#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qc9 h HIS 1911N 0.00 0.81 -1.45 1.96 3.86 -1.99 -3.22 115.15 115.11 2qc9 h HIS 1911Ca 0.00 0.03 -0.72 0.00 -1.16 0.00 0.00 60.37 58.52 2qc9 h HIS 1911Cb 0.00 -0.24 -0.18 0.00 1.06 0.00 0.00 27.41 28.06 2qc9 h HIS 1911CO 0.00 0.09 1.66 0.09 0.86 0.00 0.00 177.93 180.63 2qc9 n ASN 1912N -4.71 7.59 -3.86 2.45 3.02 -1.26 -4.49 115.26 114.00 2qc9 n ASN 1912Ca 0.25 -3.33 -0.14 0.00 -0.03 0.00 0.00 54.58 51.33 2qc9 n ASN 1912Cb 0.79 -1.27 -0.15 0.00 -0.61 0.00 0.00 39.78 38.54 2qc9 n ASN 1912CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qc9 s GLN 1913N -2.19 0.12 0.00 3.52 -2.07 -1.22 -5.08 119.66 112.74 2qc9 s GLN 1913Ca 0.51 0.01 0.00 0.00 -1.82 0.00 0.00 55.36 54.07 2qc9 s GLN 1913Cb 0.24 -0.20 0.00 0.00 -1.09 0.00 0.00 33.01 31.96 2qc9 s GLN 1913CO -0.15 -0.03 0.00 0.25 -1.32 0.00 0.00 175.29 174.04 2qc9 n THR 1914N 3.43 0.00 -1.11 3.63 -2.24 -1.26 -4.44 114.28 112.28 2qc9 n THR 1914Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2qc9 n THR 1914Cb 0.56 -0.92 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 2qc9 n THR 1914CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2qc9 n ASP 1915N 0.00 0.64 0.02 3.42 5.75 -1.26 -4.82 116.55 120.30 2qc9 n ASP 1915Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 54.79 54.89 2qc9 n ASP 1915Cb 0.00 0.00 0.46 0.00 -1.03 0.00 0.00 41.12 40.55 2qc9 n ASP 1915CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2qc9 n ARG 1916N 0.00 0.04 -0.00 0.11 1.85 -1.26 -2.07 116.66 115.32 2qc9 n ARG 1916Ca 0.00 0.16 0.04 0.00 -1.00 0.00 0.00 57.85 57.04 2qc9 n ARG 1916Cb 0.00 -1.55 -0.04 0.00 -1.05 0.00 0.00 32.46 29.81 2qc9 n ARG 1916CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 2qc9 n THR 1917N -1.62 0.00 -0.89 8.89 -2.24 -1.26 -4.97 114.28 112.20 2qc9 n THR 1917Ca 0.05 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2qc9 n THR 1917Cb 0.26 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 2qc9 n THR 1917CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qc9 n GLY 1918N 1.24 0.54 3.70 3.38 0.00 -0.88 -1.70 105.19 111.47 2qc9 n GLY 1918Ca 0.01 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 2qc9 n GLY 1918CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qc9 s GLU 1919N -0.38 4.35 0.92 1.61 2.02 -1.26 -3.83 118.70 122.13 2qc9 s GLU 1919Ca 0.00 0.70 -0.14 0.00 0.02 0.00 0.00 54.97 55.56 2qc9 s GLU 1919Cb 0.00 -3.48 0.18 0.00 0.10 0.00 0.00 34.13 30.93 2qc9 s GLU 1919CO 0.00 -0.00 1.27 0.95 0.02 0.00 0.00 175.26 177.49 2qc9 s THR 1920N 1.09 2.02 0.24 3.63 -4.23 -1.26 -4.11 115.64 113.02 2qc9 s THR 1920Ca 0.32 -0.08 0.23 0.00 -1.18 0.00 0.00 61.69 60.99 2qc9 s THR 1920Cb -0.16 -2.95 0.23 0.00 1.34 0.00 0.00 72.50 70.95 2qc9 s THR 1920CO 0.14 0.00 1.89 0.00 -0.54 0.00 0.00 174.62 176.10 2qc9 h ALA 1921N -1.44 1.11 -0.31 3.99 0.00 -1.80 -2.52 119.26 118.29 2qc9 h ALA 1921Ca -0.44 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.11 2qc9 h ALA 1921Cb 1.25 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2qc9 h ALA 1921CO 0.41 0.29 -0.43 1.25 0.00 0.00 0.00 179.25 180.77 2qc9 h LEU 1922N 0.00 0.85 0.32 0.00 5.85 -1.92 -1.02 115.31 119.39 2qc9 h LEU 1922Ca -0.00 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 2qc9 h LEU 1922Cb 0.64 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2qc9 h LEU 1922CO 0.03 1.16 -0.21 0.45 -0.34 0.00 0.00 178.44 179.53 2qc9 h HIS 1923N 0.64 -0.56 -0.96 1.25 3.86 -1.80 -0.95 115.15 116.63 2qc9 h HIS 1923Ca 0.04 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.35 2qc9 h HIS 1923Cb 0.99 0.20 -0.08 0.00 1.06 0.00 0.00 27.41 29.59 2qc9 h HIS 1923CO 0.06 -0.33 0.60 -0.07 0.86 0.00 0.00 177.93 179.05 2qc9 h LEU 1924N -0.52 0.91 -0.84 2.43 3.38 -1.45 0.24 115.31 119.45 2qc9 h LEU 1924Ca -0.03 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2qc9 h LEU 1924Cb 0.44 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 2qc9 h LEU 1924CO 0.02 0.52 0.53 0.00 0.09 0.00 0.00 178.44 179.60 2qc9 h ALA 1925N 1.49 1.06 -0.12 1.53 0.00 -0.71 0.30 119.26 122.82 2qc9 h ALA 1925Ca 0.46 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.23 2qc9 h ALA 1925Cb 0.36 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2qc9 h ALA 1925CO -0.23 0.49 -0.18 0.00 0.00 0.00 0.00 179.25 179.33 2qc9 h ALA 1926N 1.29 0.18 -0.96 0.00 0.00 0.35 0.23 119.26 120.35 2qc9 h ALA 1926Ca 0.30 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2qc9 h ALA 1926Cb -0.09 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2qc9 h ALA 1926CO -0.06 0.10 0.63 -0.09 0.00 0.00 0.00 179.25 179.83 2qc9 h ARG 1927N -0.09 1.23 -0.64 0.00 2.43 -0.39 -2.20 114.38 114.73 2qc9 h ARG 1927Ca 0.01 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2qc9 h ARG 1927Cb 0.74 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2qc9 h ARG 1927CO 0.04 0.81 0.00 0.66 -1.51 0.00 0.00 179.97 179.98 2qc9 n TYR 1928N -4.41 1.29 -3.98 2.20 4.01 0.07 -4.94 117.16 111.41 2qc9 n TYR 1928Ca 0.12 -0.50 -0.30 0.00 -0.16 0.00 0.00 57.90 57.06 2qc9 n TYR 1928Cb 0.05 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 38.83 2qc9 n TYR 1928CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2qc9 n SER 1929N 0.81 -3.14 -4.41 7.72 7.64 -0.83 -4.91 113.62 116.50 2qc9 n SER 1929Ca 0.21 -0.89 -0.45 0.00 1.01 0.00 0.00 58.87 58.75 2qc9 n SER 1929Cb 0.79 -3.45 -0.03 0.00 -1.01 0.00 0.00 64.21 60.52 2qc9 n SER 1929CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2qc9 s ARG 1930N -6.62 3.50 0.11 1.43 0.52 0.74 -4.87 118.95 113.76 2qc9 s ARG 1930Ca 0.49 -1.84 -0.18 0.00 -0.52 0.00 0.00 55.73 53.68 2qc9 s ARG 1930Cb -0.25 -4.66 -0.05 0.00 0.52 0.00 0.00 34.95 30.50 2qc9 s ARG 1930CO 0.87 -1.62 1.62 0.77 0.02 0.00 0.00 175.30 176.96 2qc9 h SER 1931N 8.64 0.42 -0.34 0.23 0.02 -1.91 -0.73 113.55 119.88 2qc9 h SER 1931Ca 0.06 -0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.83 2qc9 h SER 1931Cb 1.04 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 2qc9 h SER 1931CO 1.02 0.51 0.19 0.44 -1.14 0.00 0.00 176.83 177.84 2qc9 h ASP 1932N 0.30 0.29 -0.07 3.07 3.32 -1.98 -0.97 116.42 120.38 2qc9 h ASP 1932Ca 0.09 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2qc9 h ASP 1932Cb 0.24 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 2qc9 h ASP 1932CO -0.00 0.21 0.04 0.00 -1.72 0.00 0.00 179.24 177.76 2qc9 h ALA 1933N 1.16 0.09 -1.00 3.45 0.00 -1.95 -2.32 119.26 118.70 2qc9 h ALA 1933Ca 0.14 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.11 2qc9 h ALA 1933Cb 0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 2qc9 h ALA 1933CO -0.08 -0.35 0.62 0.00 0.00 0.00 0.00 179.25 179.44 2qc9 h ALA 1934N 0.92 1.51 -0.13 0.00 0.00 -0.86 -1.79 119.26 118.91 2qc9 h ALA 1934Ca 0.02 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 2qc9 h ALA 1934Cb 0.11 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2qc9 h ALA 1934CO -0.00 0.20 -0.65 0.87 0.00 0.00 0.00 179.25 179.67 2qc9 h LYS 1935N 0.97 0.49 -0.01 0.00 1.57 -0.89 -2.81 116.57 115.89 2qc9 h LYS 1935Ca 0.50 -0.36 -0.13 0.00 -1.87 0.00 0.00 60.65 58.79 2qc9 h LYS 1935Cb 0.51 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 2qc9 h LYS 1935CO -0.27 0.98 -0.60 0.07 -0.57 0.00 0.00 179.45 179.05 2qc9 h ARG 1936N 0.35 0.02 0.40 3.15 0.11 -0.87 -2.43 114.38 115.11 2qc9 h ARG 1936Ca -0.02 -0.02 -0.02 0.00 0.10 0.00 0.00 59.98 60.03 2qc9 h ARG 1936Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 2qc9 h ARG 1936CO 0.12 0.62 -0.19 -0.07 0.10 0.00 0.00 179.97 180.55 2qc9 h LEU 1937N 0.02 -0.45 -1.45 0.08 3.38 -1.31 -2.76 115.31 112.81 2qc9 h LEU 1937Ca -0.01 -0.10 0.11 0.00 0.09 0.00 0.00 57.88 57.97 2qc9 h LEU 1937Cb 1.07 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.89 2qc9 h LEU 1937CO 0.08 -0.14 0.49 -0.07 0.09 0.00 0.00 178.44 178.89 2qc9 h LEU 1938N -0.77 0.55 -0.49 1.67 3.38 -1.50 0.27 115.31 118.42 2qc9 h LEU 1938Ca -0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2qc9 h LEU 1938Cb 0.52 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2qc9 h LEU 1938CO 0.09 0.32 0.00 -0.62 0.09 0.00 0.00 178.44 178.32 2qc9 n GLU 1939N -4.50 0.15 -0.84 1.13 1.02 -0.92 -1.38 120.64 115.30 2qc9 n GLU 1939Ca 0.13 0.37 -0.05 0.00 -0.02 0.00 0.00 57.16 57.59 2qc9 n GLU 1939Cb 0.38 -1.77 0.23 0.00 -0.02 0.00 0.00 31.44 30.25 2qc9 n GLU 1939CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qc9 n ALA 1940N -1.70 4.30 -2.42 0.62 0.00 0.89 -4.93 120.51 117.26 2qc9 n ALA 1940Ca 0.03 -2.75 -0.20 0.00 0.00 0.00 0.00 53.44 50.51 2qc9 n ALA 1940Cb 0.22 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.71 2qc9 n ALA 1940CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2qc9 n SER 1941N -0.79 -5.79 -4.77 0.00 7.64 -0.48 -4.94 113.62 104.49 2qc9 n SER 1941Ca 0.37 -0.03 -0.41 0.00 1.01 0.00 0.00 58.87 59.80 2qc9 n SER 1941Cb 1.19 -4.80 -0.01 0.00 -1.01 0.00 0.00 64.21 59.59 2qc9 n SER 1941CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qc9 s ALA 1942N -3.02 3.63 -0.28 -0.43 0.00 -0.79 -4.89 121.76 115.98 2qc9 s ALA 1942Ca 0.02 1.58 -0.29 0.00 0.00 0.00 0.00 51.96 53.27 2qc9 s ALA 1942Cb -0.01 -3.63 0.01 0.00 0.00 0.00 0.00 23.12 19.50 2qc9 s ALA 1942CO 0.02 -1.05 1.09 0.34 0.00 0.00 0.00 175.76 176.16 2qc9 s ASP 1943N 0.06 6.98 -0.89 0.00 -1.08 -1.26 -4.70 116.67 115.78 2qc9 s ASP 1943Ca 0.56 1.21 -0.05 0.00 -0.52 0.00 0.00 52.55 53.75 2qc9 s ASP 1943Cb -0.47 -2.54 0.08 0.00 -1.46 0.00 0.00 42.92 38.53 2qc9 s ASP 1943CO 0.59 -0.81 2.61 0.00 0.52 0.00 0.00 175.17 178.08 2qc9 n ALA 1944N 6.71 6.65 -1.07 3.66 0.00 -1.26 -4.96 120.51 130.23 2qc9 n ALA 1944Ca 0.12 -3.53 0.00 0.00 0.00 0.00 0.00 53.44 50.03 2qc9 n ALA 1944Cb 0.47 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.44 2qc9 n ALA 1944CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2qc9 n ILE 1946N 1.38 -3.88 -3.46 0.00 5.41 -1.26 -4.08 119.36 113.47 2qc9 n ILE 1946Ca 0.56 1.60 -0.35 0.00 1.00 0.00 0.00 62.75 65.56 2qc9 n ILE 1946Cb 0.41 -2.24 -0.06 0.00 -0.71 0.00 0.00 39.64 37.04 2qc9 n ILE 1946CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2qc9 s GLN 1947N -4.33 3.87 0.36 0.38 -0.21 -1.26 -4.14 119.66 114.33 2qc9 s GLN 1947Ca 0.00 0.34 0.03 0.00 0.02 0.00 0.00 55.36 55.74 2qc9 s GLN 1947Cb 0.00 -2.94 0.07 0.00 1.00 0.00 0.00 33.01 31.13 2qc9 s GLN 1947CO 0.00 0.50 0.49 -0.40 -2.12 0.00 0.00 175.29 173.76 2qc9 n ASP 1948N 0.78 0.95 0.10 5.90 5.68 -0.25 -4.81 116.55 124.90 2qc9 n ASP 1948Ca -0.06 -1.74 0.15 0.00 -0.50 0.00 0.00 54.79 52.65 2qc9 n ASP 1948Cb 0.52 -0.29 0.38 0.00 -1.14 0.00 0.00 41.12 40.59 2qc9 n ASP 1948CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 2qc9 h ASN 1949N -0.13 0.00 -0.21 -1.12 2.35 -1.50 0.55 115.58 115.52 2qc9 h ASN 1949Ca -0.16 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 2qc9 h ASN 1949Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.04 2qc9 h ASN 1949CO 0.20 0.00 0.00 0.23 -1.65 0.00 0.00 177.43 176.21 2qc9 n MET 1950N -2.99 2.69 -0.99 0.81 2.81 -1.26 -4.96 117.12 113.23 2qc9 n MET 1950Ca 0.09 -2.29 0.00 0.00 -1.81 0.00 0.00 57.70 53.69 2qc9 n MET 1950Cb 1.06 -1.44 0.00 0.00 -0.71 0.00 0.00 33.22 32.13 2qc9 n MET 1950CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qc9 n GLY 1951N -0.27 0.50 3.77 3.03 0.00 0.19 -1.95 105.19 110.46 2qc9 n GLY 1951Ca 0.13 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2qc9 n GLY 1951CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qc9 s ARG 1952N -0.12 4.55 0.41 1.61 0.52 -1.26 -3.80 118.95 120.85 2qc9 s ARG 1952Ca 0.00 1.13 0.08 0.00 -0.52 0.00 0.00 55.73 56.42 2qc9 s ARG 1952Cb 0.00 -3.28 0.01 0.00 0.52 0.00 0.00 34.95 32.19 2qc9 s ARG 1952CO 0.00 0.51 0.55 0.95 0.02 0.00 0.00 175.30 177.33 2qc9 s THR 1953N -0.90 3.17 0.58 0.02 -4.23 -1.26 -1.09 115.64 111.93 2qc9 s THR 1953Ca 0.36 -1.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.16 2qc9 s THR 1953Cb -0.22 -3.07 0.40 0.00 1.34 0.00 0.00 72.50 70.95 2qc9 s THR 1953CO 0.25 -0.03 1.90 -0.65 -0.54 0.00 0.00 174.62 175.56 2qc9 h PRO 1954N 0.68 0.00 -0.19 3.99 0.11 -1.75 -0.41 132.00 134.44 2qc9 h PRO 1954Ca -0.41 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.52 2qc9 h PRO 1954Cb 1.28 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.39 2qc9 h PRO 1954CO 0.46 0.00 -0.60 1.25 -0.21 0.00 0.00 178.00 178.91 2qc9 h LEU 1955N 0.00 0.85 -0.63 2.35 5.85 -1.93 0.19 115.31 121.99 2qc9 h LEU 1955Ca 0.25 -0.59 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 2qc9 h LEU 1955Cb 1.26 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.01 2qc9 h LEU 1955CO -0.00 1.29 0.33 0.45 -0.34 0.00 0.00 178.44 180.17 2qc9 h HIS 1956N 0.45 0.88 -0.23 1.25 3.86 -1.47 -2.14 115.15 117.74 2qc9 h HIS 1956Ca -0.02 -0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.18 2qc9 h HIS 1956Cb 1.22 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 29.39 2qc9 h HIS 1956CO 0.09 0.64 0.11 0.00 0.86 0.00 0.00 177.93 179.63 2qc9 h ALA 1957N 1.15 0.27 -0.62 2.45 0.00 -1.18 -1.56 119.26 119.77 2qc9 h ALA 1957Ca 0.22 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.19 2qc9 h ALA 1957Cb 0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2qc9 h ALA 1957CO -0.03 -0.30 0.41 0.00 0.00 0.00 0.00 179.25 179.33 2qc9 h ALA 1958N 1.12 1.73 -0.05 0.00 0.00 -0.71 -1.82 119.26 119.53 2qc9 h ALA 1958Ca 0.09 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2qc9 h ALA 1958Cb 0.03 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qc9 h ALA 1958CO -0.07 0.18 -0.06 0.28 0.00 0.00 0.00 179.25 179.59 2qc9 h VAL 1959N 0.67 1.39 0.00 0.00 2.07 -0.77 -0.50 116.25 119.10 2qc9 h VAL 1959Ca 0.26 -1.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.49 2qc9 h VAL 1959Cb 0.18 2.12 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2qc9 h VAL 1959CO -0.07 0.34 -0.14 0.28 0.02 0.00 0.00 177.57 178.00 2qc9 h SER 1960N -0.34 0.00 0.01 0.57 0.02 -1.01 -1.93 113.55 110.88 2qc9 h SER 1960Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2qc9 h SER 1960Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 2qc9 h SER 1960CO 0.01 0.14 -0.09 0.00 -1.14 0.00 0.00 176.83 175.75 2qc9 n ALA 1961N -2.48 2.72 -3.95 3.77 0.00 -0.71 -4.95 120.51 114.91 2qc9 n ALA 1961Ca -0.02 -0.55 -0.31 0.00 0.00 0.00 0.00 53.44 52.56 2qc9 n ALA 1961Cb 0.21 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 18.69 2qc9 n ALA 1961CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2qc9 n ASP 1962N 0.46 -4.40 -4.32 0.00 2.03 -0.73 -4.85 116.55 104.75 2qc9 n ASP 1962Ca 0.15 -0.81 -0.43 0.00 0.52 0.00 0.00 54.79 54.22 2qc9 n ASP 1962Cb 0.46 -3.74 0.00 0.00 -0.72 0.00 0.00 41.12 37.12 2qc9 n ASP 1962CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qc9 n ALA 1963N -4.63 4.22 -0.31 -1.67 0.00 -0.27 -4.82 120.51 113.02 2qc9 n ALA 1963Ca 0.03 -4.11 0.17 0.00 0.00 0.00 0.00 53.44 49.53 2qc9 n ALA 1963Cb 0.53 -3.25 0.36 0.00 0.00 0.00 0.00 19.45 17.09 2qc9 n ALA 1963CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2qc9 h GLN 1964N 6.89 0.25 0.45 0.00 1.08 -1.89 -1.06 115.11 120.84 2qc9 h GLN 1964Ca 0.40 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.56 2qc9 h GLN 1964Cb 0.80 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.18 2qc9 h GLN 1964CO 1.44 0.17 -0.21 0.78 -0.95 0.00 0.00 178.83 180.06 2qc9 h GLY 1965N 0.26 -0.63 1.54 3.46 0.00 -1.94 -2.33 103.07 103.43 2qc9 h GLY 1965Ca 0.62 0.23 -0.12 0.00 0.00 0.00 0.00 47.33 48.06 2qc9 h GLY 1965CO -0.63 -0.23 -0.37 -2.08 0.00 0.00 0.00 176.54 173.22 2qc9 h VAL 1966N -0.61 1.30 0.16 4.60 2.07 -1.81 -2.57 116.25 119.39 2qc9 h VAL 1966Ca -0.06 -1.51 0.01 0.00 0.82 0.00 0.00 66.70 65.96 2qc9 h VAL 1966Cb 0.46 1.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.72 2qc9 h VAL 1966CO 0.10 0.47 -0.44 0.15 0.02 0.00 0.00 177.57 177.87 2qc9 h PHE 1967N 0.43 -1.25 -0.87 1.57 3.57 -1.14 0.48 116.94 119.73 2qc9 h PHE 1967Ca 0.04 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.65 2qc9 h PHE 1967Cb 0.85 0.53 -0.06 0.00 2.79 0.00 0.00 35.95 40.06 2qc9 h PHE 1967CO 0.03 -0.54 0.56 1.96 -2.23 0.00 0.00 178.31 178.09 2qc9 h GLN 1968N -0.70 0.89 -0.51 1.11 1.08 -1.37 0.13 115.11 115.74 2qc9 h GLN 1968Ca 0.01 -0.05 -0.06 0.00 -1.45 0.00 0.00 58.65 57.09 2qc9 h GLN 1968Cb 0.71 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2qc9 h GLN 1968CO -0.23 0.59 0.07 0.82 -0.95 0.00 0.00 178.83 179.13 2qc9 h ILE 1969N 0.92 1.25 -0.31 2.54 2.04 -0.87 -1.48 117.51 121.59 2qc9 h ILE 1969Ca 0.38 -0.97 -0.11 0.00 1.00 0.00 0.00 64.86 65.16 2qc9 h ILE 1969Cb 0.29 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2qc9 h ILE 1969CO -0.15 0.35 -0.27 -0.07 0.00 0.00 0.00 178.15 178.01 2qc9 h LEU 1970N 0.74 0.65 -0.53 1.44 3.38 0.13 -2.50 115.31 118.61 2qc9 h LEU 1970Ca 0.15 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.75 2qc9 h LEU 1970Cb 0.42 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2qc9 h LEU 1970CO 0.01 0.89 -0.30 -0.07 0.09 0.00 0.00 178.44 179.06 2qc9 h LEU 1971N 0.55 0.91 -0.66 1.67 4.07 -0.61 -2.56 115.31 118.68 2qc9 h LEU 1971Ca 0.07 -0.37 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2qc9 h LEU 1971Cb 0.75 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.23 2qc9 h LEU 1971CO 0.06 1.14 0.00 0.54 -1.08 0.00 0.00 178.44 179.10 2qc9 n ARG 1972N -4.08 0.18 -2.79 1.13 1.74 -0.57 -4.54 116.66 107.72 2qc9 n ARG 1972Ca -0.01 0.41 -0.43 0.00 -0.77 0.00 0.00 57.85 57.06 2qc9 n ARG 1972Cb 0.49 -1.84 -0.04 0.00 -1.02 0.00 0.00 32.46 30.05 2qc9 n ARG 1972CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2qc9 s ASN 1973N -4.13 6.37 0.05 0.55 2.47 -0.96 -4.97 114.94 114.32 2qc9 s ASN 1973Ca 0.04 -0.24 -0.09 0.00 0.42 0.00 0.00 52.86 52.98 2qc9 s ASN 1973Cb 0.09 -2.46 -0.02 0.00 -1.45 0.00 0.00 41.25 37.41 2qc9 s ASN 1973CO 0.37 -1.26 1.10 -1.14 -3.72 0.00 0.00 177.10 172.45 2qc9 n ARG 1974N 7.61 -0.13 0.33 0.43 0.63 -1.26 -1.34 116.66 122.92 2qc9 n ARG 1974Ca 0.03 1.09 0.11 0.00 -0.92 0.00 0.00 57.85 58.16 2qc9 n ARG 1974Cb 0.48 -1.62 0.58 0.00 0.45 0.00 0.00 32.46 32.34 2qc9 n ARG 1974CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qc9 h ALA 1975N -0.47 1.54 -2.50 5.13 0.00 -1.94 -3.43 119.26 117.59 2qc9 h ALA 1975Ca 0.05 -0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.43 2qc9 h ALA 1975Cb 0.13 0.00 0.04 0.00 0.00 0.00 0.00 17.79 17.95 2qc9 h ALA 1975CO -0.29 -0.54 1.11 0.99 0.00 0.00 0.00 179.25 180.52 2qc9 s THR 1976N -4.07 2.57 -0.84 0.00 2.01 -0.45 -4.93 115.64 109.93 2qc9 s THR 1976Ca -0.02 0.07 -0.22 0.00 0.31 0.00 0.00 61.69 61.83 2qc9 s THR 1976Cb 0.06 -3.05 0.08 0.00 0.01 0.00 0.00 72.50 69.60 2qc9 s THR 1976CO 0.20 -0.00 1.18 -0.62 -0.69 0.00 0.00 174.62 174.68 2qc9 s ASP 1977N 2.72 6.39 0.64 3.53 -1.08 -1.26 -4.87 116.67 122.75 2qc9 s ASP 1977Ca 0.81 -1.35 0.40 0.00 -0.52 0.00 0.00 52.55 51.89 2qc9 s ASP 1977Cb -0.46 -2.47 2.23 0.00 -1.46 0.00 0.00 42.92 40.76 2qc9 s ASP 1977CO 0.36 -1.40 2.33 -0.07 0.52 0.00 0.00 175.17 176.91 2qc9 h LEU 1978N 11.64 0.00 -3.05 -1.34 3.38 -1.94 -1.57 115.31 122.43 2qc9 h LEU 1978Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2qc9 h LEU 1978Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2qc9 h LEU 1978CO 1.23 0.00 0.00 0.47 0.09 0.00 0.00 178.44 180.24 2qc9 n ASP 1979N -3.27 4.59 -4.58 -0.43 8.00 -1.26 -4.20 116.55 115.39 2qc9 n ASP 1979Ca -0.03 -2.35 -0.43 0.00 0.71 0.00 0.00 54.79 52.70 2qc9 n ASP 1979Cb 0.09 -0.56 -0.00 0.00 -0.02 0.00 0.00 41.12 40.63 2qc9 n ASP 1979CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qc9 n ALA 1980N 1.24 -0.21 -2.63 2.24 0.00 -0.59 -4.88 120.51 115.68 2qc9 n ALA 1980Ca 0.26 0.30 -0.33 0.00 0.00 0.00 0.00 53.44 53.66 2qc9 n ALA 1980Cb 0.83 -2.02 -0.10 0.00 0.00 0.00 0.00 19.45 18.16 2qc9 n ALA 1980CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qc9 s ARG 1981N -1.74 2.75 0.81 0.00 0.52 -1.26 -4.14 118.95 115.88 2qc9 s ARG 1981Ca 0.61 -0.58 -0.06 0.00 -0.52 0.00 0.00 55.73 55.18 2qc9 s ARG 1981Cb -0.63 -2.62 0.16 0.00 0.52 0.00 0.00 34.95 32.38 2qc9 s ARG 1981CO 0.59 0.65 1.11 -1.64 0.02 0.00 0.00 175.30 176.03 2qc9 s MET 1982N -1.17 1.26 0.00 3.54 -1.94 -0.62 -4.69 119.30 115.68 2qc9 s MET 1982Ca 0.16 -0.94 0.15 0.00 -1.71 0.00 0.00 55.69 53.35 2qc9 s MET 1982Cb -0.11 -2.17 0.87 0.00 2.01 0.00 0.00 34.83 35.43 2qc9 s MET 1982CO 0.05 -1.82 1.34 0.72 -0.01 0.00 0.00 175.02 175.30 2qc9 n HIS 1983N -3.17 0.00 0.05 -0.03 -0.00 -0.82 -1.08 115.22 110.17 2qc9 n HIS 1983Ca 0.16 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.90 2qc9 n HIS 1983Cb 0.60 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.64 2qc9 n HIS 1983CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2qc9 n ASP 1984N -0.84 1.98 0.00 0.41 5.75 -1.26 -4.98 116.55 117.61 2qc9 n ASP 1984Ca 0.11 -1.66 0.00 0.00 -0.01 0.00 0.00 54.79 53.23 2qc9 n ASP 1984Cb 0.05 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 2qc9 n ASP 1984CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qc9 n GLY 1985N 0.09 0.57 3.74 6.12 0.00 -0.24 -0.98 105.19 114.49 2qc9 n GLY 1985Ca 0.04 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2qc9 n GLY 1985CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qc9 s THR 1986N -2.00 3.95 0.43 2.61 2.01 -1.26 -3.55 115.64 117.83 2qc9 s THR 1986Ca 0.00 1.72 0.08 0.00 0.31 0.00 0.00 61.69 63.80 2qc9 s THR 1986Cb 0.00 -4.10 0.00 0.00 0.01 0.00 0.00 72.50 68.41 2qc9 s THR 1986CO 0.00 0.32 0.49 0.42 -0.69 0.00 0.00 174.62 175.16 2qc9 s THR 1987N -0.40 2.78 0.28 -0.82 -4.23 -1.26 -1.59 115.64 110.40 2qc9 s THR 1987Ca 0.48 -1.16 0.02 0.00 -1.18 0.00 0.00 61.69 59.85 2qc9 s THR 1987Cb -0.28 -2.94 0.07 0.00 1.34 0.00 0.00 72.50 70.69 2qc9 s THR 1987CO 0.34 0.00 1.72 -0.65 -0.54 0.00 0.00 174.62 175.50 2qc9 h PRO 1988N 0.79 0.51 -0.79 3.99 0.11 -1.73 -2.04 132.00 132.84 2qc9 h PRO 1988Ca -0.40 -0.19 -0.02 0.00 0.11 0.00 0.00 66.00 65.50 2qc9 h PRO 1988Cb 1.28 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 2qc9 h PRO 1988CO 0.50 0.71 0.41 1.25 -0.21 0.00 0.00 178.00 180.67 2qc9 h LEU 1989N 0.46 1.01 0.05 2.35 5.85 -1.94 -0.98 115.31 122.10 2qc9 h LEU 1989Ca 0.07 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 2qc9 h LEU 1989Cb 0.65 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.42 2qc9 h LEU 1989CO 0.05 0.84 -0.02 0.40 -0.34 0.00 0.00 178.44 179.37 2qc9 h ILE 1990N 1.11 1.18 -0.46 4.05 2.04 -1.89 -1.66 117.51 121.89 2qc9 h ILE 1990Ca 0.28 -0.76 0.09 0.00 1.00 0.00 0.00 64.86 65.47 2qc9 h ILE 1990Cb 0.07 1.68 -0.10 0.00 -0.74 0.00 0.00 36.82 37.73 2qc9 h ILE 1990CO -0.04 0.19 -0.25 -0.07 0.00 0.00 0.00 178.15 177.98 2qc9 h LEU 1991N -0.40 -0.84 -0.56 1.44 3.38 -1.21 0.23 115.31 117.36 2qc9 h LEU 1991Ca -0.01 0.18 0.11 0.00 0.09 0.00 0.00 57.88 58.25 2qc9 h LEU 1991Cb 0.36 0.44 -0.09 0.00 0.09 0.00 0.00 40.66 41.46 2qc9 h LEU 1991CO 0.01 -0.27 0.07 0.00 0.09 0.00 0.00 178.44 178.35 2qc9 h ALA 1992N 1.09 0.61 0.06 1.53 0.00 -1.06 0.17 119.26 121.66 2qc9 h ALA 1992Ca 0.21 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.26 2qc9 h ALA 1992Cb 0.49 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2qc9 h ALA 1992CO -0.55 -0.34 -0.03 0.00 0.00 0.00 0.00 179.25 178.33 2qc9 h ALA 1993N 1.47 -0.08 -0.52 0.00 0.00 -0.06 0.25 119.26 120.32 2qc9 h ALA 1993Ca 0.29 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.15 2qc9 h ALA 1993Cb 0.44 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 2qc9 h ALA 1993CO -0.41 -0.47 0.29 0.00 0.00 0.00 0.00 179.25 178.65 2qc9 h ARG 1994N -0.23 0.56 0.00 0.00 3.08 -0.01 -1.81 114.38 115.97 2qc9 h ARG 1994Ca -0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2qc9 h ARG 1994Cb 0.20 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2qc9 h ARG 1994CO 0.01 0.37 0.00 1.28 -1.07 0.00 0.00 179.97 180.57 2qc9 n LEU 1995N -4.82 0.00 -3.31 3.04 4.77 0.54 -4.92 117.00 112.30 2qc9 n LEU 1995Ca 0.04 0.22 -0.17 0.00 -0.03 0.00 0.00 56.01 56.08 2qc9 n LEU 1995Cb 0.10 -0.22 0.07 0.00 -2.33 0.00 0.00 43.42 41.03 2qc9 n LEU 1995CO 0.31 -0.02 0.02 0.00 -1.33 0.00 0.00 177.39 176.37 2qc9 n ALA 1996N -1.22 -2.48 -3.72 -1.18 0.00 -0.49 -4.97 120.51 106.45 2qc9 n ALA 1996Ca 0.15 0.09 -0.33 0.00 0.00 0.00 0.00 53.44 53.34 2qc9 n ALA 1996Cb 0.19 -5.49 -0.08 0.00 0.00 0.00 0.00 19.45 14.07 2qc9 n ALA 1996CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qc9 n LEU 1997N -3.37 3.82 -0.20 0.00 4.77 -0.04 -4.96 117.00 117.01 2qc9 n LEU 1997Ca -0.08 -5.17 0.01 0.00 -0.03 0.00 0.00 56.01 50.74 2qc9 n LEU 1997Cb 0.62 -0.98 0.10 0.00 -2.33 0.00 0.00 43.42 40.83 2qc9 n LEU 1997CO 0.60 1.64 0.85 -0.08 -1.33 0.00 0.00 177.39 179.07 2qc9 h GLU 1998N 5.75 0.13 -0.48 3.23 4.57 -1.93 -1.66 114.58 124.19 2qc9 h GLU 1998Ca 0.16 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.39 2qc9 h GLU 1998Cb 0.79 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.29 2qc9 h GLU 1998CO 0.81 0.09 0.18 0.78 -1.18 0.00 0.00 179.01 179.70 2qc9 h GLY 1999N 0.14 0.64 1.64 1.92 0.00 -1.98 -1.59 103.07 103.84 2qc9 h GLY 1999Ca 0.32 -0.11 -0.15 0.00 0.00 0.00 0.00 47.33 47.39 2qc9 h GLY 1999CO -0.50 0.03 -0.55 -0.33 0.00 0.00 0.00 176.54 175.19 2qc9 h MET 2000N 0.37 0.38 0.01 4.80 2.86 -1.86 -2.33 114.93 119.15 2qc9 h MET 2000Ca 0.23 -0.24 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2qc9 h MET 2000Cb 0.22 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2qc9 h MET 2000CO -0.22 0.83 -0.00 1.25 1.06 0.00 0.00 176.91 179.83 2qc9 h LEU 2001N 0.29 -0.01 -0.43 1.22 5.85 -0.94 -1.64 115.31 119.66 2qc9 h LEU 2001Ca 0.00 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 2qc9 h LEU 2001Cb 1.06 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 2qc9 h LEU 2001CO 0.09 0.12 0.22 -0.33 -0.34 0.00 0.00 178.44 178.19 2qc9 h GLU 2002N -0.13 0.62 -0.59 1.25 5.08 -1.27 -1.59 114.58 117.95 2qc9 h GLU 2002Ca -0.00 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2qc9 h GLU 2002Cb 0.13 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2qc9 h GLU 2002CO 0.00 0.52 0.19 -0.44 -1.00 0.00 0.00 179.01 178.29 2qc9 h ASP 2003N 0.56 0.81 -0.54 1.42 3.32 -1.36 0.35 116.42 120.98 2qc9 h ASP 2003Ca 0.15 -0.13 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 2qc9 h ASP 2003Cb 0.10 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 2qc9 h ASP 2003CO -0.02 0.76 0.10 -0.07 -1.72 0.00 0.00 179.24 178.29 2qc9 h LEU 2004N 0.86 0.88 -0.12 1.55 3.38 -1.01 0.65 115.31 121.49 2qc9 h LEU 2004Ca 0.20 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2qc9 h LEU 2004Cb 0.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2qc9 h LEU 2004CO -0.01 0.89 -0.10 0.40 0.09 0.00 0.00 178.44 179.70 2qc9 h ILE 2005N 0.88 1.34 0.00 1.22 2.04 -0.53 -0.37 117.51 122.10 2qc9 h ILE 2005Ca 0.18 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 2qc9 h ILE 2005Cb 0.38 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.34 2qc9 h ILE 2005CO 0.01 0.36 -0.08 0.78 0.00 0.00 0.00 178.15 179.21 2qc9 h ASN 2006N -0.09 0.00 -0.19 1.72 2.35 -0.08 0.54 115.58 119.83 2qc9 h ASN 2006Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2qc9 h ASN 2006Cb 0.61 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.98 2qc9 h ASN 2006CO 0.03 0.08 0.00 -1.20 -1.65 0.00 0.00 177.43 174.69 2qc9 n SER 2007N -3.81 1.18 0.00 5.81 7.64 0.20 -4.91 113.62 119.73 2qc9 n SER 2007Ca -0.02 -1.89 0.00 0.00 1.01 0.00 0.00 58.87 57.97 2qc9 n SER 2007Cb 0.18 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 2qc9 n SER 2007CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2qc9 n HIS 2008N 0.10 0.00 -1.77 1.43 8.25 0.18 -5.04 115.22 118.37 2qc9 n HIS 2008Ca 0.10 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.15 2qc9 n HIS 2008Cb 0.20 -0.75 0.01 0.00 1.12 0.00 0.00 29.99 30.57 2qc9 n HIS 2008CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qc9 n ALA 2009N -0.22 2.25 -1.85 -1.41 0.00 -0.17 -4.81 120.51 114.29 2qc9 n ALA 2009Ca 0.00 0.31 -0.33 0.00 0.00 0.00 0.00 53.44 53.41 2qc9 n ALA 2009Cb 0.27 -2.41 -0.04 0.00 0.00 0.00 0.00 19.45 17.28 2qc9 n ALA 2009CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qc9 s ASP 2010N -0.25 4.86 0.67 0.00 2.15 -1.26 -4.78 116.67 118.05 2qc9 s ASP 2010Ca 0.56 0.36 0.40 0.00 0.43 0.00 0.00 52.55 54.31 2qc9 s ASP 2010Cb -0.47 -2.53 2.20 0.00 -0.30 0.00 0.00 42.92 41.83 2qc9 s ASP 2010CO 0.62 -2.74 2.24 1.62 -0.17 0.00 0.00 175.17 176.73 2qc9 h VAL 2011N 7.26 0.00 -0.16 1.11 3.04 -1.91 -2.48 116.25 123.12 2qc9 h VAL 2011Ca -0.17 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.52 2qc9 h VAL 2011Cb 1.15 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 2qc9 h VAL 2011CO 1.18 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 178.33 2qc9 n ASN 2012N -3.02 3.14 -4.67 3.17 3.02 -1.26 -4.57 115.26 111.07 2qc9 n ASN 2012Ca -0.03 -1.98 -0.31 0.00 -0.03 0.00 0.00 54.58 52.23 2qc9 n ASN 2012Cb 0.16 -0.09 0.16 0.00 -0.61 0.00 0.00 39.78 39.41 2qc9 n ASN 2012CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qc9 s ALA 2013N -1.79 1.40 0.04 5.41 0.00 -0.93 -4.93 121.76 120.95 2qc9 s ALA 2013Ca 0.31 0.45 -0.01 0.00 0.00 0.00 0.00 51.96 52.71 2qc9 s ALA 2013Cb 0.21 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 2qc9 s ALA 2013CO 0.30 -2.71 -0.01 0.14 0.00 0.00 0.00 175.76 173.48 2qc9 s VAL 2014N -2.68 0.17 0.07 0.00 -7.23 -1.26 -4.33 120.40 105.14 2qc9 s VAL 2014Ca 0.66 -1.43 -0.01 0.00 -1.81 0.00 0.00 61.98 59.39 2qc9 s VAL 2014Cb -0.22 -1.03 0.01 0.00 0.56 0.00 0.00 36.38 35.71 2qc9 s VAL 2014CO 0.58 -0.79 0.09 -0.90 -0.31 0.00 0.00 175.10 173.78 2qc9 n ASP 2015N 0.68 0.03 0.29 4.85 5.68 -0.30 -4.85 116.55 122.93 2qc9 n ASP 2015Ca -0.18 -1.05 0.18 0.00 -0.50 0.00 0.00 54.79 53.24 2qc9 n ASP 2015Cb 0.59 -0.07 0.78 0.00 -1.14 0.00 0.00 41.12 41.28 2qc9 n ASP 2015CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2qc9 h ASP 2016N -0.11 0.00 0.11 -1.12 5.19 -1.26 -1.16 116.42 118.08 2qc9 h ASP 2016Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 2qc9 h ASP 2016Cb 0.09 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.60 2qc9 h ASP 2016CO 0.02 0.01 -0.01 0.18 -3.12 0.00 0.00 179.24 176.32 2qc9 n LEU 2017N -3.11 0.17 0.00 1.55 4.77 -1.26 -4.86 117.00 114.26 2qc9 n LEU 2017Ca -0.00 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2qc9 n LEU 2017Cb 0.26 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2qc9 n LEU 2017CO 0.26 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 2qc9 n GLY 2018N 1.08 0.50 3.80 -0.72 0.00 -0.44 -2.28 105.19 107.13 2qc9 n GLY 2018Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 2qc9 n GLY 2018CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qc9 s LYS 2019N -0.14 4.36 0.50 1.61 1.02 -1.26 -3.95 119.74 121.88 2qc9 s LYS 2019Ca 0.00 0.96 0.07 0.00 0.02 0.00 0.00 55.97 57.03 2qc9 s LYS 2019Cb 0.00 -3.02 0.03 0.00 -0.52 0.00 0.00 37.83 34.32 2qc9 s LYS 2019CO 0.00 0.46 0.48 -1.54 -0.92 0.00 0.00 175.35 173.83 2qc9 s SER 2020N -1.45 4.89 0.38 2.83 1.04 -1.26 -1.14 113.70 118.98 2qc9 s SER 2020Ca 0.40 -0.97 0.08 0.00 0.48 0.00 0.00 55.95 55.93 2qc9 s SER 2020Cb -0.19 0.02 0.74 0.00 0.10 0.00 0.00 66.02 66.70 2qc9 s SER 2020CO 0.22 -0.99 1.92 0.00 0.98 0.00 0.00 173.24 175.38 2qc9 h ALA 2021N 0.73 1.49 -0.24 5.32 0.00 -1.81 -1.04 119.26 123.71 2qc9 h ALA 2021Ca -0.37 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.23 2qc9 h ALA 2021Cb 1.29 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2qc9 h ALA 2021CO 0.54 0.36 -0.38 1.25 0.00 0.00 0.00 179.25 181.02 2qc9 h LEU 2022N 0.33 0.57 0.60 0.00 5.85 -1.95 0.17 115.31 120.89 2qc9 h LEU 2022Ca 0.07 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 2qc9 h LEU 2022Cb 0.32 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.19 2qc9 h LEU 2022CO 0.01 0.90 -0.29 0.45 -0.34 0.00 0.00 178.44 179.17 2qc9 h HIS 2023N 0.46 -0.75 -0.34 1.25 3.86 -1.60 -2.06 115.15 115.97 2qc9 h HIS 2023Ca 0.04 -0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 2qc9 h HIS 2023Cb 0.86 0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.56 2qc9 h HIS 2023CO 0.03 -0.45 0.09 -1.49 0.86 0.00 0.00 177.93 176.97 2qc9 h TRP 2024N -0.83 0.50 -0.37 2.45 4.06 -1.25 -2.13 115.95 118.37 2qc9 h TRP 2024Ca -0.08 -0.02 0.04 0.00 2.06 0.00 0.00 58.89 60.89 2qc9 h TRP 2024Cb 0.63 -0.15 -0.04 0.00 -1.00 0.00 0.00 29.16 28.60 2qc9 h TRP 2024CO -0.03 0.43 0.13 0.00 -3.56 0.00 0.00 178.44 175.41 2qc9 h ALA 2025N 1.62 0.43 0.17 1.49 0.00 -0.41 -1.57 119.26 120.99 2qc9 h ALA 2025Ca 0.12 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2qc9 h ALA 2025Cb 0.17 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2qc9 h ALA 2025CO -0.01 -0.26 -0.08 0.00 0.00 0.00 0.00 179.25 178.90 2qc9 h ALA 2026N 1.23 -0.23 -0.84 0.00 0.00 -0.90 0.54 119.26 119.07 2qc9 h ALA 2026Ca 0.17 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.14 2qc9 h ALA 2026Cb 0.14 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.93 2qc9 h ALA 2026CO -0.17 -0.59 0.42 0.00 0.00 0.00 0.00 179.25 178.91 2qc9 h ALA 2027N 0.50 1.25 -0.17 0.00 0.00 -1.10 0.28 119.26 120.01 2qc9 h ALA 2027Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2qc9 h ALA 2027Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2qc9 h ALA 2027CO 0.04 -0.11 0.00 1.33 0.00 0.00 0.00 179.25 180.51 2qc9 n VAL 2028N -4.89 0.21 -3.69 0.00 0.24 -0.62 -4.82 118.33 104.76 2qc9 n VAL 2028Ca 0.17 -0.46 -0.26 0.00 -2.04 0.00 0.00 64.34 61.75 2qc9 n VAL 2028Cb 0.43 0.75 0.06 0.00 -1.47 0.00 0.00 33.84 33.62 2qc9 n VAL 2028CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2qc9 n ASN 2029N 0.77 -5.76 -4.53 -1.34 5.15 0.09 -4.89 115.26 104.75 2qc9 n ASN 2029Ca 0.17 -0.62 -0.43 0.00 -0.60 0.00 0.00 54.58 53.11 2qc9 n ASN 2029Cb 0.45 -4.68 -0.02 0.00 -0.53 0.00 0.00 39.78 35.00 2qc9 n ASN 2029CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2qc9 s ASN 2030N -3.35 6.71 0.18 1.20 3.84 0.17 -4.76 114.94 118.93 2qc9 s ASN 2030Ca 0.59 -2.08 -0.11 0.00 0.21 0.00 0.00 52.86 51.47 2qc9 s ASN 2030Cb -0.27 -2.52 0.09 0.00 -0.55 0.00 0.00 41.25 38.00 2qc9 s ASN 2030CO 0.76 -1.22 1.75 1.62 -2.79 0.00 0.00 177.10 177.22 2qc9 h VAL 2031N 5.95 1.23 -0.84 -5.21 3.04 -1.90 -2.20 116.25 116.33 2qc9 h VAL 2031Ca 0.29 -0.71 0.04 0.00 -1.01 0.00 0.00 66.70 65.30 2qc9 h VAL 2031Cb 0.95 0.51 -0.05 0.00 -2.01 0.00 0.00 31.29 30.69 2qc9 h VAL 2031CO 1.36 0.28 0.55 0.44 -1.01 0.00 0.00 177.57 179.19 2qc9 h ASP 2032N 0.90 0.88 -0.10 3.17 3.32 -1.98 -2.19 116.42 120.41 2qc9 h ASP 2032Ca 0.22 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.21 2qc9 h ASP 2032Cb 0.19 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 2qc9 h ASP 2032CO -0.02 0.60 -0.12 0.00 -1.72 0.00 0.00 179.24 177.97 2qc9 h ALA 2033N 1.52 0.15 -0.80 3.45 0.00 -1.92 -3.01 119.26 118.64 2qc9 h ALA 2033Ca 0.34 -0.32 0.14 0.00 0.00 0.00 0.00 54.91 55.07 2qc9 h ALA 2033Cb 0.07 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.74 2qc9 h ALA 2033CO -0.10 0.02 0.37 0.00 0.00 0.00 0.00 179.25 179.53 2qc9 h ALA 2034N 0.56 1.17 -0.20 0.00 0.00 -0.95 0.30 119.26 120.13 2qc9 h ALA 2034Ca 0.01 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2qc9 h ALA 2034Cb 0.66 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2qc9 h ALA 2034CO 0.03 -0.15 0.05 0.28 0.00 0.00 0.00 179.25 179.45 2qc9 h VAL 2035N 0.53 1.21 -0.75 0.00 2.07 -1.41 -1.64 116.25 116.25 2qc9 h VAL 2035Ca 0.44 -0.67 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 2qc9 h VAL 2035Cb 0.64 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 2qc9 h VAL 2035CO -0.38 0.21 0.28 0.58 0.02 0.00 0.00 177.57 178.27 2qc9 h VAL 2036N 0.14 1.26 -0.49 2.57 2.07 -1.26 -1.69 116.25 118.85 2qc9 h VAL 2036Ca 0.06 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.69 2qc9 h VAL 2036Cb 0.27 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 2qc9 h VAL 2036CO 0.00 0.34 0.09 -0.07 0.02 0.00 0.00 177.57 177.95 2qc9 h LEU 2037N 1.10 0.77 -1.11 2.57 3.38 -0.83 -1.93 115.31 119.25 2qc9 h LEU 2037Ca 0.25 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2qc9 h LEU 2037Cb 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2qc9 h LEU 2037CO -0.02 0.82 -0.44 -0.07 0.09 0.00 0.00 178.44 178.82 2qc9 h LEU 2038N 0.68 0.00 -1.17 1.67 3.38 -1.17 0.67 115.31 119.36 2qc9 h LEU 2038Ca 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 2qc9 h LEU 2038Cb 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2qc9 h LEU 2038CO 0.01 0.44 -0.34 0.50 0.09 0.00 0.00 178.44 179.14 2qc9 h LYS 2039N 0.00 0.00 -0.47 1.13 3.11 -0.93 -3.14 116.57 116.27 2qc9 h LYS 2039Ca -0.00 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.81 2qc9 h LYS 2039Cb 0.79 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.01 2qc9 h LYS 2039CO 0.06 0.34 0.02 0.09 -2.81 0.00 0.00 179.45 177.15 2qc9 n ASN 2040N -3.68 4.90 0.00 4.20 3.02 -0.76 -4.93 115.26 118.01 2qc9 n ASN 2040Ca -0.01 -3.02 0.00 0.00 -0.03 0.00 0.00 54.58 51.52 2qc9 n ASN 2040Cb 0.44 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 2qc9 n ASN 2040CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qc9 n GLY 2041N 0.08 0.67 3.63 7.41 0.00 -1.12 -4.93 105.19 110.93 2qc9 n GLY 2041Ca 0.27 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.79 2qc9 n GLY 2041CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qc9 n ALA 2042N -1.50 0.88 -1.55 4.61 0.00 0.17 -4.81 120.51 118.30 2qc9 n ALA 2042Ca 0.00 0.18 -0.42 0.00 0.00 0.00 0.00 53.44 53.20 2qc9 n ALA 2042Cb 0.00 -2.52 -0.04 0.00 0.00 0.00 0.00 19.45 16.89 2qc9 n ALA 2042CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2qc9 n ASN 2043N 7.63 2.59 0.26 0.00 2.85 -1.26 -4.68 115.26 122.65 2qc9 n ASN 2043Ca 0.27 -0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.86 2qc9 n ASN 2043Cb 0.28 -1.48 0.72 0.00 1.24 0.00 0.00 39.78 40.54 2qc9 n ASN 2043CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 2qc9 h LYS 2044N 16.00 0.00 -0.43 1.20 2.10 -1.97 -2.94 116.57 130.52 2qc9 h LYS 2044Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 2qc9 h LYS 2044Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 2qc9 h LYS 2044CO 1.06 0.12 0.00 -0.25 -2.00 0.00 0.00 179.45 178.38 2qc9 n ASP 2045N -3.69 4.25 -4.75 7.07 8.00 -1.26 -4.58 116.55 121.59 2qc9 n ASP 2045Ca -0.02 -2.66 -0.39 0.00 0.71 0.00 0.00 54.79 52.43 2qc9 n ASP 2045Cb 0.23 -0.52 0.04 0.00 -0.02 0.00 0.00 41.12 40.85 2qc9 n ASP 2045CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2qc9 s MET 2046N -2.22 3.16 -0.08 -1.24 1.75 -1.11 -4.93 119.30 114.63 2qc9 s MET 2046Ca 0.43 2.28 0.04 0.00 -1.25 0.00 0.00 55.69 57.19 2qc9 s MET 2046Cb 0.31 -2.29 -0.00 0.00 2.84 0.00 0.00 34.83 35.69 2qc9 s MET 2046CO 0.16 -1.19 -0.22 -0.65 -0.65 0.00 0.00 175.02 172.47 2qc9 s GLN 2047N -2.88 2.62 0.04 4.11 -0.21 -1.26 -3.93 119.66 118.16 2qc9 s GLN 2047Ca 0.71 -0.79 -0.01 0.00 0.02 0.00 0.00 55.36 55.29 2qc9 s GLN 2047Cb -0.41 -2.07 0.01 0.00 1.00 0.00 0.00 33.01 31.54 2qc9 s GLN 2047CO 0.49 0.21 0.06 0.27 -2.12 0.00 0.00 175.29 174.20 2qc9 n ASN 2048N 3.39 -0.12 0.21 5.90 0.23 -0.86 -4.78 115.26 119.22 2qc9 n ASN 2048Ca -0.19 -0.96 0.18 0.00 -0.53 0.00 0.00 54.58 53.08 2qc9 n ASN 2048Cb 0.53 -0.04 0.84 0.00 -2.08 0.00 0.00 39.78 39.02 2qc9 n ASN 2048CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 2qc9 h ASN 2049N -0.19 0.00 -0.86 0.53 2.35 -1.67 -0.89 115.58 114.84 2qc9 h ASN 2049Ca -0.02 0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 55.22 2qc9 h ASN 2049Cb 0.05 0.00 -0.28 0.00 0.05 0.00 0.00 38.32 38.14 2qc9 h ASN 2049CO 0.01 0.00 0.48 0.29 -1.65 0.00 0.00 177.43 176.56 2qc9 n LYS 2050N -3.66 2.41 -1.04 0.81 5.02 -1.26 -4.92 118.16 115.53 2qc9 n LYS 2050Ca 0.02 -3.22 -0.07 0.00 -2.02 0.00 0.00 58.31 53.02 2qc9 n LYS 2050Cb 0.36 -2.16 -0.03 0.00 -0.02 0.00 0.00 35.03 33.19 2qc9 n LYS 2050CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2qc9 n GLU 2051N -1.04 -1.46 -2.82 1.97 1.02 -0.34 -2.16 120.64 115.82 2qc9 n GLU 2051Ca 0.55 0.48 -0.40 0.00 -0.02 0.00 0.00 57.16 57.76 2qc9 n GLU 2051Cb 1.19 -4.43 -0.05 0.00 -0.02 0.00 0.00 31.44 28.13 2qc9 n GLU 2051CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2qc9 s GLU 2052N -2.25 4.69 0.37 3.49 2.02 -1.26 -3.88 118.70 121.88 2qc9 s GLU 2052Ca 0.00 1.35 0.06 0.00 0.02 0.00 0.00 54.97 56.40 2qc9 s GLU 2052Cb 0.00 -3.33 -0.00 0.00 0.10 0.00 0.00 34.13 30.90 2qc9 s GLU 2052CO 0.00 0.37 0.52 0.95 0.02 0.00 0.00 175.26 177.13 2qc9 s THR 2053N -0.54 3.82 0.23 3.63 -4.23 -1.26 -2.03 115.64 115.25 2qc9 s THR 2053Ca 0.42 -0.93 -0.07 0.00 -1.18 0.00 0.00 61.69 59.93 2qc9 s THR 2053Cb -0.24 -3.33 0.20 0.00 1.34 0.00 0.00 72.50 70.48 2qc9 s THR 2053CO 0.29 -0.14 1.85 -0.65 -0.54 0.00 0.00 174.62 175.43 2qc9 h PRO 2054N 0.76 1.25 -0.91 3.99 0.11 -1.81 -1.62 132.00 133.78 2qc9 h PRO 2054Ca -0.45 -0.15 -0.02 0.00 0.11 0.00 0.00 66.00 65.50 2qc9 h PRO 2054Cb 1.26 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 2qc9 h PRO 2054CO 0.52 0.92 0.51 1.25 -0.21 0.00 0.00 178.00 180.99 2qc9 h LEU 2055N 1.25 1.12 0.33 2.35 5.85 -1.93 0.27 115.31 124.56 2qc9 h LEU 2055Ca 0.31 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 2qc9 h LEU 2055Cb 0.04 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 40.79 2qc9 h LEU 2055CO -0.05 0.89 -0.16 0.15 -0.34 0.00 0.00 178.44 178.94 2qc9 h PHE 2056N 1.27 -0.41 -0.36 1.25 3.04 -1.76 -0.93 116.94 119.03 2qc9 h PHE 2056Ca 0.32 -0.01 0.06 0.00 3.98 0.00 0.00 57.97 62.32 2qc9 h PHE 2056Cb 0.01 0.14 -0.05 0.00 2.56 0.00 0.00 35.95 38.60 2qc9 h PHE 2056CO 0.01 -0.25 0.03 -0.07 -2.02 0.00 0.00 178.31 176.01 2qc9 h LEU 2057N -0.45 -0.08 -0.52 0.59 3.38 -1.03 -0.96 115.31 116.25 2qc9 h LEU 2057Ca -0.05 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.09 2qc9 h LEU 2057Cb 0.34 0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.14 2qc9 h LEU 2057CO 0.07 -0.01 0.11 0.00 0.09 0.00 0.00 178.44 178.71 2qc9 h ALA 2058N 1.30 0.59 -0.72 1.53 0.00 -0.68 -1.52 119.26 119.76 2qc9 h ALA 2058Ca 0.18 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2qc9 h ALA 2058Cb 0.23 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2qc9 h ALA 2058CO -0.27 -0.30 0.48 0.00 0.00 0.00 0.00 179.25 179.16 2qc9 h ALA 2059N 1.40 1.48 -0.31 0.00 0.00 -0.25 0.01 119.26 121.59 2qc9 h ALA 2059Ca 0.26 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 2qc9 h ALA 2059Cb 0.35 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2qc9 h ALA 2059CO -0.33 0.48 -0.19 -0.09 0.00 0.00 0.00 179.25 179.12 2qc9 h ARG 2060N 0.98 0.68 -0.00 0.00 2.43 -0.24 -3.14 114.38 115.09 2qc9 h ARG 2060Ca 0.26 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2qc9 h ARG 2060Cb -0.11 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 2qc9 h ARG 2060CO -0.06 0.91 -0.11 0.39 -1.51 0.00 0.00 179.97 179.59 2qc9 n GLU 2061N -4.34 0.20 -1.20 0.20 -0.58 -0.76 -4.89 120.64 109.27 2qc9 n GLU 2061Ca -0.03 -0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2qc9 n GLU 2061Cb 0.41 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 2qc9 n GLU 2061CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qc9 n GLY 2062N 1.42 0.39 2.84 0.62 0.00 -0.44 -4.93 105.19 105.09 2qc9 n GLY 2062Ca 0.09 -1.04 -0.41 0.00 0.00 0.00 0.00 46.02 44.67 2qc9 n GLY 2062CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qc9 n SER 2063N 1.96 3.80 -0.06 1.61 7.64 -0.14 -4.76 113.62 123.67 2qc9 n SER 2063Ca 0.00 -2.71 -0.13 0.00 1.01 0.00 0.00 58.87 57.04 2qc9 n SER 2063Cb 0.11 -1.38 -0.09 0.00 -1.01 0.00 0.00 64.21 61.84 2qc9 n SER 2063CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2qc9 h TYR 2064N 6.72 -1.45 -0.57 1.43 5.03 -1.92 0.78 116.97 126.99 2qc9 h TYR 2064Ca 0.53 0.06 0.06 0.00 2.58 0.00 0.00 58.73 61.96 2qc9 h TYR 2064Cb 0.58 0.66 -0.09 0.00 1.55 0.00 0.00 36.73 39.43 2qc9 h TYR 2064CO 1.45 -0.45 -0.55 0.93 -1.32 0.00 0.00 178.16 178.21 2qc9 h GLU 2065N -0.44 -0.27 -0.68 1.82 3.07 -1.94 0.96 114.58 117.09 2qc9 h GLU 2065Ca 0.04 0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 58.88 2qc9 h GLU 2065Cb 0.56 0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.50 2qc9 h GLU 2065CO -0.44 -0.18 0.26 1.15 -1.40 0.00 0.00 179.01 178.39 2qc9 h THR 2066N -0.28 1.24 -0.38 1.13 2.02 -1.82 -1.93 112.91 112.88 2qc9 h THR 2066Ca 0.11 -0.76 0.07 0.00 0.77 0.00 0.00 66.41 66.60 2qc9 h THR 2066Cb 0.55 0.44 -0.06 0.00 -1.74 0.00 0.00 68.15 67.34 2qc9 h THR 2066CO -0.69 0.30 0.00 0.00 0.37 0.00 0.00 175.52 175.51 2qc9 h ALA 2067N 1.30 0.35 -0.85 6.16 0.00 0.12 -0.14 119.26 126.20 2qc9 h ALA 2067Ca 0.23 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2qc9 h ALA 2067Cb 0.21 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2qc9 h ALA 2067CO -0.02 -0.39 0.54 -0.22 0.00 0.00 0.00 179.25 179.16 2qc9 h LYS 2068N 0.11 1.13 -0.35 0.00 3.64 -0.42 -1.37 116.57 119.29 2qc9 h LYS 2068Ca 0.19 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2qc9 h LYS 2068Cb 0.26 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2qc9 h LYS 2068CO -0.31 0.76 0.21 0.28 -2.27 0.00 0.00 179.45 178.13 2qc9 h VAL 2069N 1.15 1.12 -0.58 2.00 2.07 -0.34 -0.16 116.25 121.52 2qc9 h VAL 2069Ca 0.31 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 2qc9 h VAL 2069Cb -0.10 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 2qc9 h VAL 2069CO -0.06 0.12 0.12 -0.07 0.02 0.00 0.00 177.57 177.69 2qc9 h LEU 2070N 0.46 0.85 -0.66 2.57 3.38 -0.54 -2.17 115.31 119.21 2qc9 h LEU 2070Ca 0.13 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2qc9 h LEU 2070Cb 0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2qc9 h LEU 2070CO -0.02 0.84 -0.53 -0.07 0.09 0.00 0.00 178.44 178.75 2qc9 h LEU 2071N 0.86 0.42 0.00 1.67 3.38 -0.98 -1.69 115.31 118.97 2qc9 h LEU 2071Ca 0.18 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2qc9 h LEU 2071Cb 0.34 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2qc9 h LEU 2071CO 0.00 0.87 0.00 0.47 0.09 0.00 0.00 178.44 179.88 2qc9 n ASP 2072N -3.95 0.00 -1.01 -0.43 8.00 -0.10 -1.46 116.55 117.61 2qc9 n ASP 2072Ca -0.02 0.42 0.08 0.00 0.71 0.00 0.00 54.79 55.98 2qc9 n ASP 2072Cb 0.58 -0.47 0.24 0.00 -0.02 0.00 0.00 41.12 41.45 2qc9 n ASP 2072CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2qc9 n HIS 2073N -1.47 0.78 -3.33 1.24 8.25 -0.77 -4.97 115.22 114.96 2qc9 n HIS 2073Ca 0.05 -0.53 -0.16 0.00 -0.26 0.00 0.00 57.72 56.82 2qc9 n HIS 2073Cb 0.20 -0.06 0.08 0.00 1.12 0.00 0.00 29.99 31.33 2qc9 n HIS 2073CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2qc9 n PHE 2074N 0.92 -2.36 -2.74 4.41 3.72 -0.53 -4.95 117.46 115.93 2qc9 n PHE 2074Ca 0.18 0.88 -0.42 0.00 -0.05 0.00 0.00 57.45 58.04 2qc9 n PHE 2074Cb 0.57 -4.45 -0.03 0.00 -0.94 0.00 0.00 39.48 34.63 2qc9 n PHE 2074CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qc9 s ALA 2075N -3.39 3.24 -0.44 4.37 0.00 -0.71 -4.93 121.76 119.90 2qc9 s ALA 2075Ca 0.30 0.45 -0.27 0.00 0.00 0.00 0.00 51.96 52.44 2qc9 s ALA 2075Cb -0.04 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.69 2qc9 s ALA 2075CO 0.74 -0.31 2.38 -1.71 0.00 0.00 0.00 175.76 176.86 2qc9 n ASN 2076N 4.16 2.49 -0.56 0.00 2.85 -1.26 -4.79 115.26 118.14 2qc9 n ASN 2076Ca 0.06 -0.35 0.04 0.00 -0.11 0.00 0.00 54.58 54.22 2qc9 n ASN 2076Cb 0.50 -1.57 0.12 0.00 1.24 0.00 0.00 39.78 40.07 2qc9 n ASN 2076CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 2qc9 n ARG 2077N 8.95 1.73 -0.31 1.20 1.85 -1.26 -3.60 116.66 125.21 2qc9 n ARG 2077Ca 0.36 -0.95 0.07 0.00 -1.00 0.00 0.00 57.85 56.34 2qc9 n ARG 2077Cb 0.52 -1.30 0.22 0.00 -1.05 0.00 0.00 32.46 30.84 2qc9 n ARG 2077CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2qc9 n ASP 2078N 0.24 3.47 -4.80 2.89 8.00 -1.26 -4.68 116.55 120.41 2qc9 n ASP 2078Ca 0.09 -2.32 -0.37 0.00 0.71 0.00 0.00 54.79 52.89 2qc9 n ASP 2078Cb 0.28 -0.37 -0.06 0.00 -0.02 0.00 0.00 41.12 40.95 2qc9 n ASP 2078CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qc9 s ILE 2079N -1.58 5.17 0.44 0.53 1.01 -1.24 -5.06 121.20 120.48 2qc9 s ILE 2079Ca 0.33 0.72 0.07 0.00 0.00 0.00 0.00 60.65 61.77 2qc9 s ILE 2079Cb 0.21 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.97 2qc9 s ILE 2079CO 0.16 0.50 0.22 0.42 0.00 0.00 0.00 174.94 176.24 2qc9 s THR 2080N -0.44 2.14 0.47 2.92 -4.23 -1.26 -4.62 115.64 110.61 2qc9 s THR 2080Ca 0.21 -1.65 -0.03 0.00 -1.18 0.00 0.00 61.69 59.04 2qc9 s THR 2080Cb -0.15 -2.79 0.10 0.00 1.34 0.00 0.00 72.50 71.00 2qc9 s THR 2080CO 0.10 0.00 0.64 -0.90 -0.54 0.00 0.00 174.62 173.92 2qc9 n ASP 2081N -1.36 0.57 0.07 3.99 5.75 -1.13 -4.61 116.55 119.83 2qc9 n ASP 2081Ca -0.02 -1.55 0.21 0.00 -0.01 0.00 0.00 54.79 53.42 2qc9 n ASP 2081Cb 0.64 -0.44 0.73 0.00 -1.03 0.00 0.00 41.12 41.02 2qc9 n ASP 2081CO 0.00 0.00 0.00 1.12 -0.11 0.00 0.00 177.20 178.21 2qc9 h HIS 2082N -0.80 0.00 -0.96 2.11 2.07 -1.69 0.45 115.15 116.33 2qc9 h HIS 2082Ca -0.21 0.00 -0.50 0.00 -2.85 0.00 0.00 60.37 56.81 2qc9 h HIS 2082Cb 0.71 0.00 -0.30 0.00 2.57 0.00 0.00 27.41 30.39 2qc9 h HIS 2082CO 0.00 0.00 0.61 -1.33 -3.07 0.00 0.00 177.93 174.14 2qc9 n MET 2083N -3.71 2.23 -3.46 5.12 2.81 -1.26 -4.91 117.12 113.94 2qc9 n MET 2083Ca 0.08 -3.03 -0.22 0.00 -1.81 0.00 0.00 57.70 52.73 2qc9 n MET 2083Cb 0.66 -2.16 -0.04 0.00 -0.71 0.00 0.00 33.22 30.98 2qc9 n MET 2083CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2qc9 n ASP 2084N -1.14 -1.37 -4.80 7.83 8.00 0.16 -4.89 116.55 120.33 2qc9 n ASP 2084Ca 0.58 -0.40 -0.38 0.00 0.71 0.00 0.00 54.79 55.31 2qc9 n ASP 2084Cb 1.62 -1.25 -0.06 0.00 -0.02 0.00 0.00 41.12 41.40 2qc9 n ASP 2084CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2qc9 s ARG 2085N -5.92 4.04 0.07 -1.24 0.52 -1.26 -4.79 118.95 110.36 2qc9 s ARG 2085Ca 0.42 0.39 -0.23 0.00 -0.52 0.00 0.00 55.73 55.79 2qc9 s ARG 2085Cb -0.25 -3.29 -0.06 0.00 0.52 0.00 0.00 34.95 31.88 2qc9 s ARG 2085CO 0.52 0.54 0.69 -0.51 0.02 0.00 0.00 175.30 176.55 2qc9 s LEU 2086N -0.57 4.50 0.32 2.53 1.43 -1.26 -2.82 118.68 122.80 2qc9 s LEU 2086Ca 0.23 1.39 0.16 0.00 -1.03 0.00 0.00 54.13 54.88 2qc9 s LEU 2086Cb -0.16 -3.10 0.86 0.00 0.03 0.00 0.00 46.19 43.82 2qc9 s LEU 2086CO 0.12 0.14 1.42 -0.81 0.23 0.00 0.00 176.35 177.44 2qc9 n PRO 2087N 2.25 0.11 0.03 1.29 -0.04 -1.26 1.00 135.00 138.37 2qc9 n PRO 2087Ca -0.06 0.59 -0.12 0.00 -0.04 0.00 0.00 63.50 63.87 2qc9 n PRO 2087Cb 0.50 -2.04 -0.01 0.00 -0.04 0.00 0.00 33.50 31.92 2qc9 n PRO 2087CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2qc9 h ARG 2088N 0.00 0.54 -0.30 0.54 1.12 -1.91 -2.01 114.38 112.36 2qc9 h ARG 2088Ca 0.00 -0.44 -0.06 0.00 -1.11 0.00 0.00 59.98 58.37 2qc9 h ARG 2088Cb 0.38 0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 30.43 2qc9 h ARG 2088CO 0.00 1.07 -0.03 -0.44 -3.11 0.00 0.00 179.97 177.46 2qc9 h ASP 2089N 0.37 0.55 -0.59 -3.80 3.32 0.27 -3.01 116.42 113.52 2qc9 h ASP 2089Ca -0.04 -0.34 -0.08 0.00 0.02 0.00 0.00 57.03 56.60 2qc9 h ASP 2089Cb 1.34 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 2qc9 h ASP 2089CO 0.14 0.75 0.07 0.40 -1.72 0.00 0.00 179.24 178.88 2qc9 h ILE 2090N 0.33 1.26 -0.95 0.35 5.03 -1.51 -2.15 117.51 119.88 2qc9 h ILE 2090Ca 0.08 -1.04 0.14 0.00 -0.12 0.00 0.00 64.86 63.92 2qc9 h ILE 2090Cb 0.49 0.77 -0.08 0.00 -3.03 0.00 0.00 36.82 34.98 2qc9 h ILE 2090CO 0.02 0.38 0.60 0.00 -0.68 0.00 0.00 178.15 178.47 2qc9 h ALA 2091N 1.00 1.70 -0.00 1.87 0.00 -1.29 0.41 119.26 122.95 2qc9 h ALA 2091Ca 0.18 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2qc9 h ALA 2091Cb 0.46 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2qc9 h ALA 2091CO 0.02 0.04 -0.23 0.94 0.00 0.00 0.00 179.25 180.02 2qc9 n GLN 2092N -4.60 0.10 0.03 0.00 -0.06 -1.08 0.70 117.38 112.47 2qc9 n GLN 2092Ca 0.19 -0.04 -0.22 0.00 -2.00 0.00 0.00 57.00 54.93 2qc9 n GLN 2092Cb 0.44 -1.50 -0.14 0.00 -4.06 0.00 0.00 30.24 24.97 2qc9 n GLN 2092CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 2qc9 h GLU 2093N 0.09 0.32 -0.03 3.69 4.81 0.38 -3.27 114.58 120.55 2qc9 h GLU 2093Ca 0.00 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2qc9 h GLU 2093Cb 0.48 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.06 2qc9 h GLU 2093CO 0.00 1.26 0.00 -2.13 -0.73 0.00 0.00 179.01 177.41 2qc9 n ARG 2094N -3.67 1.55 -2.42 1.92 3.00 -0.12 -4.93 116.66 111.99 2qc9 n ARG 2094Ca -0.27 -0.81 -0.14 0.00 -0.00 0.00 0.00 57.85 56.64 2qc9 n ARG 2094Cb 1.01 -1.47 0.00 0.00 0.00 0.00 0.00 32.46 32.01 2qc9 n ARG 2094CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 2qc9 n MET 2095N -0.01 -1.77 -2.65 -0.14 2.81 -1.04 -4.96 117.12 109.36 2qc9 n MET 2095Ca 0.19 0.63 -0.43 0.00 -1.81 0.00 0.00 57.70 56.29 2qc9 n MET 2095Cb 0.31 -4.86 -0.01 0.00 -0.71 0.00 0.00 33.22 27.95 2qc9 n MET 2095CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 2qc9 s HIS 2096N -2.76 2.82 0.34 2.03 3.76 0.22 -4.75 115.29 116.94 2qc9 s HIS 2096Ca 0.06 -1.39 0.08 0.00 -0.15 0.00 0.00 55.06 53.66 2qc9 s HIS 2096Cb -0.03 -4.64 0.63 0.00 1.11 0.00 0.00 32.58 29.65 2qc9 s HIS 2096CO 0.08 -1.77 1.82 0.45 -0.85 0.00 0.00 174.74 174.47 2qc9 h HIS 2097N 8.42 0.30 -0.65 1.40 3.86 -1.93 -1.00 115.15 125.54 2qc9 h HIS 2097Ca 0.32 -0.05 0.10 0.00 -1.16 0.00 0.00 60.37 59.58 2qc9 h HIS 2097Cb 0.93 -0.08 -0.07 0.00 1.06 0.00 0.00 27.41 29.25 2qc9 h HIS 2097CO 1.31 0.49 0.27 0.22 0.86 0.00 0.00 177.93 181.08 2qc9 h ASP 2098N 0.25 0.30 0.47 2.45 3.58 -1.96 -2.38 116.42 119.13 2qc9 h ASP 2098Ca 0.04 0.08 -0.10 0.00 0.42 0.00 0.00 57.03 57.47 2qc9 h ASP 2098Cb 0.55 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.62 2qc9 h ASP 2098CO 0.04 0.17 -1.61 2.30 -2.88 0.00 0.00 179.24 177.25 2qc9 n ILE 2099N -4.96 0.69 -0.30 2.25 -5.35 -1.11 -3.42 119.36 107.17 2qc9 n ILE 2099Ca 0.10 -0.62 0.02 0.00 -0.27 0.00 0.00 62.75 61.99 2qc9 n ILE 2099Cb 0.29 -0.37 0.16 0.00 -1.74 0.00 0.00 39.64 37.98 2qc9 n ILE 2099CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 2qc9 h VAL 2100N 0.00 0.96 0.00 7.28 2.07 -0.93 0.17 116.25 125.80 2qc9 h VAL 2100Ca -0.12 -0.30 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 2qc9 h VAL 2100Cb 1.33 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2qc9 h VAL 2100CO 0.02 0.16 -0.39 -0.09 0.02 0.00 0.00 177.57 177.29 2qc9 h ARG 2101N 0.87 0.00 -0.07 1.57 2.43 -1.57 -3.15 114.38 114.46 2qc9 h ARG 2101Ca 0.39 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.34 2qc9 h ARG 2101Cb 0.29 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2qc9 h ARG 2101CO -0.22 0.39 -0.86 1.25 -1.51 0.00 0.00 179.97 179.02 2qc9 h LEU 2102N 0.00 0.71 -1.46 3.80 5.85 -0.82 -3.12 115.31 120.27 2qc9 h LEU 2102Ca -0.00 -0.51 -0.05 0.00 0.84 0.00 0.00 57.88 58.15 2qc9 h LEU 2102Cb 0.94 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2qc9 h LEU 2102CO 0.05 1.30 -0.20 -0.07 -0.34 0.00 0.00 178.44 179.17 2qc9 h LEU 2103N 0.36 0.09 -0.75 2.25 3.38 -0.77 -2.33 115.31 117.54 2qc9 h LEU 2103Ca -0.07 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2qc9 h LEU 2103Cb 1.48 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.20 2qc9 h LEU 2103CO 0.16 0.30 0.00 0.47 0.09 0.00 0.00 178.44 179.46 2qc9 n ASP 2104N -4.26 1.16 -0.71 -0.43 8.00 -1.21 -3.36 116.55 115.75 2qc9 n ASP 2104Ca -0.02 -1.42 0.05 0.00 0.71 0.00 0.00 54.79 54.12 2qc9 n ASP 2104Cb 0.29 -0.01 0.15 0.00 -0.02 0.00 0.00 41.12 41.53 2qc9 n ASP 2104CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qc9 n GLU 2105N -0.08 1.95 0.00 -1.24 1.02 -0.88 -5.10 120.64 116.31 2qc9 n GLU 2105Ca 0.20 -1.21 0.00 0.00 -0.02 0.00 0.00 57.16 56.13 2qc9 n GLU 2105Cb 0.29 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.34 2qc9 n GLU 2105CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97