#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvp s ILE 1810N 0.00 -0.01 0.03 -0.61 1.10 -1.26 -5.17 121.20 115.29 2kvp s ILE 1810Ca 0.00 0.03 0.03 0.00 -0.51 0.00 0.00 60.65 60.20 2kvp s ILE 1810Cb 0.00 -0.71 -0.02 0.00 0.15 0.00 0.00 42.46 41.88 2kvp s ILE 1810CO 0.00 0.01 -0.11 1.51 -2.11 0.00 0.00 174.94 174.25 2kvp s ASP 1811N 0.77 1.23 0.00 4.50 -4.77 -1.26 -5.04 116.67 112.10 2kvp s ASP 1811Ca -0.04 -0.43 0.00 0.00 -3.30 0.00 0.00 52.55 48.78 2kvp s ASP 1811Cb -0.05 -0.05 0.00 0.00 -1.09 0.00 0.00 42.92 41.73 2kvp s ASP 1811CO -0.06 -0.04 0.55 -0.81 0.70 0.00 0.00 175.17 175.51 2kvp n PRO 1812N 1.91 0.68 -1.01 2.11 -0.04 -1.26 -3.73 135.00 133.66 2kvp n PRO 1812Ca -0.19 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.07 2kvp n PRO 1812Cb 0.55 -1.13 0.14 0.00 -0.04 0.00 0.00 33.50 33.02 2kvp n PRO 1812CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2kvp n PHE 1813N -0.24 2.50 -2.02 0.54 3.01 -1.26 -4.85 117.46 115.14 2kvp n PHE 1813Ca 0.00 -1.68 -0.29 0.00 1.01 0.00 0.00 57.45 56.50 2kvp n PHE 1813Cb 0.07 -0.85 -0.05 0.00 -0.01 0.00 0.00 39.48 38.64 2kvp n PHE 1813CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2kvp s THR 1814N -2.76 3.41 -0.34 4.37 2.01 -1.24 -4.92 115.64 116.16 2kvp s THR 1814Ca 0.47 -0.23 -0.29 0.00 0.31 0.00 0.00 61.69 61.94 2kvp s THR 1814Cb 0.39 -3.94 0.02 0.00 0.01 0.00 0.00 72.50 68.98 2kvp s THR 1814CO 0.08 -0.89 1.14 0.21 -0.69 0.00 0.00 174.62 174.48 2kvp s ASN 1815N 8.22 6.82 -1.12 3.53 3.84 -1.26 -3.94 114.94 131.03 2kvp s ASN 1815Ca 0.71 1.00 -0.21 0.00 0.21 0.00 0.00 52.86 54.56 2kvp s ASN 1815Cb -0.08 -2.54 -0.00 0.00 -0.55 0.00 0.00 41.25 38.07 2kvp s ASN 1815CO 0.04 -0.99 0.78 -0.62 -2.79 0.00 0.00 177.10 173.52 2kvp n GLU 1816N 7.14 -1.13 -3.62 0.43 4.71 -1.26 -4.99 120.64 121.92 2kvp n GLU 1816Ca 0.13 0.46 -0.03 0.00 -0.01 0.00 0.00 57.16 57.71 2kvp n GLU 1816Cb 0.47 -3.95 -0.06 0.00 -1.01 0.00 0.00 31.44 26.89 2kvp n GLU 1816CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2kvp s ALA 1817N -3.44 -2.22 0.51 0.62 0.00 -1.25 -5.17 121.76 110.81 2kvp s ALA 1817Ca 0.45 2.25 -0.05 0.00 0.00 0.00 0.00 51.96 54.61 2kvp s ALA 1817Cb -0.17 -1.69 -0.02 0.00 0.00 0.00 0.00 23.12 21.24 2kvp s ALA 1817CO 0.87 -0.46 0.81 0.00 0.00 0.00 0.00 175.76 176.98 2kvp s ALA 1818N 1.62 3.40 0.06 0.00 0.00 -1.26 -4.89 121.76 120.70 2kvp s ALA 1818Ca -0.08 -0.62 -0.34 0.00 0.00 0.00 0.00 51.96 50.92 2kvp s ALA 1818Cb -0.05 -2.55 -0.13 0.00 0.00 0.00 0.00 23.12 20.40 2kvp s ALA 1818CO -0.17 -0.49 1.70 0.43 0.00 0.00 0.00 175.76 177.23 2kvp n SER 1819N -2.34 3.24 -4.56 0.00 7.64 -1.26 -4.86 113.62 111.48 2kvp n SER 1819Ca 0.02 1.04 -0.36 0.00 1.01 0.00 0.00 58.87 60.58 2kvp n SER 1819Cb 0.56 -1.41 -0.04 0.00 -1.01 0.00 0.00 64.21 62.32 2kvp n SER 1819CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kvp s ALA 1820N 2.16 2.30 0.00 -0.43 0.00 -1.26 -4.43 121.76 120.10 2kvp s ALA 1820Ca 0.84 -1.78 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2kvp s ALA 1820Cb -0.68 -4.50 0.00 0.00 0.00 0.00 0.00 23.12 17.94 2kvp s ALA 1820CO 0.43 -4.04 0.00 0.00 0.00 0.00 0.00 175.76 172.15 2kvp n ALA 1821N 11.06 1.66 -2.15 0.00 0.00 -1.26 -5.03 120.51 124.78 2kvp n ALA 1821Ca 0.32 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.58 2kvp n ALA 1821Cb 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.92 2kvp n ALA 1821CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kvp n GLY 1822N 0.48 0.11 3.40 0.00 0.00 -1.26 -4.97 105.19 102.94 2kvp n GLY 1822Ca 0.00 -0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 2kvp n GLY 1822CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kvp s VAL 1823N -2.83 0.31 -0.49 1.61 -7.23 -1.26 -4.78 120.40 105.73 2kvp s VAL 1823Ca 0.00 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.02 2kvp s VAL 1823Cb 0.00 -2.41 0.09 0.00 0.56 0.00 0.00 36.38 34.62 2kvp s VAL 1823CO 0.00 0.00 0.41 -0.69 -0.31 0.00 0.00 175.10 174.51 2kvp s VAL 1824N -3.34 5.10 -0.01 1.32 1.01 -1.26 -4.80 120.40 118.41 2kvp s VAL 1824Ca 0.31 -1.25 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 2kvp s VAL 1824Cb 0.02 -4.13 -0.00 0.00 0.00 0.00 0.00 36.38 32.27 2kvp s VAL 1824CO 0.20 -0.67 -0.01 0.61 0.00 0.00 0.00 175.10 175.24 2kvp n GLY 1825N 5.18 -0.01 0.16 4.51 0.00 -1.26 -4.64 105.19 109.13 2kvp n GLY 1825Ca -0.13 -0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 2kvp n GLY 1825CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kvp h GLY 1826N -0.00 0.64 0.86 -0.02 0.00 -2.01 -3.25 103.07 99.28 2kvp h GLY 1826Ca -0.02 -1.41 0.00 0.00 0.00 0.00 0.00 47.33 45.91 2kvp h GLY 1826CO -0.01 1.24 -0.12 -0.33 0.00 0.00 0.00 176.54 177.32 2kvp h MET 1827N 0.23 -0.25 -0.22 4.80 2.86 -1.93 -2.09 114.93 118.33 2kvp h MET 1827Ca -0.19 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 2kvp h MET 1827Cb 1.97 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 33.67 2kvp h MET 1827CO 0.24 -0.17 0.08 -0.24 1.06 0.00 0.00 176.91 177.88 2kvp h VAL 1828N -0.26 1.09 -0.17 -2.22 3.04 -1.83 0.37 116.25 116.27 2kvp h VAL 1828Ca 0.00 -0.29 -0.06 0.00 -1.01 0.00 0.00 66.70 65.34 2kvp h VAL 1828Cb 0.25 0.84 -0.00 0.00 -2.01 0.00 0.00 31.29 30.37 2kvp h VAL 1828CO -0.03 0.11 -0.13 -0.78 -1.01 0.00 0.00 177.57 175.72 2kvp h ASP 1829N 0.30 0.41 -0.89 3.17 3.58 -1.53 -1.52 116.42 119.94 2kvp h ASP 1829Ca 0.08 -0.46 -0.01 0.00 0.42 0.00 0.00 57.03 57.06 2kvp h ASP 1829Cb 0.07 -0.11 -0.04 0.00 1.72 0.00 0.00 39.33 40.96 2kvp h ASP 1829CO -0.01 0.78 0.53 0.28 -2.88 0.00 0.00 179.24 177.94 2kvp h SER 1830N 0.05 1.09 -0.03 2.28 0.02 -0.58 0.77 113.55 117.14 2kvp h SER 1830Ca 0.03 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2kvp h SER 1830Cb 0.65 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 2kvp h SER 1830CO 0.04 0.85 0.02 0.40 -1.14 0.00 0.00 176.83 176.99 2kvp h ILE 1831N 1.24 1.05 -0.69 3.27 2.04 -0.89 -1.24 117.51 122.29 2kvp h ILE 1831Ca 0.32 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 66.00 2kvp h ILE 1831Cb -0.03 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2kvp h ILE 1831CO -0.06 0.04 0.21 0.74 0.00 0.00 0.00 178.15 179.08 2kvp h THR 1832N 0.00 1.25 -0.41 -0.27 2.02 -0.80 -1.84 112.91 112.87 2kvp h THR 1832Ca 0.01 -0.87 -0.08 0.00 0.77 0.00 0.00 66.41 66.24 2kvp h THR 1832Cb 0.04 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 2kvp h THR 1832CO -0.00 0.34 -0.08 -0.61 0.37 0.00 0.00 175.52 175.54 2kvp h GLN 1833N 1.02 0.70 -0.85 6.66 5.75 -0.73 -1.72 115.11 125.94 2kvp h GLN 1833Ca 0.22 -0.21 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 2kvp h GLN 1833Cb 0.29 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.73 2kvp h GLN 1833CO -0.01 0.77 0.44 0.00 -2.65 0.00 0.00 178.83 177.38 2kvp h ALA 1834N 1.27 1.10 0.26 3.38 0.00 -0.64 -1.01 119.26 123.61 2kvp h ALA 1834Ca 0.12 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2kvp h ALA 1834Cb 0.52 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2kvp h ALA 1834CO 0.03 0.64 -0.22 0.82 0.00 0.00 0.00 179.25 180.51 2kvp h ILE 1835N 1.20 0.52 0.37 0.00 2.04 -0.78 -2.96 117.51 117.90 2kvp h ILE 1835Ca 0.30 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.14 2kvp h ILE 1835Cb 0.08 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2kvp h ILE 1835CO -0.04 0.00 -0.22 0.78 0.00 0.00 0.00 178.15 178.67 2kvp h ASN 1836N -0.50 -0.53 -0.14 1.72 2.35 -1.04 -3.01 115.58 114.42 2kvp h ASN 1836Ca -0.01 0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2kvp h ASN 1836Cb 0.45 0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 2kvp h ASN 1836CO -0.03 -0.35 0.10 0.06 -1.65 0.00 0.00 177.43 175.56 2kvp h GLN 1837N -0.56 0.08 -0.02 0.81 3.07 -1.22 0.17 115.11 117.43 2kvp h GLN 1837Ca -0.04 -0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.69 2kvp h GLN 1837Cb 0.45 -0.02 -0.00 0.00 0.08 0.00 0.00 27.48 28.00 2kvp h GLN 1837CO 0.05 0.05 0.01 -0.07 0.09 0.00 0.00 178.83 178.97 2kvp h LEU 1838N 0.08 0.03 0.01 0.06 3.38 -1.38 -2.27 115.31 115.22 2kvp h LEU 1838Ca 0.06 -0.07 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 2kvp h LEU 1838Cb 0.14 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 2kvp h LEU 1838CO -0.01 0.09 -1.66 -0.78 0.09 0.00 0.00 178.44 176.18 2kvp h ASP 1839N -0.04 0.03 1.50 -0.43 3.58 -1.38 -3.24 116.42 116.44 2kvp h ASP 1839Ca 0.01 -0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.39 2kvp h ASP 1839Cb 0.07 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.11 2kvp h ASP 1839CO -0.00 1.06 -0.02 -0.33 -2.88 0.00 0.00 179.24 177.07 2kvp h GLU 1840N 0.01 0.00 0.00 0.28 5.08 -0.76 -3.44 114.58 115.74 2kvp h GLU 1840Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2kvp h GLU 1840Cb 1.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.24 2kvp h GLU 1840CO 0.09 0.02 0.00 0.41 -1.00 0.00 0.00 179.01 178.53 2kvp n GLY 1841N 0.58 -0.16 0.00 -3.84 0.00 -0.86 -5.00 105.19 95.92 2kvp n GLY 1841Ca 0.02 0.71 0.09 0.00 0.00 0.00 0.00 46.02 46.84 2kvp n GLY 1841CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kvp n PRO 1842N 0.00 0.15 0.00 1.61 -0.04 -1.22 -4.63 135.00 130.87 2kvp n PRO 1842Ca 0.00 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 2kvp n PRO 1842Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2kvp n PRO 1842CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2kvp n MET 1843N -1.37 0.00 -0.35 0.54 2.81 -1.26 -4.35 117.12 113.14 2kvp n MET 1843Ca 0.07 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 2kvp n MET 1843Cb 0.16 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.67 2kvp n MET 1843CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2kvp n GLY 1844N 0.00 0.57 2.47 3.03 0.00 -1.26 -5.07 105.19 104.92 2kvp n GLY 1844Ca 0.00 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 2kvp n GLY 1844CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2kvp n ASP 1845N -0.24 2.49 -4.66 1.61 5.75 -1.26 -5.04 116.55 115.20 2kvp n ASP 1845Ca 0.00 -3.25 -0.42 0.00 -0.01 0.00 0.00 54.79 51.11 2kvp n ASP 1845Cb 0.12 -0.62 -0.04 0.00 -1.03 0.00 0.00 41.12 39.55 2kvp n ASP 1845CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 2kvp s PRO 1846N -2.49 4.26 -0.04 0.11 0.05 -1.26 -4.67 135.00 130.96 2kvp s PRO 1846Ca 0.42 1.05 0.20 0.00 0.05 0.00 0.00 61.00 62.72 2kvp s PRO 1846Cb 0.24 -3.60 0.66 0.00 0.05 0.00 0.00 34.50 31.85 2kvp s PRO 1846CO -0.09 -0.42 1.56 0.39 0.05 0.00 0.00 177.00 178.49 2kvp n GLU 1847N 5.59 3.03 -3.83 4.56 1.02 -1.26 -4.96 120.64 124.78 2kvp n GLU 1847Ca 0.06 -2.65 -0.07 0.00 -0.02 0.00 0.00 57.16 54.48 2kvp n GLU 1847Cb 0.48 -1.68 0.02 0.00 -0.02 0.00 0.00 31.44 30.25 2kvp n GLU 1847CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2kvp s GLY 1848N -0.95 0.29 0.80 0.62 0.00 -1.26 -5.14 107.32 101.68 2kvp s GLY 1848Ca 0.48 -0.62 -0.12 0.00 0.00 0.00 0.00 44.72 44.47 2kvp s GLY 1848CO 0.29 0.63 1.17 -0.45 0.00 0.00 0.00 173.10 174.74 2kvp s SER 1849N -3.19 4.53 0.38 1.64 0.15 -1.26 -4.87 113.70 111.08 2kvp s SER 1849Ca 0.18 0.77 0.07 0.00 0.70 0.00 0.00 55.95 57.67 2kvp s SER 1849Cb -0.04 -1.27 0.79 0.00 -1.71 0.00 0.00 66.02 63.79 2kvp s SER 1849CO 0.09 -1.89 1.98 0.15 1.20 0.00 0.00 173.24 174.78 2kvp h PHE 1850N -1.03 0.68 -0.46 3.44 3.57 -1.92 -0.85 116.94 120.37 2kvp h PHE 1850Ca -0.46 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 60.99 2kvp h PHE 1850Cb 1.33 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 2kvp h PHE 1850CO 0.31 0.37 0.01 -0.24 -2.23 0.00 0.00 178.31 176.54 2kvp h VAL 1851N 0.68 1.23 0.05 1.41 3.04 -1.93 -0.67 116.25 120.07 2kvp h VAL 1851Ca 0.28 -0.96 -0.00 0.00 -1.01 0.00 0.00 66.70 65.01 2kvp h VAL 1851Cb 0.23 0.87 0.00 0.00 -2.01 0.00 0.00 31.29 30.38 2kvp h VAL 1851CO -0.09 0.34 -0.03 -0.78 -1.01 0.00 0.00 177.57 176.01 2kvp h ASP 1852N 0.71 -0.06 -0.09 3.17 3.58 -1.52 -0.01 116.42 122.20 2kvp h ASP 1852Ca 0.14 -0.22 -0.07 0.00 0.42 0.00 0.00 57.03 57.30 2kvp h ASP 1852Cb 0.42 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 2kvp h ASP 1852CO 0.02 0.19 -0.14 1.88 -2.88 0.00 0.00 179.24 178.31 2kvp h TYR 1853N -0.31 0.46 0.31 0.28 0.05 -1.41 -2.14 116.97 114.21 2kvp h TYR 1853Ca -0.01 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.69 2kvp h TYR 1853Cb 0.28 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 37.89 2kvp h TYR 1853CO 0.01 0.56 -0.15 0.37 -1.05 0.00 0.00 178.16 177.90 2kvp h GLN 1854N 0.40 -0.40 0.00 4.88 4.15 -0.85 0.15 115.11 123.45 2kvp h GLN 1854Ca 0.07 0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.52 2kvp h GLN 1854Cb 0.48 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.26 2kvp h GLN 1854CO 0.03 -0.23 -0.00 1.79 -1.93 0.00 0.00 178.83 178.49 2kvp h THR 1855N -0.47 0.87 0.01 2.39 1.35 -0.75 -1.13 112.91 115.19 2kvp h THR 1855Ca -0.04 -0.02 -0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2kvp h THR 1855Cb 0.35 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 2kvp h THR 1855CO 0.07 0.00 -0.01 0.74 -0.25 0.00 0.00 175.52 176.08 2kvp h THR 1856N 0.00 1.49 -0.86 6.82 2.02 -1.13 -3.33 112.91 117.93 2kvp h THR 1856Ca -0.00 -1.97 -0.03 0.00 0.77 0.00 0.00 66.41 65.19 2kvp h THR 1856Cb 0.01 2.75 -0.04 0.00 -1.74 0.00 0.00 68.15 69.13 2kvp h THR 1856CO 0.00 0.48 0.44 0.24 0.37 0.00 0.00 175.52 177.05 2kvp h MET 1857N -0.93 1.23 -0.24 6.66 2.07 -0.27 -2.11 114.93 121.34 2kvp h MET 1857Ca -0.00 -0.16 -0.03 0.00 -2.07 0.00 0.00 59.70 57.44 2kvp h MET 1857Cb 0.80 -0.23 -0.01 0.00 -1.87 0.00 0.00 31.60 30.29 2kvp h MET 1857CO 0.00 0.92 0.04 -0.39 1.07 0.00 0.00 176.91 178.55 2kvp h VAL 1858N 1.22 1.13 -0.01 -2.22 -1.51 -1.38 0.78 116.25 114.26 2kvp h VAL 1858Ca 0.30 -0.48 -0.01 0.00 -1.23 0.00 0.00 66.70 65.28 2kvp h VAL 1858Cb 0.08 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 30.15 2kvp h VAL 1858CO -0.04 0.17 -0.04 0.03 -1.23 0.00 0.00 177.57 176.46 2kvp h ARG 1859N 0.35 0.05 -0.23 5.19 3.08 -1.50 -2.63 114.38 118.69 2kvp h ARG 1859Ca 0.08 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 2kvp h ARG 1859Cb 0.17 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 2kvp h ARG 1859CO -0.00 0.64 -0.13 1.15 -1.07 0.00 0.00 179.97 180.56 2kvp h THR 1860N -0.54 1.21 -0.42 2.04 2.02 -1.17 -1.61 112.91 114.44 2kvp h THR 1860Ca -0.00 -0.92 -0.02 0.00 0.77 0.00 0.00 66.41 66.24 2kvp h THR 1860Cb 0.64 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 2kvp h THR 1860CO 0.01 0.30 0.20 0.00 0.37 0.00 0.00 175.52 176.39 2kvp h ALA 1861N 1.52 0.54 -0.72 6.16 0.00 -0.86 -0.27 119.26 125.64 2kvp h ALA 1861Ca 0.07 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2kvp h ALA 1861Cb 0.44 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2kvp h ALA 1861CO 0.03 0.11 0.47 0.87 0.00 0.00 0.00 179.25 180.73 2kvp h LYS 1862N 0.54 0.84 -0.03 0.00 1.57 -1.03 -0.40 116.57 118.05 2kvp h LYS 1862Ca 0.14 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2kvp h LYS 1862Cb 0.13 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 2kvp h LYS 1862CO -0.02 0.56 0.01 0.00 -0.57 0.00 0.00 179.45 179.43 2kvp h ALA 1863N 1.58 0.05 0.00 3.86 0.00 -0.52 -2.27 119.26 121.96 2kvp h ALA 1863Ca 0.29 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2kvp h ALA 1863Cb 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2kvp h ALA 1863CO -0.08 -0.32 -0.20 -0.84 0.00 0.00 0.00 179.25 177.80 2kvp h ILE 1864N -0.18 0.68 0.00 0.00 -0.00 -0.78 -1.24 117.51 115.99 2kvp h ILE 1864Ca 0.01 -0.86 -0.07 0.00 -0.00 0.00 0.00 64.86 63.94 2kvp h ILE 1864Cb 0.26 1.54 -0.01 0.00 -0.00 0.00 0.00 36.82 38.61 2kvp h ILE 1864CO 0.00 0.20 -0.34 0.00 -0.00 0.00 0.00 178.15 178.00 2kvp h ALA 1865N 1.80 1.32 -0.08 0.16 0.00 -0.78 -0.42 119.26 121.25 2kvp h ALA 1865Ca -0.00 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.41 2kvp h ALA 1865Cb 0.53 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2kvp h ALA 1865CO 0.03 0.43 -0.71 0.28 0.00 0.00 0.00 179.25 179.27 2kvp h VAL 1866N 0.00 1.37 -0.25 0.00 2.07 -0.65 -2.03 116.25 116.76 2kvp h VAL 1866Ca -0.00 -2.11 -0.05 0.00 0.82 0.00 0.00 66.70 65.36 2kvp h VAL 1866Cb 0.65 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 2kvp h VAL 1866CO 0.04 0.64 -0.03 0.74 0.02 0.00 0.00 177.57 178.98 2kvp h THR 1867N 0.28 1.27 -0.37 2.57 2.02 -1.03 0.29 112.91 117.94 2kvp h THR 1867Ca -0.03 -1.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.08 2kvp h THR 1867Cb 1.28 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 69.10 2kvp h THR 1867CO 0.12 0.31 -0.10 1.62 0.37 0.00 0.00 175.52 177.85 2kvp h VAL 1868N 0.22 1.24 0.00 3.16 3.04 -1.14 -0.58 116.25 122.19 2kvp h VAL 1868Ca 0.07 -1.06 -0.09 0.00 -1.01 0.00 0.00 66.70 64.62 2kvp h VAL 1868Cb 0.48 1.06 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 2kvp h VAL 1868CO 0.02 0.35 -0.41 0.06 -1.01 0.00 0.00 177.57 176.59 2kvp h GLN 1869N 0.58 0.00 -0.09 4.17 -0.00 -1.21 -2.52 115.11 116.05 2kvp h GLN 1869Ca 0.11 0.00 -0.18 0.00 -0.00 0.00 0.00 58.65 58.58 2kvp h GLN 1869Cb 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.98 2kvp h GLN 1869CO 0.03 0.41 -0.70 1.49 -0.00 0.00 0.00 178.83 180.06 2kvp h GLU 1870N 0.00 0.40 0.07 0.06 4.57 -0.21 -3.17 114.58 116.29 2kvp h GLU 1870Ca -0.00 -0.31 0.02 0.00 -1.18 0.00 0.00 59.36 57.89 2kvp h GLU 1870Cb 0.90 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.52 2kvp h GLU 1870CO 0.05 0.94 -0.21 0.52 -1.18 0.00 0.00 179.01 179.13 2kvp h MET 1871N 0.28 -0.36 -0.92 1.92 2.86 -0.68 0.52 114.93 118.54 2kvp h MET 1871Ca -0.02 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2kvp h MET 1871Cb 1.26 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.96 2kvp h MET 1871CO 0.12 -0.24 0.58 -0.24 1.06 0.00 0.00 176.91 178.19 2kvp h VAL 1872N -0.38 1.25 -0.17 -2.22 3.04 -1.61 0.21 116.25 116.37 2kvp h VAL 1872Ca 0.04 -0.50 -0.14 0.00 -1.01 0.00 0.00 66.70 65.09 2kvp h VAL 1872Cb 0.42 -0.08 0.00 0.00 -2.01 0.00 0.00 31.29 29.63 2kvp h VAL 1872CO -0.15 0.25 -0.44 0.74 -1.01 0.00 0.00 177.57 176.96 2kvp h THR 1873N 1.26 1.34 -0.05 3.17 2.02 -1.42 -3.16 112.91 116.07 2kvp h THR 1873Ca 0.33 -1.70 -0.18 0.00 0.77 0.00 0.00 66.41 65.64 2kvp h THR 1873Cb -0.09 1.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 2kvp h THR 1873CO -0.07 0.52 -0.74 0.11 0.37 0.00 0.00 175.52 175.71 2kvp h LYS 1874N 0.26 0.30 -0.03 6.66 1.79 0.36 -2.70 116.57 123.21 2kvp h LYS 1874Ca -0.01 -0.25 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 2kvp h LYS 1874Cb 1.06 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 31.76 2kvp h LYS 1874CO 0.10 0.91 -0.01 1.03 -1.08 0.00 0.00 179.45 180.39 2kvp h SER 1875N 0.20 0.03 1.49 0.86 0.87 -0.64 1.05 113.55 117.41 2kvp h SER 1875Ca -0.03 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.44 2kvp h SER 1875Cb 1.31 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 63.25 2kvp h SER 1875CO 0.12 0.05 -0.52 0.78 -0.53 0.00 0.00 176.83 176.73 2kvp h ASN 1876N 0.04 0.00 0.00 6.23 2.35 -1.47 -3.41 115.58 119.32 2kvp h ASN 1876Ca 0.01 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.53 2kvp h ASN 1876Cb 0.05 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.38 2kvp h ASN 1876CO 0.00 0.38 -1.81 0.35 -1.65 0.00 0.00 177.43 174.71 2kvp n THR 1877N -3.14 0.80 -3.30 2.81 -2.24 -0.34 -4.99 114.28 103.89 2kvp n THR 1877Ca 0.01 -0.26 -0.08 0.00 -2.27 0.00 0.00 64.05 61.46 2kvp n THR 1877Cb 0.70 -1.34 -0.06 0.00 -2.10 0.00 0.00 70.33 67.53 2kvp n THR 1877CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2kvp s SER 1878N -5.83 0.23 0.47 3.42 0.15 0.35 -5.03 113.70 107.46 2kvp s SER 1878Ca -0.20 -0.24 0.16 0.00 0.70 0.00 0.00 55.95 56.38 2kvp s SER 1878Cb 0.06 1.17 1.10 0.00 -1.71 0.00 0.00 66.02 66.65 2kvp s SER 1878CO 0.29 -0.34 2.03 1.55 1.20 0.00 0.00 173.24 177.97 2kvp h PRO 1879N 8.15 0.00 0.00 5.44 0.13 -1.80 -2.35 132.00 141.58 2kvp h PRO 1879Ca -0.10 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.99 2kvp h PRO 1879Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2kvp h PRO 1879CO 0.26 0.15 -0.20 1.05 -0.23 0.00 0.00 178.00 179.03 2kvp h GLU 1880N 0.00 0.00 0.00 0.86 4.11 -1.94 -2.22 114.58 115.40 2kvp h GLU 1880Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2kvp h GLU 1880Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2kvp h GLU 1880CO 0.02 0.20 0.00 0.39 0.07 0.00 0.00 179.01 179.69 2kvp n GLU 1881N -3.37 0.12 0.26 1.06 -0.58 -0.88 -2.35 120.64 114.89 2kvp n GLU 1881Ca 0.00 0.30 0.16 0.00 -0.42 0.00 0.00 57.16 57.20 2kvp n GLU 1881Cb 0.41 -1.70 0.57 0.00 -0.57 0.00 0.00 31.44 30.15 2kvp n GLU 1881CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2kvp h LEU 1882N 0.00 0.00 0.38 -4.62 3.38 -1.52 -3.04 115.31 109.89 2kvp h LEU 1882Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2kvp h LEU 1882Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2kvp h LEU 1882CO 0.00 0.00 -0.18 1.23 0.09 0.00 0.00 178.44 179.58 2kvp h GLY 1883N 2.48 -0.53 1.02 0.83 0.00 -1.65 0.14 103.07 105.36 2kvp h GLY 1883Ca 0.00 0.20 0.05 0.00 0.00 0.00 0.00 47.33 47.58 2kvp h GLY 1883CO 0.00 -0.19 0.53 -0.56 0.00 0.00 0.00 176.54 176.32 2kvp h PRO 1884N -0.85 0.91 -0.50 4.80 0.13 -1.76 -2.24 132.00 132.50 2kvp h PRO 1884Ca -0.05 -0.06 -0.10 0.00 -0.87 0.00 0.00 66.00 64.92 2kvp h PRO 1884Cb 0.54 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.45 2kvp h PRO 1884CO 0.09 0.61 -0.09 -0.07 -0.23 0.00 0.00 178.00 178.30 2kvp h LEU 1885N 0.94 0.95 -1.98 1.56 3.38 -1.47 0.12 115.31 118.81 2kvp h LEU 1885Ca 0.34 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2kvp h LEU 1885Cb 0.14 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2kvp h LEU 1885CO -0.11 1.08 0.04 0.00 0.09 0.00 0.00 178.44 179.54 2kvp h ALA 1886N 0.91 2.02 0.08 1.53 0.00 -0.31 0.27 119.26 123.75 2kvp h ALA 1886Ca 0.13 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2kvp h ALA 1886Cb 0.65 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2kvp h ALA 1886CO 0.04 -0.03 -0.04 -0.91 0.00 0.00 0.00 179.25 178.32 2kvp h ASN 1887N 0.03 -0.09 -0.40 0.00 2.35 -0.80 -3.15 115.58 113.53 2kvp h ASN 1887Ca 0.02 -0.51 -0.02 0.00 -0.55 0.00 0.00 56.30 55.24 2kvp h ASN 1887Cb 0.06 0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 2kvp h ASN 1887CO -0.00 0.53 0.16 -0.61 -1.65 0.00 0.00 177.43 175.86 2kvp h GLN 1888N -0.78 0.59 0.00 0.81 4.15 -0.40 0.24 115.11 119.72 2kvp h GLN 1888Ca -0.01 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.30 2kvp h GLN 1888Cb 0.60 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.19 2kvp h GLN 1888CO 0.02 0.55 -0.04 1.25 -1.93 0.00 0.00 178.83 178.68 2kvp h LEU 1889N 0.50 0.00 0.08 -2.39 5.85 -0.63 -1.90 115.31 116.82 2kvp h LEU 1889Ca 0.13 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 2kvp h LEU 1889Cb 0.18 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.22 2kvp h LEU 1889CO -0.01 0.04 -0.62 0.74 -0.34 0.00 0.00 178.44 178.25 2kvp h THR 1890N 0.00 1.53 0.08 1.05 2.02 -1.34 -3.09 112.91 113.16 2kvp h THR 1890Ca -0.00 -2.45 -0.00 0.00 0.77 0.00 0.00 66.41 64.73 2kvp h THR 1890Cb 0.09 3.18 0.00 0.00 -1.74 0.00 0.00 68.15 69.68 2kvp h THR 1890CO 0.01 0.66 -0.04 0.77 0.37 0.00 0.00 175.52 177.29 2kvp h SER 1891N -0.61 -0.09 0.46 4.18 4.64 -0.55 -0.67 113.55 120.92 2kvp h SER 1891Ca -0.12 -0.28 -0.04 0.00 -0.47 0.00 0.00 61.79 60.89 2kvp h SER 1891Cb 1.42 0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.53 2kvp h SER 1891CO 0.07 0.24 -0.17 0.44 -0.87 0.00 0.00 176.83 176.54 2kvp h ASP 1892N -0.42 0.00 -0.31 4.97 3.32 -1.56 0.10 116.42 122.53 2kvp h ASP 1892Ca -0.01 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 2kvp h ASP 1892Cb 0.36 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 2kvp h ASP 1892CO 0.02 0.17 -0.16 0.22 -1.72 0.00 0.00 179.24 177.77 2kvp h TYR 1893N 0.00 0.75 0.00 4.55 3.20 -1.37 0.12 116.97 124.22 2kvp h TYR 1893Ca -0.00 -0.19 -0.10 0.00 3.14 0.00 0.00 58.73 61.58 2kvp h TYR 1893Cb 0.45 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 2kvp h TYR 1893CO 0.00 0.88 -0.49 0.78 -1.64 0.00 0.00 178.16 177.69 2kvp h GLY 1894N 0.41 0.00 0.90 1.82 0.00 -0.47 0.11 103.07 105.83 2kvp h GLY 1894Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 2kvp h GLY 1894CO 0.05 0.00 0.04 -0.09 0.00 0.00 0.00 176.54 176.53 2kvp h ARG 1895N 0.00 0.11 -0.36 4.80 2.43 -0.68 -2.34 114.38 118.34 2kvp h ARG 1895Ca -0.00 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2kvp h ARG 1895Cb 0.89 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.39 2kvp h ARG 1895CO 0.06 0.19 0.16 -0.07 -1.51 0.00 0.00 179.97 178.81 2kvp h LEU 1896N 0.00 0.23 -2.30 3.80 3.38 0.03 -2.05 115.31 118.40 2kvp h LEU 1896Ca 0.03 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2kvp h LEU 1896Cb 0.12 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2kvp h LEU 1896CO -0.00 0.17 0.12 0.00 0.09 0.00 0.00 178.44 178.82 2kvp h ALA 1897N 1.19 1.72 -0.28 1.53 0.00 -0.73 -0.79 119.26 121.91 2kvp h ALA 1897Ca 0.15 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2kvp h ALA 1897Cb 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2kvp h ALA 1897CO -0.12 -0.18 -0.02 1.03 0.00 0.00 0.00 179.25 179.96 2kvp h SER 1898N 0.00 0.50 1.36 0.00 0.87 -0.80 -2.97 113.55 112.50 2kvp h SER 1898Ca 0.05 -0.33 -0.08 0.00 -1.23 0.00 0.00 61.79 60.20 2kvp h SER 1898Cb 0.30 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 2kvp h SER 1898CO -0.00 0.70 -0.40 1.56 -0.53 0.00 0.00 176.83 178.16 2kvp h GLN 1899N 0.28 0.00 -0.53 2.24 7.50 -1.30 -3.28 115.11 120.02 2kvp h GLN 1899Ca 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.20 2kvp h GLN 1899Cb 0.46 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.97 2kvp h GLN 1899CO 0.02 0.40 0.24 0.00 -1.50 0.00 0.00 178.83 177.99 2kvp h ALA 1900N 1.60 1.43 0.88 3.87 0.00 -1.03 -0.54 119.26 125.46 2kvp h ALA 1900Ca -0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2kvp h ALA 1900Cb 1.19 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.77 2kvp h ALA 1900CO 0.05 0.45 -0.42 0.87 0.00 0.00 0.00 179.25 180.20 2kvp h LYS 1901N 0.75 -1.14 -0.14 0.00 1.57 -1.59 -1.99 116.57 114.04 2kvp h LYS 1901Ca 0.19 0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.97 2kvp h LYS 1901Cb 0.10 0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2kvp h LYS 1901CO -0.02 -0.75 -0.22 -1.35 -0.57 0.00 0.00 179.45 176.53 2kvp h PRO 1902N -1.21 0.23 -0.91 3.15 0.11 -1.71 -2.89 132.00 128.78 2kvp h PRO 1902Ca -0.12 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 2kvp h PRO 1902Cb 0.91 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.95 2kvp h PRO 1902CO 0.20 0.45 0.54 0.00 -0.21 0.00 0.00 178.00 178.98 2kvp h ALA 1903N 1.56 1.16 -0.33 -0.75 0.00 -1.01 0.32 119.26 120.20 2kvp h ALA 1903Ca 0.04 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2kvp h ALA 1903Cb 0.52 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2kvp h ALA 1903CO 0.04 0.62 -0.09 0.00 0.00 0.00 0.00 179.25 179.82 2kvp h ALA 1904N 1.29 0.45 0.01 0.00 0.00 -1.16 -1.78 119.26 118.07 2kvp h ALA 1904Ca 0.32 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 2kvp h ALA 1904Cb -0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2kvp h ALA 1904CO -0.06 0.30 -0.86 -0.24 0.00 0.00 0.00 179.25 178.38 2kvp h VAL 1905N 0.42 1.54 -0.00 0.00 3.04 -1.35 -3.01 116.25 116.89 2kvp h VAL 1905Ca 0.08 -2.74 0.00 0.00 -1.01 0.00 0.00 66.70 63.04 2kvp h VAL 1905Cb 0.59 2.51 0.00 0.00 -2.01 0.00 0.00 31.29 32.38 2kvp h VAL 1905CO 0.03 0.79 -0.01 0.00 -1.01 0.00 0.00 177.57 177.37 2kvp n ALA 1906N -2.43 2.41 -1.77 3.17 0.00 0.11 -4.82 120.51 117.19 2kvp n ALA 1906Ca -0.02 -0.12 -0.39 0.00 0.00 0.00 0.00 53.44 52.91 2kvp n ALA 1906Cb 0.81 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 2kvp n ALA 1906CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kvp s ALA 1907N -2.86 3.21 -0.07 0.00 0.00 -0.67 -4.34 121.76 117.03 2kvp s ALA 1907Ca 0.19 1.01 -0.24 0.00 0.00 0.00 0.00 51.96 52.92 2kvp s ALA 1907Cb 0.19 -3.39 -0.19 0.00 0.00 0.00 0.00 23.12 19.73 2kvp s ALA 1907CO 0.51 -0.54 0.92 0.93 0.00 0.00 0.00 175.76 177.59 2kvp h GLU 1908N 2.78 -0.09 -6.34 0.00 5.08 -1.87 -3.44 114.58 110.70 2kvp h GLU 1908Ca -0.49 0.01 -0.55 0.00 -1.00 0.00 0.00 59.36 57.33 2kvp h GLU 1908Cb 1.23 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.46 2kvp h GLU 1908CO 0.63 0.49 0.09 -0.80 -1.00 0.00 0.00 179.01 178.42 2kvp s ASN 1909N -5.73 7.21 0.20 1.42 -0.87 -1.26 -4.97 114.94 110.93 2kvp s ASN 1909Ca -0.15 1.44 -0.09 0.00 -1.57 0.00 0.00 52.86 52.49 2kvp s ASN 1909Cb -0.00 -2.44 0.12 0.00 -0.02 0.00 0.00 41.25 38.92 2kvp s ASN 1909CO 0.57 0.18 1.75 -0.08 -2.57 0.00 0.00 177.10 176.94 2kvp h GLU 1910N 4.82 1.09 -0.29 -0.60 4.57 -1.93 -2.07 114.58 120.16 2kvp h GLU 1910Ca -0.47 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 57.46 2kvp h GLU 1910Cb 1.21 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.61 2kvp h GLU 1910CO 0.67 0.92 0.02 0.93 -1.18 0.00 0.00 179.01 180.36 2kvp h GLU 1911N 1.04 0.44 -0.11 1.92 3.07 -1.98 0.92 114.58 119.89 2kvp h GLU 1911Ca 0.24 -0.08 -0.03 0.00 -0.50 0.00 0.00 59.36 58.99 2kvp h GLU 1911Cb 0.25 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.09 2kvp h GLU 1911CO -0.01 0.45 -0.05 0.82 -1.40 0.00 0.00 179.01 178.82 2kvp h ILE 1912N 0.43 1.31 -0.73 3.13 1.08 -1.82 0.28 117.51 121.20 2kvp h ILE 1912Ca 0.10 -1.05 -0.03 0.00 -0.39 0.00 0.00 64.86 63.48 2kvp h ILE 1912Cb 0.26 1.78 -0.03 0.00 -3.07 0.00 0.00 36.82 35.75 2kvp h ILE 1912CO 0.00 0.30 0.33 1.23 -0.69 0.00 0.00 178.15 179.32 2kvp h GLY 1913N -0.12 1.13 1.26 5.37 0.00 -1.12 -1.66 103.07 107.94 2kvp h GLY 1913Ca 0.03 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.75 2kvp h GLY 1913CO 0.02 0.55 0.34 0.00 0.00 0.00 0.00 176.54 177.45 2kvp h ALA 1914N 1.16 1.32 -0.60 3.60 0.00 -0.71 -2.34 119.26 121.67 2kvp h ALA 1914Ca 0.25 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2kvp h ALA 1914Cb 0.15 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2kvp h ALA 1914CO -0.03 0.54 0.02 1.25 0.00 0.00 0.00 179.25 181.03 2kvp h HIS 1915N 0.96 1.15 0.41 0.00 6.17 0.21 -1.22 115.15 122.83 2kvp h HIS 1915Ca 0.24 -0.19 -0.02 0.00 0.71 0.00 0.00 60.37 61.11 2kvp h HIS 1915Cb 0.08 -0.30 0.00 0.00 2.52 0.00 0.00 27.41 29.71 2kvp h HIS 1915CO 0.01 1.01 -0.20 0.82 0.71 0.00 0.00 177.93 180.28 2kvp h ILE 1916N 0.96 0.58 -0.40 6.26 2.04 -1.08 -2.39 117.51 123.48 2kvp h ILE 1916Ca 0.17 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 2kvp h ILE 1916Cb 0.54 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 2kvp h ILE 1916CO 0.03 0.06 0.17 0.07 0.00 0.00 0.00 178.15 178.47 2kvp h LYS 1917N -0.73 0.56 0.00 2.37 2.10 -1.36 -1.50 116.57 118.02 2kvp h LYS 1917Ca -0.06 -0.07 -0.12 0.00 -2.00 0.00 0.00 60.65 58.41 2kvp h LYS 1917Cb 0.51 -0.11 -0.02 0.00 -0.90 0.00 0.00 32.23 31.72 2kvp h LYS 1917CO 0.09 0.46 -0.57 0.45 -2.00 0.00 0.00 179.45 177.88 2kvp h HIS 1918N 0.56 0.00 0.01 0.07 3.86 -1.19 -2.27 115.15 116.19 2kvp h HIS 1918Ca 0.14 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.16 2kvp h HIS 1918Cb 0.10 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 2kvp h HIS 1918CO 0.00 0.57 -0.88 0.00 0.86 0.00 0.00 177.93 178.48 2kvp h ARG 1919N 0.00 0.12 0.00 2.45 2.47 -0.75 -2.75 114.38 115.92 2kvp h ARG 1919Ca -0.01 -0.14 -0.07 0.00 -1.26 0.00 0.00 59.98 58.50 2kvp h ARG 1919Cb 1.03 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.39 2kvp h ARG 1919CO 0.07 0.93 -0.32 0.28 0.56 0.00 0.00 179.97 181.49 2kvp h VAL 1920N 0.06 0.79 -0.69 2.04 2.07 -1.26 -1.97 116.25 117.29 2kvp h VAL 1920Ca -0.03 -1.36 -0.05 0.00 0.82 0.00 0.00 66.70 66.08 2kvp h VAL 1920Cb 1.53 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 33.12 2kvp h VAL 1920CO 0.13 0.31 0.24 1.56 0.02 0.00 0.00 177.57 179.83 2kvp h GLN 1921N 0.00 1.03 0.16 1.57 1.08 -1.15 0.16 115.11 117.97 2kvp h GLN 1921Ca -0.00 -0.19 -0.01 0.00 -1.45 0.00 0.00 58.65 57.00 2kvp h GLN 1921Cb 0.82 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 2kvp h GLN 1921CO 0.04 0.86 -0.08 0.93 -0.95 0.00 0.00 178.83 179.63 2kvp h GLU 1922N 1.00 -0.21 -0.91 1.46 5.08 -1.10 -1.21 114.58 118.69 2kvp h GLU 1922Ca 0.23 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.69 2kvp h GLU 1922Cb 0.24 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.47 2kvp h GLU 1922CO -0.01 -0.14 0.59 -0.07 -1.00 0.00 0.00 179.01 178.38 2kvp h LEU 1923N -0.23 0.84 -0.00 1.33 3.38 -1.19 0.25 115.31 119.68 2kvp h LEU 1923Ca -0.02 0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2kvp h LEU 1923Cb 0.18 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2kvp h LEU 1923CO 0.04 0.50 -0.15 1.23 0.09 0.00 0.00 178.44 180.15 2kvp h GLY 1924N 0.93 -0.18 1.29 0.83 0.00 0.10 0.60 103.07 106.62 2kvp h GLY 1924Ca 0.42 0.17 -0.18 0.00 0.00 0.00 0.00 47.33 47.74 2kvp h GLY 1924CO -0.18 -0.14 -0.57 0.45 0.00 0.00 0.00 176.54 176.09 2kvp h HIS 1925N -0.24 0.94 0.38 5.60 3.86 -0.63 -1.74 115.15 123.31 2kvp h HIS 1925Ca 0.05 -0.34 -0.02 0.00 -1.16 0.00 0.00 60.37 58.90 2kvp h HIS 1925Cb 0.31 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.61 2kvp h HIS 1925CO -0.20 1.14 -0.18 0.78 0.86 0.00 0.00 177.93 180.33 2kvp h GLY 1926N 0.83 -0.53 1.22 2.45 0.00 -0.32 -1.32 103.07 105.40 2kvp h GLY 1926Ca 0.01 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.53 2kvp h GLY 1926CO 0.12 -0.19 0.50 0.00 0.00 0.00 0.00 176.54 176.97 2kvp h SER 1928N 1.07 -0.26 -0.78 0.00 0.87 -1.34 -1.02 113.55 112.09 2kvp h SER 1928Ca 0.29 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.87 2kvp h SER 1928Cb -0.09 0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 61.90 2kvp h SER 1928CO -0.06 -0.18 0.52 0.00 -0.53 0.00 0.00 176.83 176.57 2kvp h ALA 1929N 0.49 1.00 0.31 6.23 0.00 -0.64 0.13 119.26 126.78 2kvp h ALA 1929Ca -0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2kvp h ALA 1929Cb 0.24 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2kvp h ALA 1929CO 0.04 0.40 -0.15 1.25 0.00 0.00 0.00 179.25 180.79 2kvp h LEU 1930N 1.05 -0.35 -1.02 0.00 6.46 -0.74 -0.28 115.31 120.43 2kvp h LEU 1930Ca 0.29 0.00 -0.09 0.00 -0.12 0.00 0.00 57.88 57.96 2kvp h LEU 1930Cb -0.11 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 39.90 2kvp h LEU 1930CO -0.07 -0.24 -0.28 -0.37 -0.62 0.00 0.00 178.44 176.86 2kvp h VAL 1931N -0.43 1.26 -0.30 1.05 -1.51 -1.00 -0.66 116.25 114.67 2kvp h VAL 1931Ca -0.04 -1.27 -0.01 0.00 -1.23 0.00 0.00 66.70 64.15 2kvp h VAL 1931Cb 0.33 1.43 -0.01 0.00 -2.13 0.00 0.00 31.29 30.90 2kvp h VAL 1931CO 0.07 0.39 0.16 0.74 -1.23 0.00 0.00 177.57 177.70 2kvp h THR 1932N 0.32 1.13 -0.47 7.19 2.02 -0.72 -1.41 112.91 120.96 2kvp h THR 1932Ca 0.05 -0.35 -0.06 0.00 0.77 0.00 0.00 66.41 66.81 2kvp h THR 1932Cb 0.66 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2kvp h THR 1932CO 0.05 0.13 0.03 0.11 0.37 0.00 0.00 175.52 176.21 2kvp h LYS 1933N 0.36 0.76 -0.30 6.66 6.56 -0.69 -2.25 116.57 127.68 2kvp h LYS 1933Ca 0.11 -0.18 0.01 0.00 -1.06 0.00 0.00 60.65 59.52 2kvp h LYS 1933Cb 0.07 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 31.61 2kvp h LYS 1933CO -0.02 0.75 0.19 0.00 -2.06 0.00 0.00 179.45 178.31 2kvp h ALA 1934N 1.32 0.37 -0.64 3.86 0.00 -0.72 0.37 119.26 123.82 2kvp h ALA 1934Ca 0.15 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2kvp h ALA 1934Cb 0.39 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2kvp h ALA 1934CO 0.01 -0.17 0.41 0.78 0.00 0.00 0.00 179.25 180.28 2kvp h GLY 1935N 0.39 0.91 1.70 0.00 0.00 -0.98 0.69 103.07 105.78 2kvp h GLY 1935Ca 0.11 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 2kvp h GLY 1935CO -0.03 0.28 -0.36 0.00 0.00 0.00 0.00 176.54 176.43 2kvp h ALA 1936N 1.26 1.09 0.00 3.60 0.00 -1.04 -1.94 119.26 122.23 2kvp h ALA 1936Ca 0.25 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 2kvp h ALA 1936Cb -0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2kvp h ALA 1936CO -0.08 0.58 -0.53 1.25 0.00 0.00 0.00 179.25 180.46 2kvp h LEU 1937N 0.29 0.00 -0.31 0.00 7.12 0.39 0.25 115.31 123.06 2kvp h LEU 1937Ca 0.03 0.00 -0.12 0.00 0.13 0.00 0.00 57.88 57.92 2kvp h LEU 1937Cb 0.77 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.89 2kvp h LEU 1937CO 0.06 0.53 -0.57 1.56 -0.13 0.00 0.00 178.44 179.90 2kvp h GLN 1938N 0.00 0.00 -0.08 1.25 4.20 -0.58 0.24 115.11 120.14 2kvp h GLN 1938Ca -0.01 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.51 2kvp h GLN 1938Cb 1.10 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.88 2kvp h GLN 1938CO 0.07 0.57 -0.77 0.00 -0.67 0.00 0.00 178.83 178.03 2kvp n SER 1940N -3.84 1.18 0.04 0.00 7.64 0.04 -4.95 113.62 113.73 2kvp n SER 1940Ca -0.05 -2.87 0.07 0.00 1.01 0.00 0.00 58.87 57.03 2kvp n SER 1940Cb 0.73 -0.64 0.31 0.00 -1.01 0.00 0.00 64.21 63.60 2kvp n SER 1940CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2kvp n PRO 1941N 1.52 0.05 0.00 1.43 -0.04 0.83 -1.46 135.00 137.33 2kvp n PRO 1941Ca 0.25 0.37 0.11 0.00 -0.04 0.00 0.00 63.50 64.19 2kvp n PRO 1941Cb 0.48 -1.62 0.08 0.00 -0.04 0.00 0.00 33.50 32.40 2kvp n PRO 1941CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2kvp n SER 1942N -1.73 1.67 -4.60 3.54 2.88 -1.26 -4.87 113.62 109.25 2kvp n SER 1942Ca 0.02 -1.30 -0.42 0.00 -1.33 0.00 0.00 58.87 55.84 2kvp n SER 1942Cb 0.14 0.43 -0.04 0.00 -0.75 0.00 0.00 64.21 63.99 2kvp n SER 1942CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2kvp s ASP 1943N -2.54 6.63 0.32 -3.46 2.15 -0.53 -4.91 116.67 114.33 2kvp s ASP 1943Ca 0.19 0.50 0.08 0.00 0.43 0.00 0.00 52.55 53.75 2kvp s ASP 1943Cb 0.18 -2.44 0.55 0.00 -0.30 0.00 0.00 42.92 40.92 2kvp s ASP 1943CO 0.59 -0.80 1.76 0.58 -0.17 0.00 0.00 175.17 177.13 2kvp h VAL 1944N 5.78 1.28 0.64 1.11 2.07 -1.89 -2.72 116.25 122.51 2kvp h VAL 1944Ca -0.24 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 65.93 2kvp h VAL 1944Cb 1.08 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 32.42 2kvp h VAL 1944CO 0.95 0.40 -0.36 0.22 0.02 0.00 0.00 177.57 178.80 2kvp h TYR 1945N 0.20 -0.93 -0.72 1.57 3.20 -1.96 0.28 116.97 118.60 2kvp h TYR 1945Ca 0.02 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2kvp h TYR 1945Cb 0.70 0.32 -0.03 0.00 1.54 0.00 0.00 36.73 39.26 2kvp h TYR 1945CO 0.01 -0.55 0.37 1.15 -1.64 0.00 0.00 178.16 177.50 2kvp h THR 1946N -0.93 1.22 -0.40 1.81 2.02 -1.91 0.90 112.91 115.62 2kvp h THR 1946Ca -0.08 -0.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.49 2kvp h THR 1946Cb 0.73 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2kvp h THR 1946CO 0.11 0.25 0.14 0.50 0.37 0.00 0.00 175.52 176.90 2kvp h LYS 1947N 1.01 0.61 -0.50 6.66 3.64 -1.24 -0.34 116.57 126.42 2kvp h LYS 1947Ca 0.25 -0.12 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 2kvp h LYS 1947Cb 0.06 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2kvp h LYS 1947CO -0.04 0.59 0.32 -0.22 -2.27 0.00 0.00 179.45 177.83 2kvp h LYS 1948N 0.51 0.62 -0.58 1.90 3.64 0.12 -0.90 116.57 121.88 2kvp h LYS 1948Ca 0.13 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.55 2kvp h LYS 1948Cb 0.22 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 31.84 2kvp h LYS 1948CO -0.01 0.41 0.24 0.93 -2.27 0.00 0.00 179.45 178.75 2kvp h GLU 1949N 0.64 0.42 -0.56 1.90 4.39 -0.42 -0.95 114.58 120.00 2kvp h GLU 1949Ca 0.19 -0.03 -0.10 0.00 0.34 0.00 0.00 59.36 59.77 2kvp h GLU 1949Cb -0.04 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 2kvp h GLU 1949CO -0.06 0.28 -0.03 1.25 -1.16 0.00 0.00 179.01 179.29 2kvp h LEU 1950N 0.44 0.99 -0.83 1.33 6.46 -0.61 0.35 115.31 123.44 2kvp h LEU 1950Ca 0.28 -0.32 0.06 0.00 -0.12 0.00 0.00 57.88 57.78 2kvp h LEU 1950Cb 0.31 -0.27 -0.06 0.00 -0.73 0.00 0.00 40.66 39.91 2kvp h LEU 1950CO -0.26 1.07 0.51 0.40 -0.62 0.00 0.00 178.44 179.54 2kvp h ILE 1951N 0.89 1.04 -0.12 4.05 2.04 -0.59 0.29 117.51 125.10 2kvp h ILE 1951Ca 0.15 -0.32 -0.18 0.00 1.00 0.00 0.00 64.86 65.51 2kvp h ILE 1951Cb 0.58 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2kvp h ILE 1951CO 0.03 0.17 -0.68 -0.33 0.00 0.00 0.00 178.15 177.35 2kvp h GLU 1952N 0.94 0.49 -0.51 2.37 5.08 -0.72 -2.81 114.58 119.42 2kvp h GLU 1952Ca 0.36 -0.37 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2kvp h GLU 1952Cb 0.16 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2kvp h GLU 1952CO -0.17 1.00 0.10 0.00 -1.00 0.00 0.00 179.01 178.94 2kvp h ALA 1954N 1.36 0.09 0.00 0.00 0.00 -0.32 -2.21 119.26 118.18 2kvp h ALA 1954Ca 0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2kvp h ALA 1954Cb 0.31 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2kvp h ALA 1954CO 0.00 -0.35 -0.19 0.07 0.00 0.00 0.00 179.25 178.78 2kvp h ARG 1955N -0.02 0.00 0.68 0.00 0.11 -1.37 -0.64 114.38 113.14 2kvp h ARG 1955Ca 0.02 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.07 2kvp h ARG 1955Cb 0.13 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.22 2kvp h ARG 1955CO -0.00 0.19 -0.33 0.00 0.10 0.00 0.00 179.97 179.94 2kvp h ARG 1956N 0.00 -0.88 -0.90 0.08 3.08 -1.02 -2.74 114.38 112.00 2kvp h ARG 1956Ca -0.00 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2kvp h ARG 1956Cb 0.42 0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.63 2kvp h ARG 1956CO 0.03 -0.58 0.57 0.28 -1.07 0.00 0.00 179.97 179.19 2kvp h VAL 1957N -0.93 1.24 -0.68 2.04 2.07 -0.88 -1.81 116.25 117.30 2kvp h VAL 1957Ca -0.09 -0.49 0.08 0.00 0.82 0.00 0.00 66.70 67.02 2kvp h VAL 1957Cb 0.71 -0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2kvp h VAL 1957CO 0.15 0.24 0.45 0.28 0.02 0.00 0.00 177.57 178.72 2kvp h SER 1958N 1.23 0.56 0.28 0.57 0.02 -1.06 0.01 113.55 115.16 2kvp h SER 1958Ca 0.33 0.01 -0.24 0.00 -0.84 0.00 0.00 61.79 61.05 2kvp h SER 1958Cb -0.09 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 62.34 2kvp h SER 1958CO -0.07 0.35 -0.99 -0.33 -1.14 0.00 0.00 176.83 174.66 2kvp h GLU 1959N 0.63 0.47 -0.45 3.45 5.08 -1.04 -3.24 114.58 119.48 2kvp h GLU 1959Ca 0.30 -0.52 -0.08 0.00 -1.00 0.00 0.00 59.36 58.07 2kvp h GLU 1959Cb 0.37 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2kvp h GLU 1959CO -0.10 1.16 -0.04 0.87 -1.00 0.00 0.00 179.01 179.91 2kvp h LYS 1960N 0.26 0.76 -0.15 2.33 1.79 -0.51 -1.35 116.57 119.71 2kvp h LYS 1960Ca -0.10 -0.22 0.03 0.00 -2.18 0.00 0.00 60.65 58.19 2kvp h LYS 1960Cb 1.63 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 32.17 2kvp h LYS 1960CO 0.18 0.80 -0.06 0.28 -1.08 0.00 0.00 179.45 179.56 2kvp h VAL 1961N 0.70 0.80 -0.52 0.50 2.07 -1.12 -0.15 116.25 118.53 2kvp h VAL 1961Ca 0.13 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.64 2kvp h VAL 1961Cb 0.49 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 2kvp h VAL 1961CO 0.02 0.00 0.26 -1.28 0.02 0.00 0.00 177.57 176.60 2kvp h SER 1962N -0.03 0.64 -0.25 0.57 0.87 -1.49 -0.57 113.55 113.28 2kvp h SER 1962Ca 0.08 -0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 2kvp h SER 1962Cb 0.15 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 2kvp h SER 1962CO -0.17 0.53 0.11 0.45 -0.53 0.00 0.00 176.83 177.22 2kvp h HIS 1963N 0.72 0.37 -0.12 2.24 -0.00 -0.51 -0.24 115.15 117.61 2kvp h HIS 1963Ca 0.18 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.53 2kvp h HIS 1963Cb 0.05 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.34 2kvp h HIS 1963CO 0.00 0.37 0.06 0.28 -0.00 0.00 0.00 177.93 178.65 2kvp h VAL 1964N 0.27 1.10 -0.29 2.45 2.07 -0.40 -0.61 116.25 120.85 2kvp h VAL 1964Ca 0.09 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.38 2kvp h VAL 1964Cb 0.15 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 2kvp h VAL 1964CO -0.01 0.09 -0.04 -0.07 0.02 0.00 0.00 177.57 177.56 2kvp h LEU 1965N 0.09 -0.20 -1.44 2.57 3.38 -1.03 -1.51 115.31 117.18 2kvp h LEU 1965Ca 0.04 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2kvp h LEU 1965Cb 0.09 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2kvp h LEU 1965CO -0.01 -0.07 0.17 0.00 0.09 0.00 0.00 178.44 178.63 2kvp h ALA 1966N 1.27 1.56 -0.60 1.53 0.00 -0.84 -1.84 119.26 120.34 2kvp h ALA 1966Ca 0.14 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2kvp h ALA 1966Cb 0.20 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2kvp h ALA 1966CO -0.27 0.35 0.13 0.00 0.00 0.00 0.00 179.25 179.46 2kvp h ALA 1967N 1.64 1.08 -0.16 0.00 0.00 -0.11 0.69 119.26 122.40 2kvp h ALA 1967Ca 0.14 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2kvp h ALA 1967Cb 0.09 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2kvp h ALA 1967CO -0.02 0.60 -0.08 -0.07 0.00 0.00 0.00 179.25 179.69 2kvp h LEU 1968N 0.91 0.35 -1.71 0.00 -0.00 -0.69 -2.99 115.31 111.18 2kvp h LEU 1968Ca 0.19 -0.41 -0.01 0.00 -0.00 0.00 0.00 57.88 57.65 2kvp h LEU 1968Cb 0.35 -0.10 -0.00 0.00 -0.00 0.00 0.00 40.66 40.92 2kvp h LEU 1968CO 0.00 0.68 -0.03 1.56 -0.00 0.00 0.00 178.44 180.66 2kvp h GLN 1969N 0.02 0.00 0.00 1.13 7.50 -1.13 -1.88 115.11 120.75 2kvp h GLN 1969Ca 0.04 0.00 -0.10 0.00 0.50 0.00 0.00 58.65 59.09 2kvp h GLN 1969Cb 0.55 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.07 2kvp h GLN 1969CO 0.02 0.03 -0.47 0.00 -1.50 0.00 0.00 178.83 176.91 2kvp h ALA 1970N 1.97 1.21 -0.01 3.87 0.00 -0.72 -2.45 119.26 123.13 2kvp h ALA 1970Ca -0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2kvp h ALA 1970Cb 0.44 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2kvp h ALA 1970CO 0.00 0.59 0.00 0.41 0.00 0.00 0.00 179.25 180.25 2kvp n GLY 1971N -0.16 -0.61 2.55 0.00 0.00 -0.71 -4.38 105.19 101.88 2kvp n GLY 1971Ca -0.02 -0.29 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 2kvp n GLY 1971CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2kvp s ASN 1972N -1.98 1.35 0.00 1.61 3.84 -0.92 -4.98 114.94 113.86 2kvp s ASN 1972Ca 0.44 -2.31 0.24 0.00 0.21 0.00 0.00 52.86 51.44 2kvp s ASN 1972Cb 0.21 0.12 0.26 0.00 -0.55 0.00 0.00 41.25 41.29 2kvp s ASN 1972CO 0.35 -0.21 1.30 0.54 -2.79 0.00 0.00 177.10 176.29