 68.15 67.93 2b0h h THR 1856CO -0.10 0.00 -1.18 0.00 -0.01 0.00 0.00 175.52 174.24 2b0h h MET 1857N -0.06 0.06 -0.37 0.00 -0.00 -1.62 -2.88 114.93 110.06 2b0h h MET 1857Ca 0.03 -0.09 -0.09 0.00 -0.00 0.00 0.00 59.70 59.54 2b0h h MET 1857Cb 0.09 0.04 -0.02 0.00 -0.00 0.00 0.00 31.60 31.71 2b0h h MET 1857CO -0.06 0.97 -0.16 -0.39 -0.00 0.00 0.00 176.91 177.26 2b0h h VAL 1858N 0.02 1.26 -0.66 -0.10 -1.51 -1.31 0.43 116.25 114.37 2b0h h VAL 1858Ca -0.08 -1.20 -0.02 0.00 -1.23 0.00 0.00 66.70 64.16 2b0h h VAL 1858Cb 1.85 1.16 -0.03 0.00 -2.13 0.00 0.00 31.29 32.14 2b0h h VAL 1858CO 0.13 0.40 0.33 0.03 -1.23 0.00 0.00 177.57 177.23 2b0h h ARG 1859N 0.61 0.95 -0.54 5.19 -0.00 -1.43 -2.39 114.38 116.76 2b0h h ARG 1859Ca 0.10 -0.13 -0.10 0.00 -0.50 0.00 0.00 59.98 59.34 2b0h h ARG 1859Cb 0.62 -0.17 -0.02 0.00 0.00 0.00 0.00 29.97 30.40 2b0h h ARG 1859CO 0.04 0.75 -0.07 1.15 0.00 0.00 0.00 179.97 181.83 2b0h h THR 1860N 0.91 1.27 -0.84 2.04 2.02 -1.11 -2.21 112.91 115.00 2b0h h THR 1860Ca 0.23 -1.22 -0.00 0.00 0.77 0.00 0.00 66.41 66.19 2b0h h THR 1860Cb 0.10 0.96 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 2b0h h THR 1860CO -0.03 0.43 0.52 0.00 0.37 0.00 0.00 175.52 176.81 2b0h h ALA 1861N 0.93 1.34 -0.61 6.16 0.00 -0.04 0.13 119.26 127.17 2b0h h ALA 1861Ca 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2b0h h ALA 1861Cb 0.63 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2b0h h ALA 1861CO 0.04 0.58 0.26 0.87 0.00 0.00 0.00 179.25 181.01 2b0h h LYS 1862N 1.15 0.89 -0.41 0.00 1.57 -1.17 0.27 116.57 118.86 2b0h h LYS 1862Ca 0.30 -0.15 -0.10 0.00 -1.87 0.00 0.00 60.65 58.83 2b0h h LYS 1862Cb -0.07 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.07 2b0h h LYS 1862CO -0.06 0.75 -0.16 0.00 -0.57 0.00 0.00 179.45 179.41 2b0h h ALA 1863N 1.10 0.95 -0.34 3.86 0.00 -0.70 -1.25 119.26 122.89 2b0h h ALA 1863Ca 0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2b0h h ALA 1863Cb 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2b0h h ALA 1863CO -0.02 0.61 0.10 0.82 0.00 0.00 0.00 179.25 180.76 2b0h h ILE 1864N 0.69 1.21 -0.57 0.00 2.04 -0.52 -1.19 117.51 119.18 2b0h h ILE 1864Ca 0.11 -0.70 0.01 0.00 1.00 0.00 0.00 64.86 65.28 2b0h h ILE 1864Cb 0.65 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 2b0h h ILE 1864CO 0.05 0.24 0.37 0.00 0.00 0.00 0.00 178.15 178.80 2b0h h ALA 1865N 0.94 0.72 -0.10 1.87 0.00 -0.56 0.12 119.26 122.24 2b0h h ALA 1865Ca 0.11 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 2b0h h ALA 1865Cb 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2b0h h ALA 1865CO -0.00 0.13 -0.58 -0.24 0.00 0.00 0.00 179.25 178.56 2b0h h VAL 1866N 0.74 1.36 0.13 0.00 3.04 -1.22 -2.12 116.25 118.19 2b0h h VAL 1866Ca 0.21 -1.91 -0.01 0.00 -1.01 0.00 0.00 66.70 63.99 2b0h h VAL 1866Cb -0.06 1.93 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 2b0h h VAL 1866CO -0.06 0.57 -0.06 0.74 -1.01 0.00 0.00 177.57 177.75 2b0h h THR 1867N 0.24 0.94 -0.12 3.17 2.02 -0.52 0.06 112.91 118.71 2b0h h THR 1867Ca -0.00 -0.29 -0.05 0.00 0.77 0.00 0.00 66.41 66.84 2b0h h THR 1867Cb 1.09 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 2b0h h THR 1867CO 0.09 0.07 -0.14 -0.37 0.37 0.00 0.00 175.52 175.55 2b0h h VAL 1868N -0.31 1.17 0.00 3.16 -1.51 -0.76 -0.82 116.25 117.18 2b0h h VAL 1868Ca -0.02 -0.75 -0.18 0.00 -1.23 0.00 0.00 66.70 64.52 2b0h h VAL 1868Cb 0.25 1.23 -0.02 0.00 -2.13 0.00 0.00 31.29 30.62 2b0h h VAL 1868CO 0.03 0.23 -0.85 0.06 -1.23 0.00 0.00 177.57 175.81 2b0h h GLN 1869N 0.18 0.01 -0.72 5.19 3.07 -1.21 -2.74 115.11 118.89 2b0h h GLN 1869Ca 0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 58.65 58.71 2b0h h GLN 1869Cb 0.36 0.01 -0.03 0.00 0.08 0.00 0.00 27.48 27.90 2b0h h GLN 1869CO 0.02 0.86 0.27 0.93 0.09 0.00 0.00 178.83 181.00 2b0h h GLU 1870N 0.01 1.08 -0.90 0.06 5.08 0.03 -1.50 114.58 118.44 2b0h h GLU 1870Ca -0.01 -0.20 0.02 0.00 -1.00 0.00 0.00 59.36 58.17 2b0h h GLU 1870Cb 1.51 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 30.53 2b0h h GLU 1870CO 0.11 0.89 0.59 0.52 -1.00 0.00 0.00 179.01 180.12 2b0h h MET 1871N 1.05 1.14 0.00 2.33 2.86 -0.91 0.57 114.93 121.98 2b0h h MET 1871Ca 0.24 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.69 2b0h h MET 1871Cb 0.23 -0.26 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 2b0h h MET 1871CO -0.02 0.76 -0.58 -0.39 1.06 0.00 0.00 176.91 177.74 2b0h h VAL 1872N 1.18 1.24 0.03 -2.22 -1.51 -1.25 -2.24 116.25 111.49 2b0h h VAL 1872Ca 0.34 -2.10 -0.11 0.00 -1.23 0.00 0.00 66.70 63.59 2b0h h VAL 1872Cb -0.08 2.19 0.01 0.00 -2.13 0.00 0.00 31.29 31.28 2b0h h VAL 1872CO -0.09 0.57 -0.46 0.74 -1.23 0.00 0.00 177.57 177.09 2b0h h THR 1873N 0.00 1.53 -0.26 7.19 2.02 -0.21 -3.35 112.91 119.83 2b0h h THR 1873Ca -0.01 -2.17 -0.03 0.00 0.77 0.00 0.00 66.41 64.97 2b0h h THR 1873Cb 1.14 2.89 -0.01 0.00 -1.74 0.00 0.00 68.15 70.43 2b0h h THR 1873CO 0.08 0.61 0.04 0.11 0.37 0.00 0.00 175.52 176.72 2b0h h LYS 1874N -0.40 0.42 -0.00 6.66 1.79 0.08 -3.19 116.57 121.93 2b0h h LYS 1874Ca -0.07 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 2b0h h LYS 1874Cb 1.25 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.85 2b0h h LYS 1874CO 0.09 0.55 0.24 0.66 -1.08 0.00 0.00 179.45 179.91 2b0h h SER 1875N 0.23 0.00 -0.31 0.86 4.64 -1.32 0.94 113.55 118.60 2b0h h SER 1875Ca 0.08 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.31 2b0h h SER 1875Cb 0.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2b0h h SER 1875CO 0.00 0.00 -0.11 0.78 -0.87 0.00 0.00 176.83 176.63 2b0h h ASN 1876N 0.00 0.72 0.00 4.97 2.35 -1.70 -3.37 115.58 118.55 2b0h h ASN 1876Ca 0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.54 2b0h h ASN 1876Cb 0.49 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.66 2b0h h ASN 1876CO -0.00 0.86 -0.94 0.35 -1.65 0.00 0.00 177.43 176.05 2b0h n THR 1877N -4.17 0.00 -3.88 2.81 -2.24 -0.13 -5.00 114.28 101.67 2b0h n THR 1877Ca 0.01 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.49 2b0h n THR 1877Cb 0.36 -0.88 -0.15 0.00 -2.10 0.00 0.00 70.33 67.55 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 -3.00 4.32 0.11 3.42 0.01 0.31 -4.94 113.70 113.93 2b0h s SER 1878Ca 0.00 -1.79 0.12 0.00 1.31 0.00 0.00 55.95 55.59 2b0h s SER 1878Cb 0.00 -1.23 -0.14 0.00 0.21 0.00 0.00 66.02 64.86 2b0h s SER 1878CO 0.00 -0.38 1.10 1.55 0.41 0.00 0.00 173.24 175.93 2b0h h PRO 1879N 7.87 0.00 0.00 12.44 0.13 -1.79 -3.10 132.00 147.55 2b0h h PRO 1879Ca -0.10 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.94 2b0h h PRO 1879Cb 1.03 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 2b0h h PRO 1879CO 0.48 0.64 -0.41 1.05 -0.23 0.00 0.00 178.00 179.53 2b0h h GLU 1880N 0.00 0.00 0.00 0.86 4.11 -1.92 -2.26 114.58 115.37 2b0h h GLU 1880Ca -0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.33 2b0h h GLU 1880Cb 1.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.95 2b0h h GLU 1880CO 0.09 0.41 0.00 0.39 0.07 0.00 0.00 179.01 179.97 2b0h n GLU 1881N -4.02 0.12 0.00 1.06 -0.58 -1.24 -1.57 120.64 114.41 2b0h n GLU 1881Ca -0.02 0.57 0.13 0.00 -0.42 0.00 0.00 57.16 57.43 2b0h n GLU 1881Cb 0.45 -1.86 0.47 0.00 -0.57 0.00 0.00 31.44 29.92 2b0h n GLU 1881CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2b0h n LEU 1882N -2.12 0.49 0.35 -4.62 4.77 -0.85 -3.52 117.00 111.50 2b0h n LEU 1882Ca -0.01 0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 55.88 2b0h n LEU 1882Cb 0.06 -0.25 -0.07 0.00 -2.33 0.00 0.00 43.42 40.84 2b0h n LEU 1882CO 0.10 0.10 0.37 1.23 -1.33 0.00 0.00 177.39 177.86 2b0h h GLY 1883N 4.97 -0.96 1.71 -0.72 0.00 -1.46 -0.69 103.07 105.92 2b0h h GLY 1883Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2b0h h GLY 1883CO 0.00 -0.35 0.19 -0.56 0.00 0.00 0.00 176.54 175.83 2b0h h PRO 1884N -1.21 0.39 -0.39 4.80 0.13 -1.78 -2.52 132.00 131.43 2b0h h PRO 1884Ca -0.09 -0.02 -0.16 0.00 -0.87 0.00 0.00 66.00 64.85 2b0h h PRO 1884Cb 0.70 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 2b0h h PRO 1884CO 0.15 0.27 -0.38 -0.07 -0.23 0.00 0.00 178.00 177.74 2b0h h LEU 1885N 0.41 1.01 -0.40 1.56 3.38 -1.59 0.12 115.31 119.79 2b0h h LEU 1885Ca 0.11 -0.47 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 2b0h h LEU 1885Cb -0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 2b0h h LEU 1885CO -0.02 1.27 0.15 0.00 0.09 0.00 0.00 178.44 179.92 2b0h h ALA 1886N 0.77 0.52 -0.67 1.53 0.00 -0.79 0.17 119.26 120.78 2b0h h ALA 1886Ca 0.06 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2b0h h ALA 1886Cb 0.98 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2b0h h ALA 1886CO 0.10 0.14 0.25 -0.97 0.00 0.00 0.00 179.25 178.76 2b0h h ASN 1887N 0.50 0.93 -0.14 0.00 -1.24 -1.38 -1.27 115.58 112.97 2b0h h ASN 1887Ca 0.13 -0.14 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 2b0h h ASN 1887Cb 0.21 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.01 2b0h h ASN 1887CO -0.01 0.84 0.06 -0.61 -1.29 0.00 0.00 177.43 176.42 2b0h h GLN 1888N 0.98 0.21 -0.62 6.67 5.75 -0.22 0.76 115.11 128.66 2b0h h GLN 1888Ca 0.23 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.74 2b0h h GLN 1888Cb 0.22 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.69 2b0h h GLN 1888CO -0.02 0.30 0.34 1.25 -2.65 0.00 0.00 178.83 178.06 2b0h h LEU 1889N 0.08 0.51 -0.23 -2.39 6.46 -0.50 -0.42 115.31 118.83 2b0h h LEU 1889Ca 0.05 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.83 2b0h h LEU 1889Cb 0.17 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.01 2b0h h LEU 1889CO -0.00 0.34 0.14 0.74 -0.62 0.00 0.00 178.44 179.04 2b0h h THR 1890N 0.64 1.08 -0.36 1.05 2.02 -0.85 -0.47 112.91 116.02 2b0h h THR 1890Ca 0.27 -0.17 -0.07 0.00 0.77 0.00 0.00 66.41 67.21 2b0h h THR 1890Cb 0.14 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 2b0h h THR 1890CO -0.16 0.07 -0.04 0.28 0.37 0.00 0.00 175.52 176.04 2b0h h SER 1891N 0.29 0.66 -0.41 4.18 0.02 -0.48 -2.68 113.55 115.13 2b0h h SER 1891Ca 0.08 -0.34 -0.14 0.00 -0.84 0.00 0.00 61.79 60.56 2b0h h SER 1891Cb -0.00 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 2b0h h SER 1891CO -0.02 0.84 -0.29 0.44 -1.14 0.00 0.00 176.83 176.66 2b0h h ASP 1892N 0.47 0.97 -0.43 3.07 5.19 -0.99 -2.45 116.42 122.25 2b0h h ASP 1892Ca 0.10 -0.43 0.04 0.00 -0.62 0.00 0.00 57.03 56.12 2b0h h ASP 1892Cb 0.52 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.74 2b0h h ASP 1892CO 0.03 1.20 0.29 0.22 -3.12 0.00 0.00 179.24 177.86 2b0h h TYR 1893N 0.76 0.40 -0.06 4.55 3.20 -1.07 -0.67 116.97 124.08 2b0h h TYR 1893Ca 0.08 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.97 2b0h h TYR 1893Cb 0.88 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 39.01 2b0h h TYR 1893CO 0.06 0.23 0.05 0.78 -1.64 0.00 0.00 178.16 177.63 2b0h h GLY 1894N 0.41 0.04 1.27 1.82 0.00 -1.08 -0.37 103.07 105.15 2b0h h GLY 1894Ca 0.18 -0.01 -0.31 0.00 0.00 0.00 0.00 47.33 47.19 2b0h h GLY 1894CO -0.04 0.01 -1.31 -0.09 0.00 0.00 0.00 176.54 175.11 2b0h h ARG 1895N 0.03 0.59 -0.08 4.80 2.43 -1.12 -2.97 114.38 118.07 2b0h h ARG 1895Ca 0.03 -0.84 -0.00 0.00 -0.81 0.00 0.00 59.98 58.35 2b0h h ARG 1895Cb 0.07 0.29 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2b0h h ARG 1895CO -0.00 1.39 0.04 1.25 -1.51 0.00 0.00 179.97 181.14 2b0h h LEU 1896N 0.24 0.10 -1.25 3.80 5.85 -0.96 -1.23 115.31 121.86 2b0h h LEU 1896Ca -0.20 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 2b0h h LEU 1896Cb 1.98 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.98 2b0h h LEU 1896CO 0.25 0.14 -0.25 0.00 -0.34 0.00 0.00 178.44 178.24 2b0h h ALA 1897N 0.96 1.09 0.08 1.25 0.00 -1.21 -2.20 119.26 119.23 2b0h h ALA 1897Ca 0.03 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 2b0h h ALA 1897Cb 0.07 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2b0h h ALA 1897CO -0.00 0.31 -0.74 0.66 0.00 0.00 0.00 179.25 179.48 2b0h h SER 1898N 0.00 0.27 0.61 0.00 4.64 -1.33 -3.25 113.55 114.50 2b0h h SER 1898Ca -0.00 -0.91 0.00 0.00 -0.47 0.00 0.00 61.79 60.41 2b0h h SER 1898Cb 0.69 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2b0h h SER 1898CO 0.03 1.33 0.00 0.00 -0.87 0.00 0.00 176.83 177.33 2b0h n GLN 1899N -4.25 0.07 0.20 4.77 1.13 -0.48 -1.99 117.38 116.82 2b0h n GLN 1899Ca -0.17 0.30 0.05 0.00 -1.94 0.00 0.00 57.00 55.24 2b0h n GLN 1899Cb 0.73 -1.63 0.41 0.00 0.11 0.00 0.00 30.24 29.87 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 2.44 1.31 0.32 -1.58 0.00 -1.43 -2.38 119.26 117.95 2b0h h ALA 1900Ca 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2b0h h ALA 1900Cb 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2b0h h ALA 1900CO 0.00 0.41 -0.15 -0.22 0.00 0.00 0.00 179.25 179.29 2b0h h LYS 1901N 0.00 -0.41 0.00 0.00 1.63 -1.54 -1.86 116.57 114.39 2b0h h LYS 1901Ca -0.00 0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.81 2b0h h LYS 1901Cb 0.64 0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.36 2b0h h LYS 1901CO 0.04 -0.14 -0.09 -1.00 -3.45 0.00 0.00 179.45 174.82 2b0h h PRO 1902N -1.02 0.00 -0.25 1.90 0.13 -1.71 -1.89 132.00 129.17 2b0h h PRO 1902Ca -0.04 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.91 2b0h h PRO 1902Cb 0.46 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 2b0h h PRO 1902CO 0.07 0.09 -0.54 0.00 -0.23 0.00 0.00 178.00 177.39 2b0h h ALA 1903N 1.91 0.58 -0.01 -0.56 0.00 -1.44 -2.10 119.26 117.64 2b0h h ALA 1903Ca -0.00 -0.51 -0.17 0.00 0.00 0.00 0.00 54.91 54.23 2b0h h ALA 1903Cb 0.27 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2b0h h ALA 1903CO 0.01 0.68 -0.79 0.00 0.00 0.00 0.00 179.25 179.16 2b0h h ALA 1904N 0.82 0.67 0.00 0.00 0.00 -0.57 -1.52 119.26 118.67 2b0h h ALA 1904Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2b0h h ALA 1904Cb 1.12 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2b0h h ALA 1904CO 0.11 0.91 -0.42 -0.39 0.00 0.00 0.00 179.25 179.46 2b0h h VAL 1905N 0.06 0.00 -0.05 0.00 -1.51 -1.41 -3.19 116.25 110.15 2b0h h VAL 1905Ca -0.02 -0.80 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 2b0h h VAL 1905Cb 1.38 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 32.11 2b0h h VAL 1905CO 0.11 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.45 2b0h n ALA 1906N -2.01 2.46 -1.85 5.19 0.00 -0.79 -4.98 120.51 118.54 2b0h n ALA 1906Ca 0.03 -0.69 -0.41 0.00 0.00 0.00 0.00 53.44 52.37 2b0h n ALA 1906Cb 0.50 -0.71 -0.02 0.00 0.00 0.00 0.00 19.45 19.22 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 -1.71 3.62 -0.05 0.00 0.00 -0.58 -4.58 121.76 118.46 2b0h s ALA 1907Ca 0.25 1.36 0.13 0.00 0.00 0.00 0.00 51.96 53.70 2b0h s ALA 1907Cb 0.18 -3.56 -0.21 0.00 0.00 0.00 0.00 23.12 19.53 2b0h s ALA 1907CO 0.26 -0.77 0.75 1.05 0.00 0.00 0.00 175.76 177.05 2b0h h GLU 1908N 4.70 0.00 -6.49 0.00 9.09 -1.90 -3.47 114.58 116.51 2b0h h GLU 1908Ca -0.47 0.00 -0.44 0.00 0.05 0.00 0.00 59.36 58.50 2b0h h GLU 1908Cb 1.22 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 28.34 2b0h h GLU 1908CO 0.76 0.49 -0.23 -0.80 0.05 0.00 0.00 179.01 179.27 2b0h s ASN 1909N -6.08 5.81 -0.05 3.06 0.01 -1.26 -5.04 114.94 111.39 2b0h s ASN 1909Ca -0.04 -0.09 -0.22 0.00 -0.71 0.00 0.00 52.86 51.80 2b0h s ASN 1909Cb 0.08 -1.17 -0.16 0.00 0.41 0.00 0.00 41.25 40.41 2b0h s ASN 1909CO 0.82 -0.63 0.93 -0.08 -1.51 0.00 0.00 177.10 176.63 2b0h h GLU 1910N 0.64 -0.19 -0.08 -0.60 4.57 -2.01 -3.35 114.58 113.56 2b0h h GLU 1910Ca -0.44 0.01 -0.16 0.00 -1.18 0.00 0.00 59.36 57.58 2b0h h GLU 1910Cb 1.26 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.89 2b0h h GLU 1910CO 0.52 0.25 -0.66 0.93 -1.18 0.00 0.00 179.01 178.87 2b0h h GLU 1911N -0.82 0.33 0.18 1.92 5.08 -1.98 -2.96 114.58 116.32 2b0h h GLU 1911Ca -0.02 -0.24 0.01 0.00 -1.00 0.00 0.00 59.36 58.10 2b0h h GLU 1911Cb 0.53 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 2b0h h GLU 1911CO 0.03 0.87 -0.21 0.82 -1.00 0.00 0.00 179.01 179.53 2b0h h ILE 1912N 0.23 0.54 -0.20 3.13 2.04 -1.85 0.75 117.51 122.15 2b0h h ILE 1912Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 2b0h h ILE 1912Cb 1.20 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2b0h h ILE 1912CO 0.11 0.00 0.02 1.23 0.00 0.00 0.00 178.15 179.51 2b0h h GLY 1913N -0.43 0.31 0.82 5.37 0.00 -1.68 -0.42 103.07 107.04 2b0h h GLY 1913Ca 0.01 -0.15 -0.13 0.00 0.00 0.00 0.00 47.33 47.06 2b0h h GLY 1913CO -0.07 0.14 -0.46 0.00 0.00 0.00 0.00 176.54 176.15 2b0h h ALA 1914N 1.74 0.17 -0.39 3.60 0.00 -1.17 -3.27 119.26 119.94 2b0h h ALA 1914Ca 0.07 -0.49 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 2b0h h ALA 1914Cb 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2b0h h ALA 1914CO 0.00 0.33 -0.24 0.45 0.00 0.00 0.00 179.25 179.79 2b0h h HIS 1915N 0.03 0.91 0.04 0.00 -0.00 0.93 -2.72 115.15 114.34 2b0h h HIS 1915Ca -0.03 -0.22 0.02 0.00 -0.00 0.00 0.00 60.37 60.15 2b0h h HIS 1915Cb 1.11 -0.21 -0.05 0.00 -0.00 0.00 0.00 27.41 28.25 2b0h h HIS 1915CO 0.12 0.96 -0.45 0.82 -0.00 0.00 0.00 177.93 179.38 2b0h h ILE 1916N 0.69 0.11 0.00 2.45 2.04 -1.16 0.15 117.51 121.79 2b0h h ILE 1916Ca 0.09 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.91 2b0h h ILE 1916Cb 0.76 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2b0h h ILE 1916CO 0.06 0.00 -0.20 0.11 0.00 0.00 0.00 178.15 178.12 2b0h h LYS 1917N -0.63 0.00 0.15 2.37 1.57 -1.60 -2.09 116.57 116.34 2b0h h LYS 1917Ca 0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2b0h h LYS 1917Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2b0h h LYS 1917CO -0.31 0.20 -0.07 0.45 -0.57 0.00 0.00 179.45 179.15 2b0h h HIS 1918N 0.00 -0.19 -0.41 -1.35 3.86 -1.04 -3.16 115.15 112.87 2b0h h HIS 1918Ca -0.00 -0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.07 2b0h h HIS 1918Cb 0.62 0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.14 2b0h h HIS 1918CO 0.00 0.22 -0.29 0.00 0.86 0.00 0.00 177.93 178.72 2b0h h ARG 1919N -0.67 0.90 0.00 2.45 2.47 -0.47 -2.17 114.38 116.88 2b0h h ARG 1919Ca -0.02 -0.41 -0.05 0.00 -1.26 0.00 0.00 59.98 58.24 2b0h h ARG 1919Cb 0.49 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.79 2b0h h ARG 1919CO 0.03 1.06 -0.22 -0.39 0.56 0.00 0.00 179.97 181.02 2b0h h VAL 1920N 0.76 1.08 -0.21 2.04 -1.51 -1.53 -0.06 116.25 116.82 2b0h h VAL 1920Ca 0.08 -0.77 -0.14 0.00 -1.23 0.00 0.00 66.70 64.65 2b0h h VAL 1920Cb 0.86 1.42 0.00 0.00 -2.13 0.00 0.00 31.29 31.44 2b0h h VAL 1920CO 0.08 0.21 -0.40 -0.61 -1.23 0.00 0.00 177.57 175.62 2b0h h GLN 1921N 0.00 0.64 -0.03 5.19 4.15 -1.38 -0.03 115.11 123.66 2b0h h GLN 1921Ca -0.00 -0.41 -0.14 0.00 0.77 0.00 0.00 58.65 58.87 2b0h h GLN 1921Cb 0.41 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.13 2b0h h GLN 1921CO 0.03 1.03 -0.62 0.93 -1.93 0.00 0.00 178.83 178.26 2b0h h GLU 1922N 0.34 0.11 -0.09 1.69 5.08 -0.98 -1.80 114.58 118.93 2b0h h GLU 1922Ca 0.01 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2b0h h GLU 1922Cb 0.99 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 2b0h h GLU 1922CO 0.09 0.70 -0.09 1.25 -1.00 0.00 0.00 179.01 179.96 2b0h h LEU 1923N 0.08 0.24 -0.95 1.33 6.46 -0.98 -3.13 115.31 118.35 2b0h h LEU 1923Ca -0.01 -0.48 -0.01 0.00 -0.12 0.00 0.00 57.88 57.27 2b0h h LEU 1923Cb 1.12 -0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 40.94 2b0h h LEU 1923CO 0.09 0.66 0.56 1.23 -0.62 0.00 0.00 178.44 180.36 2b0h h GLY 1924N -0.19 1.37 1.87 3.75 0.00 -0.76 0.10 103.07 109.22 2b0h h GLY 1924Ca 0.02 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.74 2b0h h GLY 1924CO 0.02 0.56 -0.05 0.45 0.00 0.00 0.00 176.54 177.52 2b0h h HIS 1925N 1.30 0.17 0.03 5.60 3.86 -1.39 0.66 115.15 125.37 2b0h h HIS 1925Ca 0.34 -0.01 -0.23 0.00 -1.16 0.00 0.00 60.37 59.31 2b0h h HIS 1925Cb -0.04 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 2b0h h HIS 1925CO 0.01 0.23 -1.00 0.78 0.86 0.00 0.00 177.93 178.80 2b0h h GLY 1926N 0.48 0.35 0.87 2.45 0.00 -1.22 -3.06 103.07 102.94 2b0h h GLY 1926Ca 0.04 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.68 2b0h h GLY 1926CO 0.01 0.60 0.07 0.00 0.00 0.00 0.00 176.54 177.21 2b0h h SER 1928N 0.16 0.84 -0.31 0.00 4.64 -1.00 0.12 113.55 118.00 2b0h h SER 1928Ca 0.07 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.23 2b0h h SER 1928Cb 0.22 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 2b0h h SER 1928CO -0.00 0.66 -0.22 0.00 -0.87 0.00 0.00 176.83 176.39 2b0h h ALA 1929N 1.48 0.44 -0.03 5.18 0.00 -1.41 -2.96 119.26 121.96 2b0h h ALA 1929Ca 0.25 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2b0h h ALA 1929Cb -0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2b0h h ALA 1929CO -0.04 0.40 0.01 1.25 0.00 0.00 0.00 179.25 180.87 2b0h h LEU 1930N 0.45 0.04 -2.06 0.00 6.46 -0.13 -1.91 115.31 118.16 2b0h h LEU 1930Ca 0.06 -0.17 -0.01 0.00 -0.12 0.00 0.00 57.88 57.63 2b0h h LEU 1930Cb 0.78 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.69 2b0h h LEU 1930CO 0.06 0.20 -0.07 -0.37 -0.62 0.00 0.00 178.44 177.64 2b0h h VAL 1931N -0.12 0.76 -0.12 1.05 -1.51 -0.87 0.18 116.25 115.62 2b0h h VAL 1931Ca 0.01 -0.27 -0.07 0.00 -1.23 0.00 0.00 66.70 65.15 2b0h h VAL 1931Cb 0.18 1.16 -0.00 0.00 -2.13 0.00 0.00 31.29 30.49 2b0h h VAL 1931CO -0.00 0.07 -0.19 0.74 -1.23 0.00 0.00 177.57 176.96 2b0h h THR 1932N 0.00 1.38 -0.02 7.19 2.02 -1.30 -3.14 112.91 119.04 2b0h h THR 1932Ca -0.00 -1.44 -0.13 0.00 0.77 0.00 0.00 66.41 65.62 2b0h h THR 1932Cb 0.15 2.04 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2b0h h THR 1932CO 0.01 0.42 -0.58 0.11 0.37 0.00 0.00 175.52 175.84 2b0h h LYS 1933N -0.09 0.06 0.33 6.66 1.79 -0.49 -2.35 116.57 122.48 2b0h h LYS 1933Ca 0.01 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2b0h h LYS 1933Cb 0.76 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.41 2b0h h LYS 1933CO 0.04 0.63 -0.18 0.00 -1.08 0.00 0.00 179.45 178.86 2b0h h ALA 1934N 1.36 -0.48 0.00 3.86 0.00 -0.73 0.36 119.26 123.64 2b0h h ALA 1934Ca -0.01 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2b0h h ALA 1934Cb 1.04 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2b0h h ALA 1934CO 0.08 -0.77 -0.28 0.78 0.00 0.00 0.00 179.25 179.06 2b0h h GLY 1935N -0.48 0.00 1.28 0.00 0.00 -1.56 -2.87 103.07 99.44 2b0h h GLY 1935Ca -0.04 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.05 2b0h h GLY 1935CO 0.05 0.00 -0.93 0.00 0.00 0.00 0.00 176.54 175.66 2b0h h ALA 1936N 1.72 0.25 -0.49 3.60 0.00 -1.01 -2.48 119.26 120.85 2b0h h ALA 1936Ca -0.00 -0.66 -0.09 0.00 0.00 0.00 0.00 54.91 54.15 2b0h h ALA 1936Cb 0.75 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2b0h h ALA 1936CO 0.04 0.71 -0.05 1.25 0.00 0.00 0.00 179.25 181.20 2b0h h LEU 1937N 0.41 0.84 -0.79 0.00 5.85 -0.16 0.80 115.31 122.26 2b0h h LEU 1937Ca -0.09 -0.23 -0.07 0.00 0.84 0.00 0.00 57.88 58.32 2b0h h LEU 1937Cb 1.57 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.36 2b0h h LEU 1937CO 0.18 0.93 -0.35 0.06 -0.34 0.00 0.00 178.44 178.92 2b0h h GLN 1938N 0.78 0.00 0.00 1.25 3.07 -1.54 -1.91 115.11 116.76 2b0h h GLN 1938Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.88 2b0h h GLN 1938Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.10 2b0h h GLN 1938CO 0.03 0.35 -0.14 0.00 0.09 0.00 0.00 178.83 179.16 2b0h n SER 1940N -1.71 -0.98 0.00 0.00 7.64 0.21 -4.98 113.62 113.79 2b0h n SER 1940Ca 0.06 -2.84 0.13 0.00 1.01 0.00 0.00 58.87 57.23 2b0h n SER 1940Cb 0.37 0.20 0.64 0.00 -1.01 0.00 0.00 64.21 64.40 2b0h n SER 1940CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2b0h n PRO 1941N 1.74 0.31 -0.05 1.43 -0.04 -0.78 -2.64 135.00 134.98 2b0h n PRO 1941Ca 0.19 0.04 0.12 0.00 -0.04 0.00 0.00 63.50 63.81 2b0h n PRO 1941Cb 0.55 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.90 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 -1.32 1.93 -4.24 3.54 2.88 -1.26 -4.73 113.62 110.42 2b0h n SER 1942Ca 0.11 -1.69 -0.38 0.00 -1.33 0.00 0.00 58.87 55.58 2b0h n SER 1942Cb 0.22 -0.07 -0.11 0.00 -0.75 0.00 0.00 64.21 63.50 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 -1.78 5.42 0.38 -3.46 2.15 -1.08 -4.94 116.67 113.36 2b0h s ASP 1943Ca 0.35 -1.43 0.19 0.00 0.43 0.00 0.00 52.55 52.09 2b0h s ASP 1943Cb 0.20 -1.90 0.72 0.00 -0.30 0.00 0.00 42.92 41.63 2b0h s ASP 1943CO 0.30 -0.44 1.75 1.62 -0.17 0.00 0.00 175.17 178.23 2b0h h VAL 1944N 6.18 0.84 -0.37 1.11 3.04 -1.88 -3.11 116.25 122.05 2b0h h VAL 1944Ca -0.21 -1.45 -0.13 0.00 -1.01 0.00 0.00 66.70 63.89 2b0h h VAL 1944Cb 1.08 1.90 -0.01 0.00 -2.01 0.00 0.00 31.29 32.24 2b0h h VAL 1944CO 0.68 0.35 -0.29 1.88 -1.01 0.00 0.00 177.57 179.17 2b0h h TYR 1945N 0.00 0.93 -0.84 3.17 0.05 -1.97 0.73 116.97 119.04 2b0h h TYR 1945Ca -0.00 -0.24 0.02 0.00 0.05 0.00 0.00 58.73 58.56 2b0h h TYR 1945Cb 0.87 -0.21 -0.05 0.00 1.01 0.00 0.00 36.73 38.35 2b0h h TYR 1945CO 0.00 0.99 0.56 1.15 -1.05 0.00 0.00 178.16 179.81 2b0h h THR 1946N 0.68 1.17 -0.30 -2.88 2.02 -1.91 -0.93 112.91 110.76 2b0h h THR 1946Ca 0.08 -0.37 -0.09 0.00 0.77 0.00 0.00 66.41 66.80 2b0h h THR 1946Cb 0.83 -0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2b0h h THR 1946CO 0.07 0.20 -0.17 0.50 0.37 0.00 0.00 175.52 176.49 2b0h h LYS 1947N 1.09 0.64 -0.09 6.66 3.64 -1.40 -2.73 116.57 124.37 2b0h h LYS 1947Ca 0.32 -0.29 0.04 0.00 -1.27 0.00 0.00 60.65 59.45 2b0h h LYS 1947Cb -0.04 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.72 2b0h h LYS 1947CO -0.09 0.88 -0.21 0.87 -2.27 0.00 0.00 179.45 178.63 2b0h h LYS 1948N 0.39 -0.28 -0.82 1.90 1.79 -0.16 -1.73 116.57 117.65 2b0h h LYS 1948Ca 0.06 0.02 0.06 0.00 -2.18 0.00 0.00 60.65 58.61 2b0h h LYS 1948Cb 0.70 0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 31.37 2b0h h LYS 1948CO 0.05 -0.19 0.54 0.93 -1.08 0.00 0.00 179.45 179.70 2b0h h GLU 1949N -0.29 0.91 -0.03 3.15 5.08 -1.21 -0.71 114.58 121.48 2b0h h GLU 1949Ca 0.09 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2b0h h GLU 1949Cb 0.42 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2b0h h GLU 1949CO -0.26 0.60 0.02 1.25 -1.00 0.00 0.00 179.01 179.62 2b0h h LEU 1950N 0.94 0.04 -0.63 1.33 6.46 -1.01 0.20 115.31 122.63 2b0h h LEU 1950Ca 0.35 -0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 58.02 2b0h h LEU 1950Cb 0.17 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.07 2b0h h LEU 1950CO -0.12 0.05 0.18 0.40 -0.62 0.00 0.00 178.44 178.33 2b0h h ILE 1951N 0.02 1.25 -0.57 4.05 5.03 -0.96 -1.30 117.51 125.03 2b0h h ILE 1951Ca 0.01 -0.89 -0.03 0.00 -0.12 0.00 0.00 64.86 63.83 2b0h h ILE 1951Cb 0.02 0.62 -0.03 0.00 -3.03 0.00 0.00 36.82 34.41 2b0h h ILE 1951CO -0.00 0.34 0.23 -0.33 -0.68 0.00 0.00 178.15 177.71 2b0h h GLU 1952N 0.92 0.82 -0.02 2.37 4.39 -0.70 -2.35 114.58 120.00 2b0h h GLU 1952Ca 0.20 -0.12 -0.18 0.00 0.34 0.00 0.00 59.36 59.60 2b0h h GLU 1952Cb 0.33 -0.15 0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2b0h h GLU 1952CO -0.00 0.67 -0.71 0.00 -1.16 0.00 0.00 179.01 177.81 2b0h h ALA 1954N 0.37 1.22 -0.07 0.00 0.00 -1.00 -1.23 119.26 118.55 2b0h h ALA 1954Ca -0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2b0h h ALA 1954Cb 1.39 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2b0h h ALA 1954CO 0.14 0.65 -0.11 0.07 0.00 0.00 0.00 179.25 180.01 2b0h h ARG 1955N 1.27 0.11 0.18 0.00 0.11 -1.52 -2.06 114.38 112.48 2b0h h ARG 1955Ca 0.33 -0.02 -0.30 0.00 0.10 0.00 0.00 59.98 60.09 2b0h h ARG 1955Cb -0.03 -0.02 0.02 0.00 1.11 0.00 0.00 29.97 31.05 2b0h h ARG 1955CO -0.06 0.23 -1.35 0.00 0.10 0.00 0.00 179.97 178.89 2b0h h ARG 1956N 0.11 0.39 0.00 0.08 3.08 -1.30 -3.13 114.38 113.61 2b0h h ARG 1956Ca 0.02 -0.67 -0.12 0.00 0.07 0.00 0.00 59.98 59.29 2b0h h ARG 1956Cb 0.26 0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 2b0h h ARG 1956CO 0.02 1.32 -0.57 -0.39 -1.07 0.00 0.00 179.97 179.27 2b0h h VAL 1957N 0.11 1.38 0.00 2.04 -1.51 -1.17 -2.46 116.25 114.64 2b0h h VAL 1957Ca -0.19 -1.98 -0.03 0.00 -1.23 0.00 0.00 66.70 63.27 2b0h h VAL 1957Cb 2.06 2.08 -0.00 0.00 -2.13 0.00 0.00 31.29 33.29 2b0h h VAL 1957CO 0.24 0.56 -0.14 -1.28 -1.23 0.00 0.00 177.57 175.72 2b0h h SER 1958N 0.00 0.00 -0.44 4.19 0.87 -1.38 -0.93 113.55 115.85 2b0h h SER 1958Ca -0.01 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.44 2b0h h SER 1958Cb 1.03 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 2b0h h SER 1958CO 0.07 0.14 -0.17 -0.33 -0.53 0.00 0.00 176.83 176.01 2b0h h GLU 1959N 0.00 0.90 -0.14 2.24 5.08 -1.38 -3.06 114.58 118.22 2b0h h GLU 1959Ca -0.00 -0.38 -0.08 0.00 -1.00 0.00 0.00 59.36 57.91 2b0h h GLU 1959Cb 0.45 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2b0h h GLU 1959CO 0.02 1.03 -0.26 0.87 -1.00 0.00 0.00 179.01 179.67 2b0h h LYS 1960N 0.74 0.25 -0.40 2.33 6.56 -1.15 -1.60 116.57 123.29 2b0h h LYS 1960Ca 0.10 -0.08 -0.04 0.00 -1.06 0.00 0.00 60.65 59.57 2b0h h LYS 1960Cb 0.73 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.35 2b0h h LYS 1960CO 0.06 0.50 0.07 -0.39 -2.06 0.00 0.00 179.45 177.62 2b0h h VAL 1961N 0.22 1.19 0.00 0.50 -1.51 -1.22 -0.53 116.25 114.90 2b0h h VAL 1961Ca 0.04 -0.71 -0.12 0.00 -1.23 0.00 0.00 66.70 64.67 2b0h h VAL 1961Cb 0.58 0.82 -0.02 0.00 -2.13 0.00 0.00 31.29 30.54 2b0h h VAL 1961CO 0.04 0.26 -0.58 -1.28 -1.23 0.00 0.00 177.57 174.78 2b0h h SER 1962N 0.58 0.00 0.65 4.19 0.87 -1.33 -2.40 113.55 116.12 2b0h h SER 1962Ca 0.13 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.56 2b0h h SER 1962Cb 0.27 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.21 2b0h h SER 1962CO 0.00 0.58 -0.65 0.45 -0.53 0.00 0.00 176.83 176.68 2b0h h HIS 1963N 0.00 0.00 -0.13 2.24 -0.00 -0.32 -0.15 115.15 116.80 2b0h h HIS 1963Ca -0.01 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.33 2b0h h HIS 1963Cb 1.29 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.69 2b0h h HIS 1963CO 0.00 0.65 -0.03 0.28 -0.00 0.00 0.00 177.93 178.82 2b0h h VAL 1964N 0.00 1.29 -0.01 2.45 2.07 -1.00 -2.29 116.25 118.76 2b0h h VAL 1964Ca -0.01 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.56 2b0h h VAL 1964Cb 1.15 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 32.55 2b0h h VAL 1964CO 0.08 0.29 -0.29 -0.07 0.02 0.00 0.00 177.57 177.60 2b0h h LEU 1965N -0.07 -0.88 -1.43 2.57 3.38 -1.10 -1.54 115.31 116.26 2b0h h LEU 1965Ca 0.03 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2b0h h LEU 1965Cb 0.46 0.36 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 2b0h h LEU 1965CO 0.01 -0.36 0.07 0.00 0.09 0.00 0.00 178.44 178.25 2b0h h ALA 1966N 0.35 1.54 -0.27 1.53 0.00 -1.09 -1.20 119.26 120.12 2b0h h ALA 1966Ca 0.07 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2b0h h ALA 1966Cb 0.53 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2b0h h ALA 1966CO -0.26 0.34 -0.02 0.00 0.00 0.00 0.00 179.25 179.32 2b0h h ALA 1967N 1.64 0.36 -0.01 0.00 0.00 -0.78 -3.07 119.26 117.40 2b0h h ALA 1967Ca 0.11 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 2b0h h ALA 1967Cb 0.19 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2b0h h ALA 1967CO -0.00 0.12 -0.66 -0.07 0.00 0.00 0.00 179.25 178.64 2b0h h LEU 1968N 0.26 0.07 -0.37 0.00 -0.00 -1.00 -3.12 115.31 111.15 2b0h h LEU 1968Ca 0.07 -0.05 0.00 0.00 -0.00 0.00 0.00 57.88 57.91 2b0h h LEU 1968Cb 0.45 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.09 2b0h h LEU 1968CO 0.02 0.71 0.00 0.00 -0.00 0.00 0.00 178.44 179.17 2b0h n GLN 1969N -3.77 1.00 -0.52 1.13 6.02 -0.48 -4.79 117.38 115.97 2b0h n GLN 1969Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2b0h n GLN 1969Cb 0.65 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.73 2b0h n GLN 1969CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b0h n ALA 1970N -0.31 0.00 0.00 -1.58 0.00 -1.18 -4.73 120.51 112.70 2b0h n ALA 1970Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2b0h n ALA 1970Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.54 2b0h n ALA 1970CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b0h n GLY 1971N 5.00 0.44 0.25 0.00 0.00 -1.26 -4.38 105.19 105.25 2b0h n GLY 1971Ca 0.00 -1.43 0.14 0.00 0.00 0.00 0.00 46.02 44.73 2b0h n GLY 1971CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2b0h n ASN 1972N 0.00 0.89 -0.25 1.61 0.23 -1.26 -5.12 115.26 111.36 2b0h n ASN 1972Ca 0.00 -0.97 0.15 0.00 -0.53 0.00 0.00 54.58 53.22 2b0h n ASN 1972Cb 0.00 0.02 0.73 0.00 -2.08 0.00 0.00 39.78 38.44 2b0h n ASN 1972CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19