Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ofk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 17.A OD1 no hydrogen 2.791 N/A ARG 2.A NE ASP 17.A OD2 no hydrogen 3.379 N/A ARG 2.A NH2 ASP 17.A OD2 no hydrogen 2.872 N/A CYS 3.A SG HIS 16.A NE2 no hydrogen 3.622 N/A CYS 3.A SG HIS 174.A ND1 no hydrogen 3.562 N/A VAL 6.A N CYS 3.A O no hydrogen 3.425 N/A ASP 9.A N SER 7.A OG no hydrogen 3.091 N/A LEU 11.A N ASP 9.A OD1 no hydrogen 3.082 N/A TYR 12.A N ASP 9.A O no hydrogen 2.928 N/A ILE 13.A N ASP 9.A O no hydrogen 2.962 N/A ALA 14.A N PRO 10.A O no hydrogen 2.990 N/A TYR 15.A N LEU 11.A O no hydrogen 3.127 N/A HIS 16.A N TYR 12.A O no hydrogen 2.848 N/A HIS 16.A ND1 ASP 17.A OD1 no hydrogen 2.776 N/A ASP 17.A N ILE 13.A O no hydrogen 2.810 N/A ASN 18.A N ALA 14.A O no hydrogen 2.795 N/A GLU 19.A N TYR 15.A O no hydrogen 2.996 N/A TRP 20.A N TYR 15.A O no hydrogen 3.002 N/A GLY 21.A N ALA 167.A O no hydrogen 3.217 N/A VAL 22.A N GLU 19.A O no hydrogen 3.098 N/A GLU 24.A N CYS 168.A O no hydrogen 2.935 N/A ASP 26.A N GLU 24.A OE2 no hydrogen 3.008 N/A SER 27.A OG.A GLU 105.A OE2 no hydrogen 3.114 N/A SER 27.A OG.B GLU 105.A OE2 no hydrogen 2.534 N/A LYS 29.A N ASP 26.A OD1 no hydrogen 2.904 N/A LYS 29.A NZ GLU 24.A OE1 no hydrogen 2.783 N/A LEU 30.A N ASP 26.A O no hydrogen 2.891 N/A PHE 31.A N SER 27.A O no hydrogen 2.926 N/A GLU 32.A N ARG 28.A O no hydrogen 2.935 N/A MET 33.A N LYS 29.A O no hydrogen 3.140 N/A ILE 34.A N LEU 30.A O no hydrogen 2.925 N/A CYS 35.A N PHE 31.A O no hydrogen 3.149 N/A CYS 35.A SG PHE 31.A O no hydrogen 3.461 N/A CYS 35.A SG ASN 97.A OD1 no hydrogen 3.933 N/A LEU 36.A N GLU 32.A O no hydrogen 2.893 N/A GLU 37.A N MET 33.A O no hydrogen 2.852 N/A GLY 38.A N ILE 34.A O no hydrogen 3.141 N/A GLN 39.A N CYS 35.A O no hydrogen 3.017 N/A GLN 39.A NE2 LYS 90.A O no hydrogen 2.971 N/A GLN 40.A N GLU 37.A O no hydrogen 3.208 N/A GLN 40.A NE2 GLN 40.A O no hydrogen 3.232 N/A GLN 40.A NE2 LEU 43.A O no hydrogen 3.123 N/A ALA 41.A N GLY 38.A O no hydrogen 3.082 N/A LEU 43.A N GLN 40.A O no hydrogen 2.853 N/A SER 44.A OG THR 47.A OG1 no hydrogen 3.063 N/A THR 47.A OG1 SER 44.A OG no hydrogen 3.063 N/A LEU 49.A N TRP 45.A O no hydrogen 2.792 N/A LYS 50.A N ILE 46.A O no hydrogen 2.928 N/A LYS 51.A N VAL 48.A O no hydrogen 2.957 N/A LYS 51.A NZ ILE 84.A O no hydrogen 3.225 N/A ARG 52.A N LEU 49.A O no hydrogen 3.056 N/A ARG 52.A NH1 GLU 19.A OE1 no hydrogen 2.691 N/A ARG 52.A NH1 GLU 19.A OE2 no hydrogen 3.542 N/A ARG 52.A NH2 GLU 19.A OE1 no hydrogen 3.505 N/A ARG 52.A NH2 GLU 19.A OE2 no hydrogen 2.749 N/A TYR 55.A N LYS 51.A O no hydrogen 2.963 N/A TYR 55.A OH GLN 39.A OE1 no hydrogen 2.829 N/A ARG 56.A N ARG 52.A O no hydrogen 2.902 N/A ARG 56.A NE GLU 32.A OE2 no hydrogen 2.749 N/A ARG 56.A NH1 GLU 53.A OE2 no hydrogen 2.508 N/A ARG 56.A NH2 GLU 32.A OE2 no hydrogen 3.162 N/A ALA 57.A N GLU 53.A O no hydrogen 2.937 N/A CYS 58.A N ASN 54.A O no hydrogen 2.971 N/A CYS 58.A SG.A ASN 54.A O no hydrogen 3.523 N/A CYS 58.A SG.B ASN 54.A O no hydrogen 3.100 N/A CYS 58.A SG.B ASN 81.A OD1 no hydrogen 3.393 N/A PHE 59.A N TYR 55.A O no hydrogen 2.905 N/A GLN 61.A N ARG 56.A O no hydrogen 2.732 N/A PHE 62.A N PHE 59.A O no hydrogen 2.848 N/A ASP 63.A N HIS 60.A O no hydrogen 3.015 N/A ILE 65.A N ASP 63.A OD1 no hydrogen 3.052 N/A ARG 66.A NE ASP 63.A OD2 no hydrogen 2.981 N/A ILE 67.A N ASP 63.A O no hydrogen 3.157 N/A ALA 68.A N PRO 64.A O no hydrogen 2.860 N/A ALA 69.A N ARG 66.A O no hydrogen 3.325 N/A MET 70.A N ILE 67.A O no hydrogen 2.961 N/A GLN 71.A N ASP 74.A OD1 no hydrogen 2.780 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.754 N/A VAL 75.A N GLN 71.A O no hydrogen 3.080 N/A GLU 76.A N GLU 72.A O no hydrogen 2.912 N/A ARG 77.A N GLU 73.A O no hydrogen 3.104 N/A LEU 78.A N ASP 74.A O no hydrogen 2.888 N/A LEU 79.A N VAL 75.A O no hydrogen 2.871 N/A GLN 80.A N ARG 77.A O no hydrogen 2.954 N/A ASN 81.A N LEU 78.A O no hydrogen 2.982 N/A ILE 84.A N ASN 81.A O no hydrogen 3.371 N/A ILE 85.A N TYR 55.A OH no hydrogen 3.182 N/A ARG 86.A NE.B LEU 79.A O no hydrogen 2.320 N/A ARG 86.A NH2.B LEU 79.A O no hydrogen 2.977 N/A ARG 88.A NH1 GLU 72.A OE1 no hydrogen 2.883 N/A ARG 88.A NH1 GLU 72.A OE2 no hydrogen 3.504 N/A ARG 88.A NH2 GLU 72.A OE2 no hydrogen 2.953 N/A LYS 90.A N HIS 87.A ND1 no hydrogen 3.015 N/A LYS 90.A NZ GLN 39.A O no hydrogen 2.800 N/A LYS 90.A NZ ALA 41.A O no hydrogen 2.775 N/A ILE 91.A N HIS 87.A O no hydrogen 2.976 N/A GLN 92.A N ARG 88.A O no hydrogen 2.917 N/A ALA 93.A N GLY 89.A O no hydrogen 2.873 N/A ILE 94.A N ILE 91.A O no hydrogen 3.207 N/A ILE 95.A N ILE 91.A O no hydrogen 3.504 N/A SER 96.A N GLN 92.A O no hydrogen 2.893 N/A SER 96.A OG GLN 92.A O no hydrogen 3.225 N/A ASN 97.A N ALA 93.A O no hydrogen 2.787 N/A ASN 97.A ND2 LYS 154.A O no hydrogen 3.494 N/A ALA 98.A N ILE 94.A O no hydrogen 2.945 N/A ARG 99.A N ILE 95.A O no hydrogen 3.160 N/A ARG 99.A NE ALA 68.A O no hydrogen 2.942 N/A ARG 99.A NH2 ALA 68.A O no hydrogen 3.179 N/A ALA 100.A N SER 96.A O no hydrogen 2.850 N/A TRP 101.A N ASN 97.A O no hydrogen 2.942 N/A LEU 102.A N ALA 98.A O no hydrogen 2.896 N/A ALA 103.A N ARG 99.A O no hydrogen 3.016 N/A MET 104.A N ALA 100.A O no hydrogen 3.187 N/A GLU 105.A N TRP 101.A O no hydrogen 2.889 N/A GLN 106.A N LEU 102.A O no hydrogen 2.752 N/A ASN 107.A N MET 104.A O no hydrogen 3.063 N/A GLY 108.A N GLU 105.A O no hydrogen 3.088 N/A GLU 109.A N MET 104.A O no hydrogen 2.927 N/A SER 110.A OG SER 27.A OG.A no hydrogen 3.257 N/A PHE 111.A N GLU 105.A OE2 no hydrogen 2.814 N/A ALA 112.A N SER 27.A OG.A no hydrogen 3.112 N/A ASP 113.A N SER 110.A OG no hydrogen 3.093 N/A PHE 114.A N SER 110.A O no hydrogen 3.021 N/A VAL 115.A N PHE 111.A O no hydrogen 2.940 N/A TRP 116.A N ALA 112.A O no hydrogen 3.039 N/A TRP 116.A NE1 GLU 24.A O no hydrogen 2.867 N/A SER 117.A N ASP 113.A O no hydrogen 2.996 N/A SER 117.A N PHE 114.A O no hydrogen 3.180 N/A SER 117.A OG PHE 114.A O no hydrogen 2.674 N/A PHE 118.A N VAL 115.A O no hydrogen 3.139 N/A VAL 119.A N TRP 116.A O no hydrogen 3.123 N/A ASP 120.A N SER 117.A O no hydrogen 3.210 N/A GLY 121.A N TRP 116.A O no hydrogen 2.988 N/A GLN 122.A N VAL 119.A O no hydrogen 3.178 N/A GLN 124.A N LEU 170.A O no hydrogen 3.218 N/A THR 126.A N ASN 172.A O no hydrogen 2.916 N/A ALA 128.A N THR 126.A OG1 no hydrogen 2.965 N/A LYS 133.A N SER 130.A O no hydrogen 2.985 N/A ILE 134.A N LEU 131.A O no hydrogen 2.970 N/A THR 138.A N SER 141.A OG no hydrogen 2.910 N/A SER 141.A N THR 138.A OG1 no hydrogen 3.033 N/A SER 141.A OG THR 138.A O no hydrogen 3.158 N/A SER 141.A OG THR 158.A O no hydrogen 3.206 N/A SER 141.A OG THR 158.A OG1 no hydrogen 2.744 N/A ASP 142.A N THR 138.A O no hydrogen 2.826 N/A ALA 143.A N PRO 139.A O no hydrogen 2.888 N/A LEU 144.A N ALA 140.A O no hydrogen 2.897 N/A ALA 145.A N SER 141.A O no hydrogen 2.848 N/A LYS 146.A N ASP 142.A O no hydrogen 2.973 N/A ALA 147.A N ALA 143.A O no hydrogen 3.004 N/A LEU 148.A N LEU 144.A O no hydrogen 2.830 N/A LYS 149.A N ALA 145.A O no hydrogen 2.968 N/A LYS 150.A N LYS 146.A O no hydrogen 3.002 N/A ARG 151.A N ALA 147.A O no hydrogen 2.983 N/A ARG 151.A NH1 GLU 109.A OE2 no hydrogen 2.861 N/A ARG 151.A NH2 GLU 109.A OE2 no hydrogen 3.319 N/A GLY 152.A N LYS 149.A O no hydrogen 3.066 N/A PHE 153.A N LEU 148.A O no hydrogen 2.912 N/A THR 158.A OG1 SER 141.A OG no hydrogen 2.744 N/A THR 158.A OG1 ASP 142.A OD1 no hydrogen 2.608 N/A CYS 161.A N GLY 157.A O no hydrogen 2.900 N/A CYS 161.A SG VAL 156.A O no hydrogen 3.295 N/A CYS 161.A SG GLY 157.A O no hydrogen 3.463 N/A TYR 162.A N THR 158.A O no hydrogen 2.915 N/A TYR 162.A OH ASP 173.A OD2 no hydrogen 2.590 N/A SER 163.A N THR 159.A O no hydrogen 2.938 N/A SER 163.A OG THR 159.A O no hydrogen 3.047 N/A PHE 164.A N ILE 160.A O no hydrogen 2.944 N/A MET 165.A N CYS 161.A O no hydrogen 2.795 N/A GLN 166.A N TYR 162.A O no hydrogen 2.946 N/A GLN 166.A NE2 ASP 173.A OD2 no hydrogen 2.796 N/A ALA 167.A N SER 163.A O no hydrogen 2.880 N/A CYS 168.A N PHE 164.A O no hydrogen 2.940 N/A GLY 169.A N GLN 166.A O no hydrogen 3.246 N/A VAL 171.A N MET 165.A O no hydrogen 3.198 N/A ASN 172.A N GLN 124.A O no hydrogen 2.778 N/A HIS 174.A N ASN 172.A OD1 no hydrogen 3.230 N/A HIS 174.A NE2 TRP 20.A O no hydrogen 3.031 N/A THR 176.A N ALA 128.A O no hydrogen 3.078 N/A CYS 178.A N ILE 175.A O no hydrogen 2.910 N/A CYS 178.A SG GLN 1.A O no hydrogen 4.046 N/A CYS 178.A SG HIS 16.A NE2 no hydrogen 3.430 N/A CYS 178.A SG HIS 174.A ND1 no hydrogen 3.587 N/A PHE 179.A N GLN 1.A O no hydrogen 2.932 N/A CYS 180.A SG ASP 17.A O no hydrogen 3.996 N/A HIS 181.A N CYS 178.A O no hydrogen 2.879 N/A HIS 181.A ND1 PRO 182.A O no hydrogen 3.158 N/A HIS 181.A NE2 THR 126.A O no hydrogen 3.009 N/A