Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7o69_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG.B GLY 74.A O no hydrogen 3.229 N/A VAL 5.A N SER 3.A OG.A no hydrogen 3.188 N/A ARG 6.A N SER 3.A O.A no hydrogen 3.009 N/A ARG 6.A NE PHE 9.A O no hydrogen 2.971 N/A ARG 6.A NH1 GLU 14.A OE1 no hydrogen 2.937 N/A ARG 6.A NH2 PHE 9.A O no hydrogen 2.889 N/A ARG 6.A NH2 GLU 14.A OE1 no hydrogen 2.797 N/A ASN 8.A ND2 GLY 122.A O no hydrogen 2.915 N/A ASP 12.A N HIS 10.A ND1 no hydrogen 2.871 N/A GLU 14.A N HIS 10.A O no hydrogen 3.087 N/A ALA 15.A N PRO 11.A O no hydrogen 2.970 N/A ALA 16.A N ASP 12.A O no hydrogen 2.987 N/A ILE 17.A N SER 13.A O no hydrogen 2.880 N/A ASN 18.A N GLU 14.A O no hydrogen 3.095 N/A ASN 18.A ND2 ARG 76.A O no hydrogen 3.095 N/A ARG 19.A N ALA 15.A O no hydrogen 3.003 N/A GLN 20.A N ALA 16.A O no hydrogen 2.917 N/A GLN 20.A NE2 GLU 24.A OE2 no hydrogen 2.921 N/A ILE 21.A N ILE 17.A O no hydrogen 2.852 N/A ASN 22.A N ASN 18.A O no hydrogen 3.223 N/A ASN 22.A ND2 ASP 81.A O no hydrogen 2.928 N/A LEU 23.A N ARG 19.A O no hydrogen 3.056 N/A GLU 24.A N GLN 20.A O no hydrogen 2.945 N/A LEU 25.A N ILE 21.A O no hydrogen 3.028 N/A TYR 26.A N ASN 22.A O no hydrogen 2.871 N/A ALA 27.A N LEU 23.A O no hydrogen 2.910 N/A SER 28.A N GLU 24.A O no hydrogen 2.938 N/A SER 28.A OG SER 56.A O no hydrogen 2.883 N/A SER 28.A OG SER 56.A OG no hydrogen 3.098 N/A SER 28.A OG THR 60.A OG1 no hydrogen 2.938 N/A TYR 29.A N LEU 25.A O no hydrogen 3.062 N/A VAL 30.A N TYR 26.A O no hydrogen 2.932 N/A TYR 31.A N.A ALA 27.A O no hydrogen 3.080 N/A TYR 31.A N.B ALA 27.A O no hydrogen 3.094 N/A TYR 31.A OH.A GLU 104.A OE2.A no hydrogen 2.833 N/A TYR 31.A OH.A GLU 104.A OE2.B no hydrogen 2.664 N/A TYR 31.A OH.B GLU 104.A OE2.A no hydrogen 2.461 N/A TYR 31.A OH.B GLU 104.A OE2.B no hydrogen 2.829 N/A LEU 32.A N SER 28.A O no hydrogen 2.961 N/A SER 33.A N TYR 29.A O no hydrogen 2.954 N/A SER 33.A OG GLN 87.A O.A no hydrogen 3.560 N/A MET 34.A N VAL 30.A O no hydrogen 2.975 N/A ALA 35.A N TYR 31.A O.A no hydrogen 2.836 N/A ALA 35.A N TYR 31.A O.B no hydrogen 2.966 N/A TYR 36.A N LEU 32.A O no hydrogen 3.206 N/A TYR 37.A N SER 33.A O no hydrogen 3.029 N/A PHE 38.A N MET 34.A O no hydrogen 3.212 N/A SER 39.A OG.A SER 49.A OG no hydrogen 2.885 N/A SER 39.A OG.B TYR 36.A O no hydrogen 3.274 N/A ARG 40.A N TYR 37.A O no hydrogen 3.126 N/A ARG 40.A NE.A ASP 42.A OD1 no hydrogen 2.922 N/A ARG 40.A NH2.A ASP 42.A OD1 no hydrogen 3.333 N/A ARG 40.A NH2.A ASP 42.A OD2 no hydrogen 2.957 N/A VAL 43.A N ARG 40.A O no hydrogen 3.007 N/A LEU 45.A N PHE 38.A O no hydrogen 2.882 N/A ASN 47.A N ASP 168.A OD2 no hydrogen 2.814 N/A ASN 47.A ND2 ASP 168.A O no hydrogen 2.929 N/A PHE 48.A N ASP 168.A OD2 no hydrogen 3.011 N/A SER 49.A N LEU 45.A O no hydrogen 3.022 N/A SER 49.A OG ALA 35.A O no hydrogen 2.756 N/A SER 49.A OG SER 39.A OG.A no hydrogen 2.885 N/A ARG 50.A N ASN 46.A O no hydrogen 2.977 N/A ARG 50.A NH1.A ASN 47.A OD1 no hydrogen 2.378 N/A ARG 50.A NH1.B ASN 47.A OD1 no hydrogen 2.631 N/A ARG 50.A NH2.A LEU 172.A O no hydrogen 2.816 N/A TYR 51.A N ASN 47.A O no hydrogen 2.925 N/A TYR 51.A OH GLU 144.A OE1 no hydrogen 2.618 N/A PHE 52.A N PHE 48.A O no hydrogen 3.047 N/A LEU 53.A N SER 49.A O no hydrogen 2.940 N/A HIS 54.A N ARG 50.A O no hydrogen 2.969 N/A GLN 55.A N TYR 51.A O no hydrogen 3.051 N/A GLN 55.A NE2.A TYR 51.A O no hydrogen 3.425 N/A SER 56.A N PHE 52.A O no hydrogen 2.850 N/A SER 56.A OG SER 28.A O no hydrogen 2.766 N/A SER 56.A OG SER 28.A OG no hydrogen 3.098 N/A ARG 57.A N LEU 53.A O no hydrogen 3.103 N/A GLU 58.A N HIS 54.A O no hydrogen 2.984 N/A GLU 59.A N GLN 55.A O no hydrogen 3.029 N/A THR 60.A N SER 56.A O no hydrogen 3.191 N/A THR 60.A OG1 SER 28.A OG no hydrogen 2.938 N/A THR 60.A OG1 SER 56.A O no hydrogen 3.409 N/A GLU 61.A N ARG 57.A O no hydrogen 3.166 N/A HIS 62.A N.A GLU 58.A O no hydrogen 2.967 N/A HIS 62.A N.B GLU 58.A O no hydrogen 2.938 N/A HIS 62.A ND1.A GLU 59.A OE1 no hydrogen 2.964 N/A HIS 62.A ND1.B GLU 24.A OE1 no hydrogen 3.190 N/A ALA 63.A N GLU 59.A O no hydrogen 2.922 N/A GLU 64.A N THR 60.A O no hydrogen 2.903 N/A LYS 65.A N GLU 61.A O no hydrogen 2.984 N/A LYS 65.A NZ.B GLU 61.A OE2.B no hydrogen 2.591 N/A LEU 66.A N HIS 62.A O.A no hydrogen 3.378 N/A LEU 66.A N HIS 62.A O.B no hydrogen 3.453 N/A MET 67.A N ALA 63.A O no hydrogen 2.979 N/A ARG 68.A N GLU 64.A O no hydrogen 2.880 N/A LEU 69.A N LYS 65.A O no hydrogen 2.940 N/A GLN 70.A N LEU 66.A O no hydrogen 2.961 N/A GLN 70.A NE2 GLU 14.A O no hydrogen 3.076 N/A GLN 70.A NE2 ASN 18.A OD1 no hydrogen 3.039 N/A ASN 71.A N MET 67.A O no hydrogen 3.161 N/A GLN 72.A N ARG 68.A O no hydrogen 2.807 N/A ARG 73.A N LEU 69.A O no hydrogen 2.921 N/A ARG 73.A NH1 ASP 123.A OD1 no hydrogen 2.976 N/A ARG 73.A NH1 ASP 123.A OD2 no hydrogen 3.276 N/A ARG 73.A NH1 HIS 125.A ND1 no hydrogen 3.066 N/A ARG 73.A NH2 GLN 7.A O no hydrogen 3.082 N/A ARG 73.A NH2 ASP 123.A OD1 no hydrogen 3.474 N/A ARG 73.A NH2 ASP 123.A OD2 no hydrogen 3.199 N/A GLY 74.A N ASN 71.A O no hydrogen 3.128 N/A GLY 75.A N GLN 70.A O no hydrogen 2.863 N/A ARG 76.A N GLU 14.A OE2 no hydrogen 2.869 N/A ARG 76.A NH1 GLY 75.A O no hydrogen 2.843 N/A ARG 78.A N ASN 18.A OD1 no hydrogen 3.126 N/A ARG 78.A NH1 ILE 77.A O no hydrogen 3.258 N/A GLN 87.A NE2.A ASP 89.A O.A no hydrogen 2.961 N/A GLN 87.A NE2.A ASP 89.A O.B no hydrogen 2.867 N/A GLN 87.A NE2.A GLU 91.A OE2 no hydrogen 2.938 N/A GLN 87.A NE2.B ASP 89.A O.A no hydrogen 2.746 N/A GLN 87.A NE2.B ASP 89.A O.B no hydrogen 2.646 N/A GLN 87.A NE2.B GLU 91.A OE2 no hydrogen 3.167 N/A TRP 90.A NE1 SER 33.A OG no hydrogen 2.915 N/A GLU 91.A N ASP 89.A OD1.A no hydrogen 2.879 N/A GLU 91.A N ASP 89.A OD1.B no hydrogen 3.050 N/A SER 92.A N TRP 90.A O no hydrogen 2.827 N/A GLY 93.A N GLU 164.A OE1 no hydrogen 2.811 N/A LEU 94.A N GLU 164.A OE2 no hydrogen 2.896 N/A HIS 95.A N SER 92.A OG no hydrogen 2.906 N/A HIS 95.A NE2 GLN 87.A OE1.A no hydrogen 3.057 N/A HIS 95.A NE2 GLN 87.A OE1.B no hydrogen 2.620 N/A ALA 96.A N SER 92.A O no hydrogen 3.011 N/A MET 97.A N GLY 93.A O no hydrogen 3.046 N/A GLU 98.A N LEU 94.A O no hydrogen 2.896 N/A CYS 99.A N HIS 95.A O no hydrogen 2.861 N/A CYS 99.A SG GLN 87.A OE1.A no hydrogen 3.936 N/A CYS 99.A SG GLN 87.A OE1.B no hydrogen 3.931 N/A CYS 99.A SG HIS 95.A NE2 no hydrogen 3.317 N/A CYS 99.A SG HIS 95.A O no hydrogen 3.373 N/A ALA 100.A N ALA 96.A O no hydrogen 2.847 N/A LEU 101.A N MET 97.A O no hydrogen 2.946 N/A LEU 102.A N GLU 98.A O no hydrogen 3.069 N/A LEU 103.A N CYS 99.A O no hydrogen 2.925 N/A GLU 104.A N ALA 100.A O no hydrogen 2.864 N/A LYS 105.A N LEU 101.A O no hydrogen 3.001 N/A ASN 106.A N LEU 102.A O no hydrogen 2.918 N/A VAL 107.A N LEU 103.A O no hydrogen 2.873 N/A ASN 108.A N GLU 104.A O no hydrogen 2.866 N/A GLN 109.A N LYS 105.A O no hydrogen 2.917 N/A GLN 109.A NE2.A GLU 113.A OE2 no hydrogen 2.788 N/A GLN 109.A NE2.B GLU 113.A OE2 no hydrogen 3.099 N/A SER 110.A N ASN 106.A O no hydrogen 3.118 N/A SER 110.A OG GLN 20.A OE1 no hydrogen 2.627 N/A LEU 111.A N VAL 107.A O no hydrogen 2.971 N/A LEU 112.A N ASN 108.A O no hydrogen 2.861 N/A GLU 113.A N GLN 109.A O no hydrogen 2.949 N/A LEU 114.A N SER 110.A O no hydrogen 2.895 N/A HIS 115.A N LEU 111.A O no hydrogen 2.854 N/A HIS 115.A NE2 GLU 131.A OE2.A no hydrogen 2.692 N/A HIS 115.A NE2 GLU 131.A OE2.B no hydrogen 2.624 N/A ALA 116.A N LEU 112.A O no hydrogen 2.934 N/A LEU 117.A N GLU 113.A O no hydrogen 2.950 N/A ALA 118.A N LEU 114.A O no hydrogen 2.891 N/A SER 119.A N HIS 115.A O no hydrogen 2.864 N/A SER 119.A OG.A HIS 115.A O no hydrogen 2.903 N/A ASP 120.A N ALA 116.A O no hydrogen 2.906 N/A LYS 121.A N LEU 117.A O no hydrogen 2.919 N/A GLY 122.A N SER 119.A O no hydrogen 3.016 N/A ASP 123.A N ALA 118.A O no hydrogen 2.923 N/A LEU 126.A N ASP 123.A OD1 no hydrogen 3.022 N/A CYS 127.A N ASP 123.A O no hydrogen 3.079 N/A CYS 127.A SG HIS 115.A O no hydrogen 4.047 N/A CYS 127.A SG SER 119.A OG.A no hydrogen 3.429 N/A CYS 127.A SG ASP 123.A O no hydrogen 3.526 N/A ASP 128.A N PRO 124.A O no hydrogen 2.894 N/A PHE 129.A N HIS 125.A O no hydrogen 2.909 N/A LEU 130.A N LEU 126.A O no hydrogen 3.032 N/A GLU 131.A N CYS 127.A O no hydrogen 2.962 N/A THR 132.A N ASP 128.A O no hydrogen 2.795 N/A THR 132.A OG1 ASP 128.A O no hydrogen 2.758 N/A THR 132.A OG1 ASP 128.A OD1 no hydrogen 3.234 N/A THR 132.A OG1 ASP 128.A OD2 no hydrogen 3.524 N/A TYR 133.A N PHE 129.A O no hydrogen 3.085 N/A TYR 134.A N LEU 130.A O no hydrogen 2.920 N/A TYR 134.A OH HIS 62.A O.A no hydrogen 2.655 N/A TYR 134.A OH HIS 62.A O.B no hydrogen 2.617 N/A LEU 135.A N LEU 130.A O no hydrogen 2.919 N/A GLN 138.A N TYR 134.A O no hydrogen 2.948 N/A GLN 138.A NE2 GLU 104.A O no hydrogen 3.044 N/A GLN 138.A NE2 GLU 104.A OE1.A no hydrogen 2.769 N/A GLN 138.A NE2 GLU 104.A OE1.B no hydrogen 3.031 N/A VAL 139.A N LEU 135.A O no hydrogen 3.148 N/A LYS 140.A N ASN 136.A O no hydrogen 2.926 N/A SER 141.A N GLU 137.A O no hydrogen 2.962 N/A SER 141.A OG.B GLU 137.A O no hydrogen 2.979 N/A SER 141.A OG.B GLU 137.A OE1.B no hydrogen 3.522 N/A ILE 142.A N GLN 138.A O no hydrogen 2.888 N/A LYS 143.A N VAL 139.A O no hydrogen 3.006 N/A LYS 143.A NZ ASP 147.A OD1 no hydrogen 2.818 N/A LYS 143.A NZ ASP 147.A OD2 no hydrogen 3.301 N/A GLU 144.A N LYS 140.A O no hydrogen 2.947 N/A LEU 145.A N SER 141.A O no hydrogen 2.981 N/A GLY 146.A N ILE 142.A O no hydrogen 2.871 N/A ASP 147.A N LYS 143.A O no hydrogen 2.918 N/A HIS 148.A N GLU 144.A O no hydrogen 2.996 N/A VAL 149.A N LEU 145.A O no hydrogen 2.874 N/A HIS 150.A N GLY 146.A O no hydrogen 2.922 N/A ASN 151.A N ASP 147.A O no hydrogen 3.047 N/A ASN 151.A ND2 ASP 147.A O no hydrogen 3.153 N/A LEU 152.A N HIS 148.A O no hydrogen 2.978 N/A VAL 153.A N VAL 149.A O no hydrogen 2.885 N/A LYS 154.A N HIS 150.A O no hydrogen 2.936 N/A MET 155.A N ASN 151.A O no hydrogen 2.899 N/A GLY 156.A N VAL 153.A O no hydrogen 3.035 N/A ALA 157.A N LEU 152.A O no hydrogen 2.955 N/A ALA 160.A N GLY 156.A O no hydrogen 2.964 N/A ALA 163.A N ALA 160.A O no hydrogen 3.073 N/A LEU 166.A N LEU 162.A O no hydrogen 2.885 N/A PHE 167.A N ALA 163.A O no hydrogen 2.938 N/A ASP 168.A N GLU 164.A O no hydrogen 2.838 N/A THR 169.A N.A TYR 165.A O no hydrogen 3.210 N/A THR 169.A N.B TYR 165.A O no hydrogen 3.196 N/A THR 169.A OG1.B TYR 165.A O no hydrogen 3.104 N/A THR 169.A OG1.B LEU 166.A O no hydrogen 2.947 N/A THR 169.A OG1.B HIS 170.A ND1 no hydrogen 2.989 N/A HIS 170.A N LEU 166.A O no hydrogen 2.941 N/A HIS 170.A ND1 LEU 166.A O no hydrogen 2.820 N/A THR 171.A N PHE 167.A O no hydrogen 2.941 N/A LEU 172.A N PHE 167.A O no hydrogen 3.215 N/A