#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b0h n ILE 1838N 0.00 -9.06 -4.60 -0.61 5.41 -1.26 -5.07 119.36 104.16 2b0h n ILE 1838Ca 0.00 1.67 -0.27 0.00 1.00 0.00 0.00 62.75 65.15 2b0h n ILE 1838Cb 0.00 -5.46 -0.14 0.00 -0.71 0.00 0.00 39.64 33.33 2b0h n ILE 1838CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 2b0h s ASP 1839N -0.49 2.80 -0.06 4.38 -4.77 -1.26 -5.03 116.67 112.24 2b0h s ASP 1839Ca -0.16 -0.61 0.07 0.00 -3.30 0.00 0.00 52.55 48.55 2b0h s ASP 1839Cb 0.01 -0.22 0.30 0.00 -1.09 0.00 0.00 42.92 41.92 2b0h s ASP 1839CO 0.49 0.17 1.08 -0.81 0.70 0.00 0.00 175.17 176.81 2b0h n PRO 1840N 1.53 2.19 -1.97 2.11 -0.04 -1.26 -4.63 135.00 132.93 2b0h n PRO 1840Ca -0.18 -1.16 -0.41 0.00 -0.04 0.00 0.00 63.50 61.71 2b0h n PRO 1840Cb 0.53 -1.57 -0.00 0.00 -0.04 0.00 0.00 33.50 32.42 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 0.29 2.95 0.03 0.54 3.72 -1.26 -4.27 117.46 119.46 2b0h n PHE 1841Ca 0.10 -2.89 0.00 0.00 -0.05 0.00 0.00 57.45 54.62 2b0h n PHE 1841Cb 0.47 -2.16 0.01 0.00 -0.94 0.00 0.00 39.48 36.85 2b0h n PHE 1841CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2b0h n THR 1842N 3.52 0.13 -4.10 4.37 -2.24 -1.26 -5.04 114.28 109.66 2b0h n THR 1842Ca 0.53 -0.57 -0.04 0.00 -2.27 0.00 0.00 64.05 61.70 2b0h n THR 1842Cb 0.33 0.95 -0.01 0.00 -2.10 0.00 0.00 70.33 69.50 2b0h n THR 1842CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2b0h n MET 1843N -0.01 1.57 0.00 -0.78 2.81 -1.26 -4.98 117.12 114.47 2b0h n MET 1843Ca 0.01 -0.53 0.00 0.00 -1.81 0.00 0.00 57.70 55.37 2b0h n MET 1843Cb 0.06 0.18 0.00 0.00 -0.71 0.00 0.00 33.22 32.74 2b0h n MET 1843CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2b0h n GLY 1844N 3.53 1.87 3.71 3.03 0.00 -1.26 -4.78 105.19 111.28 2b0h n GLY 1844Ca -0.02 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 2b0h n GLY 1844CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b0h s ASP 1845N -4.00 5.78 0.26 1.61 1.01 -1.26 -5.01 116.67 115.07 2b0h s ASP 1845Ca 0.00 0.19 -0.04 0.00 0.71 0.00 0.00 52.55 53.41 2b0h s ASP 1845Cb 0.00 -1.91 0.35 0.00 1.01 0.00 0.00 42.92 42.37 2b0h s ASP 1845CO 0.00 0.26 1.90 -0.65 0.21 0.00 0.00 175.17 176.90 2b0h h PRO 1846N 6.04 1.22 -0.35 8.23 0.11 -1.95 -1.32 132.00 143.98 2b0h h PRO 1846Ca -0.44 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2b0h h PRO 1846Cb 1.18 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2b0h h PRO 1846CO 0.66 0.81 0.00 -0.85 -0.21 0.00 0.00 178.00 178.40 2b0h n GLU 1847N -4.45 2.36 0.00 1.05 0.00 -1.26 -4.67 120.64 113.67 2b0h n GLU 1847Ca 0.14 -2.05 0.00 0.00 0.00 0.00 0.00 57.16 55.25 2b0h n GLU 1847Cb 0.11 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.06 2b0h n GLU 1847CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2b0h n GLY 1848N 1.43 2.64 1.85 -1.84 0.00 -0.50 -2.71 105.19 106.07 2b0h n GLY 1848Ca 0.19 -0.39 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 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 2.90 5.05 0.22 1.61 7.64 -1.26 -4.50 113.62 125.28 2b0h n SER 1849Ca 0.00 -3.08 0.15 0.00 1.01 0.00 0.00 58.87 56.96 2b0h n SER 1849Cb 0.00 -0.87 0.80 0.00 -1.01 0.00 0.00 64.21 63.13 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 1.08 0.00 0.00 1.43 3.57 -1.85 -0.77 116.94 120.39 2b0h h PHE 1850Ca 0.37 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.84 2b0h h PHE 1850Cb 1.51 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.24 2b0h h PHE 1850CO 0.94 0.00 -0.12 -0.39 -2.23 0.00 0.00 178.31 176.51 2b0h h VAL 1851N 0.00 0.95 0.07 1.41 -1.51 -1.88 0.14 116.25 115.43 2b0h h VAL 1851Ca 0.07 -0.42 -0.10 0.00 -1.23 0.00 0.00 66.70 65.02 2b0h h VAL 1851Cb 0.34 1.24 0.01 0.00 -2.13 0.00 0.00 31.29 30.74 2b0h h VAL 1851CO -0.00 0.12 -0.44 -0.78 -1.23 0.00 0.00 177.57 175.24 2b0h h ASP 1852N 0.00 0.22 -0.66 4.19 3.58 -1.52 -3.23 116.42 119.01 2b0h h ASP 1852Ca -0.00 -0.96 -0.01 0.00 0.42 0.00 0.00 57.03 56.48 2b0h h ASP 1852Cb 0.23 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.17 2b0h h ASP 1852CO 0.02 1.21 0.38 1.88 -2.88 0.00 0.00 179.24 179.84 2b0h h TYR 1853N -0.70 0.90 0.73 0.28 0.05 -1.34 0.10 116.97 116.98 2b0h h TYR 1853Ca -0.08 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.66 2b0h h TYR 1853Cb 1.32 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.75 2b0h h TYR 1853CO 0.23 0.62 -0.50 0.37 -1.05 0.00 0.00 178.16 177.83 2b0h h GLN 1854N 0.93 -1.13 -0.23 4.88 4.15 -0.86 -3.06 115.11 119.79 2b0h h GLN 1854Ca 0.24 0.08 -0.09 0.00 0.77 0.00 0.00 58.65 59.64 2b0h h GLN 1854Cb 0.01 0.26 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2b0h h GLN 1854CO -0.04 -0.75 -0.26 1.15 -1.93 0.00 0.00 178.83 177.00 2b0h h THR 1855N -1.17 1.26 -0.27 2.39 2.02 -1.51 -3.00 112.91 112.63 2b0h h THR 1855Ca -0.10 -1.26 -0.03 0.00 0.77 0.00 0.00 66.41 65.79 2b0h h THR 1855Cb 0.96 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 2b0h h THR 1855CO 0.06 0.40 0.05 0.00 0.37 0.00 0.00 175.52 176.40 2b0h h THR 1856N 0.39 1.23 0.01 3.16 1.03 -0.96 -2.58 112.91 115.19 2b0h h THR 1856Ca 0.06 -0.76 -0.23 0.00 -0.01 0.00 0.00 66.41 65.47 2b0h h THR 1856Cb 0.66 1.20 -0.03 0.00 -1.07 0.00 0.00 68.15 68.91 2b0h h THR 1856CO 0.05 0.25 -1.17 0.00 -0.01 0.00 0.00 175.52 174.64 2b0h h MET 1857N 0.27 0.03 0.00 0.00 -0.00 -1.58 -3.05 114.93 110.61 2b0h h MET 1857Ca 0.08 -0.05 -0.04 0.00 -0.00 0.00 0.00 59.70 59.69 2b0h h MET 1857Cb 0.32 0.02 -0.01 0.00 -0.00 0.00 0.00 31.60 31.93 2b0h h MET 1857CO 0.00 0.93 -0.20 -0.39 -0.00 0.00 0.00 176.91 177.26 2b0h h VAL 1858N 0.01 1.12 -0.35 -0.10 -1.51 -1.50 0.35 116.25 114.28 2b0h h VAL 1858Ca -0.08 -0.68 -0.03 0.00 -1.23 0.00 0.00 66.70 64.68 2b0h h VAL 1858Cb 1.84 1.37 -0.01 0.00 -2.13 0.00 0.00 31.29 32.35 2b0h h VAL 1858CO 0.13 0.19 0.10 0.03 -1.23 0.00 0.00 177.57 176.79 2b0h h ARG 1859N 0.00 0.54 -0.48 5.19 2.47 -1.41 -2.49 114.38 118.21 2b0h h ARG 1859Ca -0.00 -0.12 -0.12 0.00 -1.26 0.00 0.00 59.98 58.48 2b0h h ARG 1859Cb 0.35 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.58 2b0h h ARG 1859CO 0.03 0.57 -0.17 1.15 0.56 0.00 0.00 179.97 182.10 2b0h h THR 1860N 0.41 1.27 -0.78 2.04 2.02 -1.12 -2.85 112.91 113.89 2b0h h THR 1860Ca 0.11 -1.32 0.03 0.00 0.77 0.00 0.00 66.41 66.00 2b0h h THR 1860Cb 0.26 1.08 -0.05 0.00 -1.74 0.00 0.00 68.15 67.70 2b0h h THR 1860CO -0.00 0.46 0.50 0.00 0.37 0.00 0.00 175.52 176.84 2b0h h ALA 1861N 0.96 1.03 -0.73 6.16 0.00 -0.27 -0.78 119.26 125.64 2b0h h ALA 1861Ca 0.12 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2b0h h ALA 1861Cb 0.73 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2b0h h ALA 1861CO 0.06 0.31 0.25 0.87 0.00 0.00 0.00 179.25 180.74 2b0h h LYS 1862N 0.97 1.11 -0.36 0.00 1.57 -1.33 -0.68 116.57 117.85 2b0h h LYS 1862Ca 0.31 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 2b0h h LYS 1862Cb 0.01 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 2b0h h LYS 1862CO -0.11 0.93 -0.14 0.00 -0.57 0.00 0.00 179.45 179.56 2b0h h ALA 1863N 1.19 1.10 -0.25 3.86 0.00 -1.12 -1.58 119.26 122.46 2b0h h ALA 1863Ca 0.24 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2b0h h ALA 1863Cb 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2b0h h ALA 1863CO -0.01 0.56 -0.03 0.82 0.00 0.00 0.00 179.25 180.58 2b0h h ILE 1864N 0.58 1.27 -0.65 0.00 2.04 -0.79 -2.55 117.51 117.41 2b0h h ILE 1864Ca 0.10 -0.99 0.04 0.00 1.00 0.00 0.00 64.86 65.00 2b0h h ILE 1864Cb 0.57 1.43 -0.04 0.00 -0.74 0.00 0.00 36.82 38.03 2b0h h ILE 1864CO 0.04 0.31 0.39 0.00 0.00 0.00 0.00 178.15 178.89 2b0h h ALA 1865N 0.78 0.85 -0.15 1.87 0.00 -0.73 -0.71 119.26 121.18 2b0h h ALA 1865Ca 0.07 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2b0h h ALA 1865Cb 0.47 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2b0h h ALA 1865CO 0.02 0.13 -0.39 -0.24 0.00 0.00 0.00 179.25 178.77 2b0h h VAL 1866N 0.76 1.30 0.15 0.00 3.04 -1.33 -1.93 116.25 118.25 2b0h h VAL 1866Ca 0.27 -1.49 -0.01 0.00 -1.01 0.00 0.00 66.70 64.46 2b0h h VAL 1866Cb 0.06 1.61 0.00 0.00 -2.01 0.00 0.00 31.29 30.95 2b0h h VAL 1866CO -0.12 0.45 -0.07 0.74 -1.01 0.00 0.00 177.57 177.56 2b0h h THR 1867N 0.28 0.92 -0.09 3.17 2.02 -0.85 -0.03 112.91 118.33 2b0h h THR 1867Ca 0.03 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 2b0h h THR 1867Cb 0.81 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 2b0h h THR 1867CO 0.06 0.07 -0.06 -0.37 0.37 0.00 0.00 175.52 175.59 2b0h h VAL 1868N -0.35 1.11 0.00 3.16 -1.51 -1.09 0.76 116.25 118.33 2b0h h VAL 1868Ca -0.02 -0.45 -0.13 0.00 -1.23 0.00 0.00 66.70 64.87 2b0h h VAL 1868Cb 0.27 1.11 -0.02 0.00 -2.13 0.00 0.00 31.29 30.52 2b0h h VAL 1868CO 0.03 0.14 -0.60 -0.61 -1.23 0.00 0.00 177.57 175.30 2b0h h GLN 1869N 0.13 0.00 -0.04 5.19 5.75 -1.04 -2.01 115.11 123.10 2b0h h GLN 1869Ca 0.03 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.47 2b0h h GLN 1869Cb 0.20 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.76 2b0h h GLN 1869CO 0.01 0.60 -0.21 0.93 -2.65 0.00 0.00 178.83 177.52 2b0h h GLU 1870N 0.00 0.20 -0.53 1.69 5.08 0.51 -3.10 114.58 118.43 2b0h h GLU 1870Ca -0.01 -0.17 0.08 0.00 -1.00 0.00 0.00 59.36 58.26 2b0h h GLU 1870Cb 1.17 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.39 2b0h h GLU 1870CO 0.08 0.83 0.17 0.52 -1.00 0.00 0.00 179.01 179.62 2b0h h MET 1871N -0.37 0.33 -0.15 2.33 2.86 -0.71 0.26 114.93 119.49 2b0h h MET 1871Ca -0.02 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 2b0h h MET 1871Cb 0.88 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 2b0h h MET 1871CO 0.04 0.22 -0.32 -0.39 1.06 0.00 0.00 176.91 177.52 2b0h h VAL 1872N 0.34 1.28 -0.40 -2.22 -1.51 -1.50 -0.83 116.25 111.41 2b0h h VAL 1872Ca 0.26 -1.33 -0.14 0.00 -1.23 0.00 0.00 66.70 64.26 2b0h h VAL 1872Cb 0.31 1.53 -0.01 0.00 -2.13 0.00 0.00 31.29 30.99 2b0h h VAL 1872CO -0.28 0.40 -0.31 0.74 -1.23 0.00 0.00 177.57 176.89 2b0h h THR 1873N 0.25 1.27 -0.27 7.19 2.02 -1.01 -3.18 112.91 119.19 2b0h h THR 1873Ca 0.03 -1.47 -0.17 0.00 0.77 0.00 0.00 66.41 65.57 2b0h h THR 1873Cb 0.70 1.29 -0.00 0.00 -1.74 0.00 0.00 68.15 68.40 2b0h h THR 1873CO 0.05 0.49 -0.52 0.11 0.37 0.00 0.00 175.52 176.03 2b0h h LYS 1874N 0.75 0.77 -0.03 6.66 1.79 -0.20 -3.25 116.57 123.06 2b0h h LYS 1874Ca 0.08 -0.47 0.01 0.00 -2.18 0.00 0.00 60.65 58.09 2b0h h LYS 1874Cb 0.88 0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.57 2b0h h LYS 1874CO 0.08 1.09 0.17 0.66 -1.08 0.00 0.00 179.45 180.38 2b0h h SER 1875N 0.60 0.00 1.51 0.86 4.64 -1.14 0.92 113.55 120.93 2b0h h SER 1875Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2b0h h SER 1875Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2b0h h SER 1875CO 0.11 0.00 0.00 0.78 -0.87 0.00 0.00 176.83 176.85 2b0h h ASN 1876N 0.00 0.00 0.00 4.97 2.35 -1.69 -3.40 115.58 117.81 2b0h h ASN 1876Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2b0h h ASN 1876Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 2b0h h ASN 1876CO -0.00 0.00 0.00 0.35 -1.65 0.00 0.00 177.43 176.13 2b0h n THR 1877N -3.05 0.00 -3.93 2.81 -2.24 0.19 -5.04 114.28 103.03 2b0h n THR 1877Ca 0.02 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.50 2b0h n THR 1877Cb 0.42 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.50 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 -2.47 4.48 0.10 3.42 0.01 0.29 -4.93 113.70 114.60 2b0h s SER 1878Ca 0.00 -2.16 0.24 0.00 1.31 0.00 0.00 55.95 55.34 2b0h s SER 1878Cb 0.00 -1.42 0.29 0.00 0.21 0.00 0.00 66.02 65.10 2b0h s SER 1878CO 0.00 -0.37 1.26 -0.81 0.41 0.00 0.00 173.24 173.73 2b0h n PRO 1879N 4.23 0.28 0.08 12.44 -0.04 -1.26 -3.96 135.00 146.76 2b0h n PRO 1879Ca 0.03 0.06 -0.21 0.00 -0.04 0.00 0.00 63.50 63.34 2b0h n PRO 1879Cb 0.40 -1.65 -0.14 0.00 -0.04 0.00 0.00 33.50 32.07 2b0h n PRO 1879CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2b0h h GLU 1880N 0.00 0.46 0.00 0.54 4.11 -1.89 -3.17 114.58 114.63 2b0h h GLU 1880Ca 0.00 -0.69 0.00 0.00 0.07 0.00 0.00 59.36 58.74 2b0h h GLU 1880Cb 0.73 0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.22 2b0h h GLU 1880CO 0.00 1.31 0.00 -0.85 0.07 0.00 0.00 179.01 179.54 2b0h n GLU 1881N -3.96 0.07 0.31 1.06 0.28 -1.26 -2.18 120.64 114.97 2b0h n GLU 1881Ca -0.14 0.26 0.20 0.00 -0.16 0.00 0.00 57.16 57.32 2b0h n GLU 1881Cb 0.91 -1.62 1.02 0.00 1.43 0.00 0.00 31.44 33.18 2b0h n GLU 1881CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2b0h h LEU 1882N 0.00 0.00 0.81 -1.84 3.38 -1.72 -2.72 115.31 113.22 2b0h h LEU 1882Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2b0h h LEU 1882Cb 0.35 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.11 2b0h h LEU 1882CO 0.00 0.01 -0.39 1.23 0.09 0.00 0.00 178.44 179.38 2b0h h GLY 1883N 0.65 -1.13 0.14 0.83 0.00 -1.61 0.17 103.07 102.12 2b0h h GLY 1883Ca -0.00 0.42 0.19 0.00 0.00 0.00 0.00 47.33 47.93 2b0h h GLY 1883CO 0.00 -0.41 0.59 -2.55 0.00 0.00 0.00 176.54 174.17 2b0h h PRO 1884N -1.21 0.73 -0.76 4.80 0.11 -1.77 -1.09 132.00 132.82 2b0h h PRO 1884Ca -0.11 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.90 2b0h h PRO 1884Cb 0.83 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.74 2b0h h PRO 1884CO 0.18 0.48 0.27 -0.07 -0.21 0.00 0.00 178.00 178.65 2b0h h LEU 1885N 0.75 1.06 -0.43 2.35 3.38 -1.33 0.23 115.31 121.31 2b0h h LEU 1885Ca 0.57 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 58.33 2b0h h LEU 1885Cb 0.87 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2b0h h LEU 1885CO -0.38 0.96 0.15 0.00 0.09 0.00 0.00 178.44 179.26 2b0h h ALA 1886N 1.18 0.57 -0.78 1.53 0.00 0.45 -0.43 119.26 121.77 2b0h h ALA 1886Ca 0.25 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2b0h h ALA 1886Cb 0.26 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2b0h h ALA 1886CO -0.01 0.20 0.39 -0.91 0.00 0.00 0.00 179.25 178.92 2b0h h ASN 1887N 0.56 1.00 -0.32 0.00 2.35 -0.87 -1.15 115.58 117.15 2b0h h ASN 1887Ca 0.14 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2b0h h ASN 1887Cb 0.24 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 2b0h h ASN 1887CO -0.01 0.84 0.17 -0.61 -1.65 0.00 0.00 177.43 176.17 2b0h h GLN 1888N 1.11 0.45 -0.31 0.81 5.75 -0.08 0.18 115.11 123.01 2b0h h GLN 1888Ca 0.27 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.72 2b0h h GLN 1888Cb 0.09 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 2b0h h GLN 1888CO -0.04 0.38 0.20 1.25 -2.65 0.00 0.00 178.83 177.97 2b0h h LEU 1889N 0.40 0.35 -0.96 -2.39 6.46 -0.84 -1.54 115.31 116.79 2b0h h LEU 1889Ca 0.11 -0.01 0.06 0.00 -0.12 0.00 0.00 57.88 57.92 2b0h h LEU 1889Cb 0.06 -0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 39.84 2b0h h LEU 1889CO -0.02 0.26 0.61 0.74 -0.62 0.00 0.00 178.44 179.41 2b0h h THR 1890N 0.41 1.09 0.20 1.05 2.02 -0.73 -0.69 112.91 116.27 2b0h h THR 1890Ca 0.11 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 2b0h h THR 1890Cb -0.04 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.23 2b0h h THR 1890CO -0.02 0.21 -0.10 0.28 0.37 0.00 0.00 175.52 176.25 2b0h h SER 1891N 1.13 -0.23 -0.58 4.18 0.02 -0.27 -2.98 113.55 114.82 2b0h h SER 1891Ca 0.41 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 61.08 2b0h h SER 1891Cb 0.13 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 2b0h h SER 1891CO -0.16 0.12 0.18 0.44 -1.14 0.00 0.00 176.83 176.26 2b0h h ASP 1892N -0.61 0.88 -0.59 3.07 3.32 -1.06 -1.67 116.42 119.76 2b0h h ASP 1892Ca -0.03 -0.16 0.05 0.00 0.02 0.00 0.00 57.03 56.92 2b0h h ASP 1892Cb 0.44 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 2b0h h ASP 1892CO 0.05 0.84 0.39 0.22 -1.72 0.00 0.00 179.24 179.02 2b0h h TYR 1893N 0.91 0.61 -0.79 4.55 3.20 -1.17 -1.83 116.97 122.46 2b0h h TYR 1893Ca 0.20 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.13 2b0h h TYR 1893Cb 0.29 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.30 2b0h h TYR 1893CO 0.02 0.34 0.50 0.78 -1.64 0.00 0.00 178.16 178.16 2b0h h GLY 1894N 0.62 1.16 0.88 1.82 0.00 -1.14 -0.12 103.07 106.30 2b0h h GLY 1894Ca 0.25 -0.37 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 2b0h h GLY 1894CO -0.07 0.30 -0.01 -0.09 0.00 0.00 0.00 176.54 176.67 2b0h h ARG 1895N 0.95 0.52 -0.16 4.80 2.43 -1.34 -2.52 114.38 119.07 2b0h h ARG 1895Ca 0.33 -0.17 0.04 0.00 -0.81 0.00 0.00 59.98 59.36 2b0h h ARG 1895Cb 0.06 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.53 2b0h h ARG 1895CO -0.13 0.68 -0.08 1.25 -1.51 0.00 0.00 179.97 180.18 2b0h h LEU 1896N 0.30 -0.25 -1.95 3.80 5.85 -0.90 -1.27 115.31 120.89 2b0h h LEU 1896Ca 0.08 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 2b0h h LEU 1896Cb 0.45 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 2b0h h LEU 1896CO 0.02 -0.10 -0.11 0.00 -0.34 0.00 0.00 178.44 177.90 2b0h h ALA 1897N 1.08 1.37 0.00 1.25 0.00 -1.01 -1.54 119.26 120.42 2b0h h ALA 1897Ca 0.09 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2b0h h ALA 1897Cb 0.19 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2b0h h ALA 1897CO -0.20 0.14 -0.29 0.77 0.00 0.00 0.00 179.25 179.67 2b0h h SER 1898N 0.00 0.00 0.42 0.00 0.02 -0.81 -2.89 113.55 110.29 2b0h h SER 1898Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2b0h h SER 1898Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2b0h h SER 1898CO 0.01 0.14 -0.55 0.00 -1.14 0.00 0.00 176.83 175.30 2b0h n GLN 1899N -3.07 0.06 0.14 3.45 6.02 -0.64 -4.07 117.38 119.27 2b0h n GLN 1899Ca 0.03 -0.04 -0.24 0.00 -0.01 0.00 0.00 57.00 56.74 2b0h n GLN 1899Cb 0.59 -1.50 -0.16 0.00 1.02 0.00 0.00 30.24 30.20 2b0h n GLN 1899CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b0h h ALA 1900N 3.05 -0.14 0.61 -1.58 0.00 -1.17 -3.21 119.26 116.82 2b0h h ALA 1900Ca 0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 54.91 54.01 2b0h h ALA 1900Cb 0.50 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.48 2b0h h ALA 1900CO 0.00 0.72 -0.29 -0.22 0.00 0.00 0.00 179.25 179.46 2b0h h LYS 1901N 0.14 -0.79 0.00 0.00 3.64 -1.70 -2.01 116.57 115.85 2b0h h LYS 1901Ca -0.26 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 2b0h h LYS 1901Cb 2.16 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 34.16 2b0h h LYS 1901CO 0.27 -0.48 -0.07 -1.00 -2.27 0.00 0.00 179.45 175.90 2b0h h PRO 1902N -1.00 0.00 -0.09 1.90 0.13 -1.75 -1.38 132.00 129.81 2b0h h PRO 1902Ca -0.08 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.89 2b0h h PRO 1902Cb 0.68 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.80 2b0h h PRO 1902CO 0.14 0.07 -0.62 0.00 -0.23 0.00 0.00 178.00 177.36 2b0h h ALA 1903N 1.93 0.79 0.05 -0.56 0.00 -1.53 -2.77 119.26 117.17 2b0h h ALA 1903Ca -0.00 -0.55 -0.27 0.00 0.00 0.00 0.00 54.91 54.09 2b0h h ALA 1903Cb 0.33 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.06 2b0h h ALA 1903CO 0.01 0.73 -1.10 0.00 0.00 0.00 0.00 179.25 178.89 2b0h h ALA 1904N 1.12 0.14 0.00 0.00 0.00 -0.50 -0.93 119.26 119.10 2b0h h ALA 1904Ca -0.01 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2b0h h ALA 1904Cb 1.14 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2b0h h ALA 1904CO 0.10 0.75 0.00 1.33 0.00 0.00 0.00 179.25 181.43 2b0h n VAL 1905N -3.78 0.66 -0.02 0.00 0.24 -0.96 -2.60 118.33 111.88 2b0h n VAL 1905Ca -0.11 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 2b0h n VAL 1905Cb 0.92 -0.82 -0.13 0.00 -1.47 0.00 0.00 33.84 32.34 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 -1.74 2.04 -1.99 2.33 0.00 -1.05 -4.92 120.51 115.18 2b0h n ALA 1906Ca 0.04 -0.78 -0.43 0.00 0.00 0.00 0.00 53.44 52.28 2b0h n ALA 1906Cb 0.33 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.09 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 -2.96 3.36 0.17 0.00 0.00 -0.36 -4.42 121.76 117.56 2b0h s ALA 1907Ca -0.06 0.73 0.03 0.00 0.00 0.00 0.00 51.96 52.65 2b0h s ALA 1907Cb 0.09 -3.84 0.03 0.00 0.00 0.00 0.00 23.12 19.40 2b0h s ALA 1907CO 0.84 -1.81 1.40 1.05 0.00 0.00 0.00 175.76 177.24 2b0h h GLU 1908N 10.71 0.18 -6.42 0.00 4.11 -1.87 -3.44 114.58 117.85 2b0h h GLU 1908Ca -0.38 -0.19 -0.53 0.00 0.07 0.00 0.00 59.36 58.33 2b0h h GLU 1908Cb 1.18 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 2b0h h GLU 1908CO 0.98 0.92 0.34 1.21 0.07 0.00 0.00 179.01 182.52 2b0h s ASN 1909N -6.91 7.37 0.15 3.06 3.84 -1.26 -4.96 114.94 116.23 2b0h s ASN 1909Ca -0.03 1.65 -0.21 0.00 0.21 0.00 0.00 52.86 54.49 2b0h s ASN 1909Cb 0.10 -2.56 0.03 0.00 -0.55 0.00 0.00 41.25 38.28 2b0h s ASN 1909CO 0.82 -0.18 1.65 -0.08 -2.79 0.00 0.00 177.10 176.53 2b0h h GLU 1910N 6.37 -0.15 -0.23 0.43 4.81 -2.01 -2.55 114.58 121.25 2b0h h GLU 1910Ca -0.42 0.01 -0.16 0.00 -0.13 0.00 0.00 59.36 58.66 2b0h h GLU 1910Cb 1.21 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 2b0h h GLU 1910CO 0.74 -0.10 -0.52 0.93 -0.73 0.00 0.00 179.01 179.32 2b0h h GLU 1911N -0.16 0.65 0.09 1.92 5.08 -1.98 -1.84 114.58 118.35 2b0h h GLU 1911Ca 0.14 -0.40 0.02 0.00 -1.00 0.00 0.00 59.36 58.12 2b0h h GLU 1911Cb 0.37 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 2b0h h GLU 1911CO -0.34 1.01 -0.20 0.82 -1.00 0.00 0.00 179.01 179.30 2b0h h ILE 1912N 0.50 0.55 -0.30 3.13 2.04 -1.81 0.47 117.51 122.09 2b0h h ILE 1912Ca 0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.84 2b0h h ILE 1912Cb 1.08 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2b0h h ILE 1912CO 0.10 0.00 0.05 1.23 0.00 0.00 0.00 178.15 179.53 2b0h h GLY 1913N -0.37 0.48 0.51 5.37 0.00 -1.40 -2.25 103.07 105.41 2b0h h GLY 1913Ca 0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2b0h h GLY 1913CO -0.12 0.23 -0.16 0.00 0.00 0.00 0.00 176.54 176.49 2b0h h ALA 1914N 1.62 0.07 -0.98 3.60 0.00 -0.64 -3.26 119.26 119.68 2b0h h ALA 1914Ca 0.10 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.63 2b0h h ALA 1914Cb 0.21 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2b0h h ALA 1914CO 0.00 0.01 0.65 0.45 0.00 0.00 0.00 179.25 180.36 2b0h h HIS 1915N -0.40 1.23 0.23 0.00 -0.00 0.07 0.08 115.15 116.36 2b0h h HIS 1915Ca -0.01 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.39 2b0h h HIS 1915Cb 0.82 -0.42 -0.04 0.00 -0.00 0.00 0.00 27.41 27.78 2b0h h HIS 1915CO 0.14 0.77 -0.50 0.82 -0.00 0.00 0.00 177.93 179.16 2b0h h ILE 1916N 1.32 0.04 -0.19 2.45 2.04 -1.47 0.57 117.51 122.27 2b0h h ILE 1916Ca 0.36 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 66.06 2b0h h ILE 1916Cb -0.15 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 35.96 2b0h h ILE 1916CO -0.08 0.00 -0.53 0.11 0.00 0.00 0.00 178.15 177.65 2b0h h LYS 1917N -0.81 0.56 -0.90 2.37 6.56 -1.57 -2.45 116.57 120.34 2b0h h LYS 1917Ca -0.02 -0.34 0.07 0.00 -1.06 0.00 0.00 60.65 59.30 2b0h h LYS 1917Cb 0.78 0.04 -0.06 0.00 -0.57 0.00 0.00 32.23 32.41 2b0h h LYS 1917CO -0.22 0.95 0.56 0.45 -2.06 0.00 0.00 179.45 179.13 2b0h h HIS 1918N 0.43 1.03 0.04 -1.35 3.86 -0.66 0.33 115.15 118.83 2b0h h HIS 1918Ca 0.01 0.03 -0.18 0.00 -1.16 0.00 0.00 60.37 59.07 2b0h h HIS 1918Cb 1.07 -0.33 0.02 0.00 1.06 0.00 0.00 27.41 29.22 2b0h h HIS 1918CO 0.04 0.51 -0.74 0.00 0.86 0.00 0.00 177.93 178.61 2b0h h ARG 1919N 1.01 0.43 -0.04 2.45 2.47 -0.81 -2.86 114.38 117.03 2b0h h ARG 1919Ca 0.40 -0.52 -0.14 0.00 -1.26 0.00 0.00 59.98 58.46 2b0h h ARG 1919Cb 0.20 0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 2b0h h ARG 1919CO -0.18 1.17 -0.60 -0.39 0.56 0.00 0.00 179.97 180.53 2b0h h VAL 1920N -0.09 1.40 -0.35 2.04 -1.51 -1.19 0.24 116.25 116.79 2b0h h VAL 1920Ca -0.10 -2.00 -0.05 0.00 -1.23 0.00 0.00 66.70 63.32 2b0h h VAL 1920Cb 1.47 2.04 -0.01 0.00 -2.13 0.00 0.00 31.29 32.65 2b0h h VAL 1920CO 0.14 0.58 0.03 -0.61 -1.23 0.00 0.00 177.57 176.49 2b0h h GLN 1921N 0.10 0.60 -0.07 5.19 -0.00 -0.44 0.56 115.11 121.05 2b0h h GLN 1921Ca -0.01 -0.17 -0.10 0.00 -0.00 0.00 0.00 58.65 58.37 2b0h h GLN 1921Cb 1.08 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.48 2b0h h GLN 1921CO 0.09 0.69 -0.44 0.93 0.00 0.00 0.00 178.83 180.10 2b0h h GLU 1922N 0.42 0.15 0.00 1.69 4.39 -1.32 -1.93 114.58 117.98 2b0h h GLU 1922Ca 0.10 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 2b0h h GLU 1922Cb 0.40 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 2b0h h GLU 1922CO 0.01 0.56 -0.26 -0.07 -1.16 0.00 0.00 179.01 178.10 2b0h h LEU 1923N 0.13 0.00 -0.24 1.33 3.38 -0.12 -1.60 115.31 118.19 2b0h h LEU 1923Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2b0h h LEU 1923Cb 0.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2b0h h LEU 1923CO 0.06 0.26 0.12 1.23 0.09 0.00 0.00 178.44 180.20 2b0h h GLY 1924N 0.84 0.36 0.90 0.83 0.00 -0.09 0.40 103.07 106.31 2b0h h GLY 1924Ca -0.00 -0.18 0.02 0.00 0.00 0.00 0.00 47.33 47.17 2b0h h GLY 1924CO 0.03 0.17 0.18 0.45 0.00 0.00 0.00 176.54 177.37 2b0h h HIS 1925N 0.26 0.33 -0.24 5.60 3.86 -1.28 0.65 115.15 124.34 2b0h h HIS 1925Ca 0.08 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 2b0h h HIS 1925Cb 0.10 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 2b0h h HIS 1925CO -0.03 0.19 0.12 0.78 0.86 0.00 0.00 177.93 179.85 2b0h h GLY 1926N 0.37 0.36 0.89 2.45 0.00 -1.10 0.21 103.07 106.25 2b0h h GLY 1926Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2b0h h GLY 1926CO -0.07 0.17 -0.08 0.00 0.00 0.00 0.00 176.54 176.56 2b0h h SER 1928N -0.17 1.09 -0.17 0.00 0.87 -0.77 -0.31 113.55 114.08 2b0h h SER 1928Ca 0.01 -0.16 -0.07 0.00 -1.23 0.00 0.00 61.79 60.34 2b0h h SER 1928Cb 0.17 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 61.84 2b0h h SER 1928CO -0.03 0.95 -0.15 0.00 -0.53 0.00 0.00 176.83 177.07 2b0h h ALA 1929N 1.20 0.25 -0.15 6.23 0.00 -0.76 -2.51 119.26 123.52 2b0h h ALA 1929Ca 0.27 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b0h h ALA 1929Cb 0.19 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2b0h h ALA 1929CO -0.02 0.14 0.09 1.25 0.00 0.00 0.00 179.25 180.70 2b0h h LEU 1930N 0.06 0.15 -1.41 0.00 6.46 -0.25 -1.28 115.31 119.03 2b0h h LEU 1930Ca 0.03 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.74 2b0h h LEU 1930Cb 0.68 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 2b0h h LEU 1930CO 0.04 0.11 -0.17 -0.37 -0.62 0.00 0.00 178.44 177.42 2b0h h VAL 1931N 0.19 1.18 -0.46 1.05 -1.51 -1.11 0.35 116.25 115.94 2b0h h VAL 1931Ca 0.06 -0.83 -0.07 0.00 -1.23 0.00 0.00 66.70 64.63 2b0h h VAL 1931Cb -0.01 1.30 -0.02 0.00 -2.13 0.00 0.00 31.29 30.43 2b0h h VAL 1931CO -0.03 0.25 -0.00 0.74 -1.23 0.00 0.00 177.57 177.30 2b0h h THR 1932N 0.16 1.26 -0.08 7.19 2.02 -0.97 -0.93 112.91 121.57 2b0h h THR 1932Ca 0.03 -1.06 -0.17 0.00 0.77 0.00 0.00 66.41 65.98 2b0h h THR 1932Cb 0.41 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 2b0h h THR 1932CO 0.03 0.37 -0.69 0.11 0.37 0.00 0.00 175.52 175.70 2b0h h LYS 1933N 0.67 0.35 -0.21 6.66 1.79 -0.46 0.38 116.57 125.74 2b0h h LYS 1933Ca 0.13 -0.27 -0.00 0.00 -2.18 0.00 0.00 60.65 58.33 2b0h h LYS 1933Cb 0.51 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.20 2b0h h LYS 1933CO 0.02 0.91 0.13 0.00 -1.08 0.00 0.00 179.45 179.43 2b0h h ALA 1934N 1.02 0.27 -0.05 3.86 0.00 -0.20 0.12 119.26 124.28 2b0h h ALA 1934Ca -0.02 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 2b0h h ALA 1934Cb 1.25 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2b0h h ALA 1934CO 0.11 -0.23 -0.47 0.78 0.00 0.00 0.00 179.25 179.45 2b0h h GLY 1935N 0.26 0.13 0.67 0.00 0.00 -1.09 -0.06 103.07 102.98 2b0h h GLY 1935Ca 0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 2b0h h GLY 1935CO -0.01 0.12 -0.01 0.00 0.00 0.00 0.00 176.54 176.63 2b0h h ALA 1936N 1.43 0.05 -0.06 3.60 0.00 -0.55 -2.52 119.26 121.21 2b0h h ALA 1936Ca 0.00 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 2b0h h ALA 1936Cb 0.87 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2b0h h ALA 1936CO 0.07 -0.26 -0.34 1.25 0.00 0.00 0.00 179.25 179.96 2b0h h LEU 1937N -0.28 0.11 -1.07 0.00 5.85 -0.74 -2.15 115.31 117.04 2b0h h LEU 1937Ca 0.01 -0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.76 2b0h h LEU 1937Cb 0.38 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.31 2b0h h LEU 1937CO 0.00 0.46 0.62 -0.61 -0.34 0.00 0.00 178.44 178.57 2b0h h GLN 1938N 0.10 1.08 0.00 1.25 4.15 -0.83 -1.35 115.11 119.50 2b0h h GLN 1938Ca 0.01 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2b0h h GLN 1938Cb 0.66 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 28.11 2b0h h GLN 1938CO 0.05 0.71 -0.47 0.00 -1.93 0.00 0.00 178.83 177.19 2b0h s SER 1940N -3.85 0.57 0.06 0.00 0.01 -0.54 -4.98 113.70 104.97 2b0h s SER 1940Ca 0.09 -1.67 0.22 0.00 1.31 0.00 0.00 55.95 55.90 2b0h s SER 1940Cb 0.15 0.77 0.90 0.00 0.21 0.00 0.00 66.02 68.05 2b0h s SER 1940CO 0.69 -0.21 1.69 -0.81 0.41 0.00 0.00 173.24 175.00 2b0h n PRO 1941N 3.97 0.06 0.00 12.44 -0.04 -1.03 -2.85 135.00 147.54 2b0h n PRO 1941Ca 0.14 0.19 0.14 0.00 -0.04 0.00 0.00 63.50 63.92 2b0h n PRO 1941Cb 0.48 -1.59 0.50 0.00 -0.04 0.00 0.00 33.50 32.85 2b0h n PRO 1941CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2b0h n SER 1942N -1.69 0.68 -4.46 3.54 7.64 -1.26 -4.72 113.62 113.35 2b0h n SER 1942Ca 0.05 -0.65 -0.44 0.00 1.01 0.00 0.00 58.87 58.84 2b0h n SER 1942Cb 0.26 0.01 -0.06 0.00 -1.01 0.00 0.00 64.21 63.41 2b0h n SER 1942CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2b0h s ASP 1943N -2.53 6.23 0.23 6.43 2.15 -1.13 -4.92 116.67 123.14 2b0h s ASP 1943Ca 0.26 -0.83 0.02 0.00 0.43 0.00 0.00 52.55 52.42 2b0h s ASP 1943Cb 0.20 -2.29 0.25 0.00 -0.30 0.00 0.00 42.92 40.78 2b0h s ASP 1943CO 0.50 -0.86 1.58 1.62 -0.17 0.00 0.00 175.17 177.84 2b0h h VAL 1944N 5.86 1.34 -0.20 1.11 3.04 -1.89 -3.16 116.25 122.34 2b0h h VAL 1944Ca -0.27 -1.78 0.01 0.00 -1.01 0.00 0.00 66.70 63.64 2b0h h VAL 1944Cb 1.10 1.82 -0.02 0.00 -2.01 0.00 0.00 31.29 32.18 2b0h h VAL 1944CO 0.95 0.54 0.10 1.88 -1.01 0.00 0.00 177.57 180.03 2b0h h TYR 1945N 0.28 0.19 -0.90 3.17 0.05 -1.98 0.20 116.97 117.98 2b0h h TYR 1945Ca 0.01 0.01 0.06 0.00 0.05 0.00 0.00 58.73 58.86 2b0h h TYR 1945Cb 1.02 -0.06 -0.06 0.00 1.01 0.00 0.00 36.73 38.64 2b0h h TYR 1945CO 0.03 0.11 0.56 1.15 -1.05 0.00 0.00 178.16 178.97 2b0h h THR 1946N 0.22 1.06 -0.40 -2.88 2.02 -1.94 0.15 112.91 111.14 2b0h h THR 1946Ca 0.08 -0.35 -0.09 0.00 0.77 0.00 0.00 66.41 66.82 2b0h h THR 1946Cb 0.01 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.35 2b0h h THR 1946CO -0.05 0.19 -0.08 0.50 0.37 0.00 0.00 175.52 176.44 2b0h h LYS 1947N 1.03 0.76 -0.01 6.66 3.64 -1.33 -1.03 116.57 126.30 2b0h h LYS 1947Ca 0.39 -0.29 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2b0h h LYS 1947Cb 0.16 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 2b0h h LYS 1947CO -0.17 0.89 -0.06 0.87 -2.27 0.00 0.00 179.45 178.71 2b0h h LYS 1948N 0.58 -0.10 0.00 1.90 1.79 0.16 -2.13 116.57 118.77 2b0h h LYS 1948Ca 0.10 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.56 2b0h h LYS 1948Cb 0.60 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.27 2b0h h LYS 1948CO 0.04 -0.07 -0.10 0.93 -1.08 0.00 0.00 179.45 179.17 2b0h h GLU 1949N -0.10 0.00 -0.11 3.15 5.08 -0.63 0.93 114.58 122.90 2b0h h GLU 1949Ca 0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2b0h h GLU 1949Cb 0.14 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 2b0h h GLU 1949CO -0.07 0.10 0.05 1.25 -1.00 0.00 0.00 179.01 179.34 2b0h h LEU 1950N 0.00 0.15 -0.34 1.33 6.46 -0.54 0.15 115.31 122.53 2b0h h LEU 1950Ca -0.00 -0.15 -0.03 0.00 -0.12 0.00 0.00 57.88 57.58 2b0h h LEU 1950Cb 0.19 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 2b0h h LEU 1950CO 0.01 0.25 0.08 0.40 -0.62 0.00 0.00 178.44 178.56 2b0h h ILE 1951N 0.03 1.22 0.00 4.05 5.03 -0.95 -1.45 117.51 125.45 2b0h h ILE 1951Ca 0.04 -0.76 -0.01 0.00 -0.12 0.00 0.00 64.86 64.00 2b0h h ILE 1951Cb 0.15 1.08 -0.00 0.00 -3.03 0.00 0.00 36.82 35.02 2b0h h ILE 1951CO -0.00 0.26 -0.05 -0.33 -0.68 0.00 0.00 178.15 177.35 2b0h h GLU 1952N 0.39 0.00 0.16 2.37 4.39 -0.62 -0.84 114.58 120.44 2b0h h GLU 1952Ca 0.11 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.46 2b0h h GLU 1952Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2b0h h GLU 1952CO 0.00 0.05 -1.73 0.00 -1.16 0.00 0.00 179.01 176.17 2b0h h ALA 1954N 0.07 0.83 0.00 0.00 0.00 -0.70 -1.71 119.26 117.75 2b0h h ALA 1954Ca -0.35 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2b0h h ALA 1954Cb 2.02 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 2b0h h ALA 1954CO 0.14 0.40 -0.05 0.07 0.00 0.00 0.00 179.25 179.81 2b0h h ARG 1955N 0.89 0.00 -0.11 0.00 -0.00 -1.33 0.31 114.38 114.14 2b0h h ARG 1955Ca 0.22 0.00 -0.23 0.00 -0.00 0.00 0.00 59.98 59.97 2b0h h ARG 1955Cb 0.13 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.11 2b0h h ARG 1955CO -0.03 0.05 -0.83 0.00 -0.00 0.00 0.00 179.97 179.16 2b0h h ARG 1956N 0.00 0.72 0.00 0.08 3.08 -1.41 -3.25 114.38 113.59 2b0h h ARG 1956Ca -0.00 -0.62 -0.26 0.00 0.07 0.00 0.00 59.98 59.17 2b0h h ARG 1956Cb 0.17 0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 2b0h h ARG 1956CO 0.01 1.23 -1.44 -0.39 -1.07 0.00 0.00 179.97 178.30 2b0h h VAL 1957N 0.47 1.17 -0.13 2.04 -1.51 -1.00 -2.62 116.25 114.69 2b0h h VAL 1957Ca -0.07 -2.97 -0.07 0.00 -1.23 0.00 0.00 66.70 62.36 2b0h h VAL 1957Cb 1.46 2.58 -0.01 0.00 -2.13 0.00 0.00 31.29 33.19 2b0h h VAL 1957CO 0.16 0.67 -0.23 0.77 -1.23 0.00 0.00 177.57 177.72 2b0h h SER 1958N 0.00 0.22 1.13 4.19 4.64 -1.11 0.54 113.55 123.17 2b0h h SER 1958Ca -0.18 -0.06 -0.18 0.00 -0.47 0.00 0.00 61.79 60.90 2b0h h SER 1958Cb 1.92 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.93 2b0h h SER 1958CO 0.10 0.46 -0.86 -0.33 -0.87 0.00 0.00 176.83 175.33 2b0h h GLU 1959N 0.21 0.00 -0.04 4.77 4.39 -1.64 -3.13 114.58 119.14 2b0h h GLU 1959Ca 0.04 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.52 2b0h h GLU 1959Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2b0h h GLU 1959CO 0.04 0.86 -0.85 -0.22 -1.16 0.00 0.00 179.01 177.68 2b0h h LYS 1960N 0.00 0.45 -0.22 2.33 3.64 -0.77 -1.56 116.57 120.45 2b0h h LYS 1960Ca -0.01 -0.42 -0.08 0.00 -1.27 0.00 0.00 60.65 58.87 2b0h h LYS 1960Cb 1.66 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.58 2b0h h LYS 1960CO 0.11 1.07 -0.20 -0.39 -2.27 0.00 0.00 179.45 177.77 2b0h h VAL 1961N 0.28 1.24 0.00 2.00 -1.51 -0.08 -1.77 116.25 116.41 2b0h h VAL 1961Ca -0.06 -1.10 -0.06 0.00 -1.23 0.00 0.00 66.70 64.25 2b0h h VAL 1961Cb 1.46 1.30 -0.01 0.00 -2.13 0.00 0.00 31.29 31.91 2b0h h VAL 1961CO 0.15 0.35 -0.26 0.28 -1.23 0.00 0.00 177.57 176.85 2b0h h SER 1962N 0.35 0.00 1.24 4.19 0.02 -1.41 -1.56 113.55 116.39 2b0h h SER 1962Ca 0.06 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.92 2b0h h SER 1962Cb 0.56 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 2b0h h SER 1962CO 0.04 0.26 -0.42 0.45 -1.14 0.00 0.00 176.83 176.02 2b0h h HIS 1963N 0.00 0.00 -0.18 3.45 -0.00 -0.43 -1.96 115.15 116.02 2b0h h HIS 1963Ca -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.31 2b0h h HIS 1963Cb 0.62 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.03 2b0h h HIS 1963CO 0.00 0.42 -0.12 0.28 -0.00 0.00 0.00 177.93 178.51 2b0h h VAL 1964N 0.00 1.32 -0.55 2.45 2.07 -0.82 -1.00 116.25 119.73 2b0h h VAL 1964Ca -0.00 -1.21 0.09 0.00 0.82 0.00 0.00 66.70 66.40 2b0h h VAL 1964Cb 1.15 1.73 -0.07 0.00 -1.52 0.00 0.00 31.29 32.58 2b0h h VAL 1964CO 0.05 0.36 0.14 -0.07 0.02 0.00 0.00 177.57 178.08 2b0h h LEU 1965N 0.07 0.07 -0.32 2.57 3.38 -1.11 -1.67 115.31 118.30 2b0h h LEU 1965Ca 0.04 0.09 -0.19 0.00 0.09 0.00 0.00 57.88 57.91 2b0h h LEU 1965Cb 0.62 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2b0h h LEU 1965CO 0.03 0.06 -0.58 0.00 0.09 0.00 0.00 178.44 178.04 2b0h h ALA 1966N 1.41 0.49 -0.68 1.53 0.00 -1.38 -3.20 119.26 117.43 2b0h h ALA 1966Ca 0.28 -0.53 0.01 0.00 0.00 0.00 0.00 54.91 54.67 2b0h h ALA 1966Cb 0.37 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2b0h h ALA 1966CO -0.33 0.69 0.44 0.00 0.00 0.00 0.00 179.25 180.05 2b0h h ALA 1967N 0.73 0.87 0.00 0.00 0.00 -0.41 -1.87 119.26 118.57 2b0h h ALA 1967Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2b0h h ALA 1967Cb 1.18 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2b0h h ALA 1967CO 0.12 0.26 0.00 -0.07 0.00 0.00 0.00 179.25 179.56 2b0h h LEU 1968N 0.89 0.00 -2.80 0.00 -0.00 -1.40 -2.57 115.31 109.43 2b0h h LEU 1968Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.14 2b0h h LEU 1968Cb -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.59 2b0h h LEU 1968CO -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.37 2b0h n GLN 1969N -2.96 3.53 -2.64 1.13 6.02 -0.72 -4.91 117.38 116.82 2b0h n GLN 1969Ca 0.02 -2.49 -0.24 0.00 -0.01 0.00 0.00 57.00 54.28 2b0h n GLN 1969Cb 0.38 -1.87 0.03 0.00 1.02 0.00 0.00 30.24 29.80 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 -1.93 3.57 0.00 -1.58 0.00 -0.97 -4.90 121.76 115.94 2b0h s ALA 1970Ca 0.44 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.43 2b0h s ALA 1970Cb 0.30 -2.33 0.00 0.00 0.00 0.00 0.00 23.12 21.08 2b0h s ALA 1970CO 0.20 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.68 2b0h n GLY 1971N -2.39 0.87 0.03 0.00 0.00 -1.26 -4.54 105.19 97.90 2b0h n GLY 1971Ca 0.04 -1.41 -0.04 0.00 0.00 0.00 0.00 46.02 44.61 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 0.00 3.52 0.00 1.61 5.15 -1.26 -5.22 115.26 119.05 2b0h n ASN 1972Ca 0.00 -0.02 0.08 0.00 -0.60 0.00 0.00 54.58 54.03 2b0h n ASN 1972Cb 0.00 0.18 0.45 0.00 -0.53 0.00 0.00 39.78 39.88 2b0h n ASN 1972CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52