Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pwk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG LEU 3.A O no hydrogen 3.921 N/A MET 4.A N TYR 96.A O no hydrogen 2.941 N/A VAL 5.A N LEU 46.A O no hydrogen 3.173 N/A LYS 6.A N ILE 98.A O no hydrogen 2.891 N/A LYS 6.A NZ GLU 45.A OE2 no hydrogen 3.412 N/A VAL 7.A N GLY 44.A O no hydrogen 2.843 N/A LEU 8.A N ALA 100.A O no hydrogen 2.894 N/A ASP 9.A N SER 14.A O no hydrogen 2.763 N/A ALA 10.A N LEU 102.A O no hydrogen 2.924 N/A VAL 11.A N ASP 9.A OD1 no hydrogen 2.736 N/A ARG 12.A N ASP 9.A OD1 no hydrogen 2.825 N/A ARG 12.A NE ASP 9.A OD2 no hydrogen 3.471 N/A GLY 13.A N ASP 9.A O no hydrogen 3.043 N/A SER 14.A N ASP 9.A O no hydrogen 3.303 N/A SER 14.A OG PRO 15.A O no hydrogen 2.940 N/A ALA 16.A N VAL 7.A O no hydrogen 2.928 N/A ASN 18.A N THR 40.A O no hydrogen 2.951 N/A VAL 19.A N THR 40.A OG1 no hydrogen 2.917 N/A MET 21.A N GLY 38.A O no hydrogen 2.951 N/A HIS 22.A N GLU 63.A O no hydrogen 2.967 N/A VAL 23.A N ALA 36.A O no hydrogen 2.648 N/A PHE 24.A N LYS 61.A O no hydrogen 2.795 N/A ARG 25.A N GLU 33.A O no hydrogen 2.861 N/A ARG 25.A NH2 GLU 57.A O no hydrogen 2.712 N/A LYS 26.A N ILE 59.A O no hydrogen 2.870 N/A LYS 26.A NZ ASP 30.A OD1 no hydrogen 3.456 N/A ALA 27.A N THR 31.A O no hydrogen 2.836 N/A ASP 29.A N ASP 29.A OD1 no hydrogen 2.577 N/A ASP 30.A N ALA 27.A O no hydrogen 2.800 N/A THR 31.A OG1 ASP 29.A OD2 no hydrogen 3.522 N/A GLU 33.A N ARG 25.A O no hydrogen 2.862 N/A PHE 35.A N VAL 23.A O no hydrogen 2.755 N/A ALA 36.A N VAL 23.A O no hydrogen 3.172 N/A GLY 38.A N MET 21.A O no hydrogen 3.111 N/A THR 40.A N VAL 19.A O no hydrogen 2.998 N/A THR 40.A OG1 ALA 16.A O no hydrogen 2.669 N/A SER 41.A N GLU 45.A O no hydrogen 2.804 N/A SER 41.A OG SER 43.A OG no hydrogen 3.018 N/A SER 41.A OG GLU 45.A O no hydrogen 3.220 N/A SER 43.A N SER 41.A OG no hydrogen 3.152 N/A SER 43.A OG SER 41.A OG no hydrogen 3.018 N/A GLY 44.A N SER 41.A O no hydrogen 2.866 N/A LEU 46.A N VAL 5.A O no hydrogen 2.804 N/A HIS 47.A NE2 GLU 45.A OE1 no hydrogen 2.710 N/A THR 50.A OG1 THR 51.A O no hydrogen 3.469 N/A THR 50.A OG1 GLU 54.A OE1 no hydrogen 2.675 N/A THR 51.A N THR 50.A OG1 no hydrogen 2.669 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.099 N/A PHE 55.A N THR 51.A O no hydrogen 2.878 N/A VAL 56.A N GLU 54.A O no hydrogen 2.961 N/A GLY 58.A N ALA 88.A O no hydrogen 3.260 N/A TYR 60.A N PHE 86.A O no hydrogen 2.802 N/A TYR 60.A OH VAL 56.A O no hydrogen 2.710 N/A LYS 61.A N PHE 24.A O no hydrogen 2.835 N/A LYS 61.A NZ GLU 63.A OE1 no hydrogen 3.416 N/A VAL 62.A N VAL 84.A O no hydrogen 2.797 N/A GLU 63.A N HIS 22.A O no hydrogen 2.799 N/A ILE 64.A N ALA 82.A O no hydrogen 2.684 N/A ASP 65.A N ALA 20.A O no hydrogen 2.788 N/A THR 66.A N ILE 64.A O no hydrogen 2.863 N/A LYS 67.A NZ GLU 80.A OE1 no hydrogen 3.307 N/A LYS 67.A NZ GLU 80.A OE2 no hydrogen 2.789 N/A SER 68.A N ASP 65.A OD1 no hydrogen 3.096 N/A SER 68.A OG ASP 65.A OD1 no hydrogen 3.237 N/A SER 68.A OG ASP 65.A OD2 no hydrogen 2.537 N/A TYR 69.A OH ASP 9.A OD2 no hydrogen 2.592 N/A TRP 70.A N THR 66.A O no hydrogen 3.069 N/A LYS 71.A N LYS 67.A O no hydrogen 2.880 N/A LYS 71.A NZ SER 76.A OG no hydrogen 2.901 N/A ALA 72.A N SER 68.A O no hydrogen 2.979 N/A LEU 73.A N TRP 70.A O no hydrogen 2.906 N/A GLY 74.A N LYS 71.A O no hydrogen 2.956 N/A ILE 75.A N TRP 70.A O no hydrogen 2.966 N/A PHE 78.A N PRO 104.A O no hydrogen 2.874 N/A HIS 81.A NE2 GLU 83.A OE2 no hydrogen 2.614 N/A ALA 82.A N ILE 64.A O no hydrogen 2.978 N/A VAL 84.A N VAL 62.A O no hydrogen 2.856 N/A PHE 86.A N TYR 60.A O no hydrogen 2.922 N/A ALA 88.A N GLY 58.A O no hydrogen 2.905 N/A ASN 89.A N TYR 96.A OH no hydrogen 2.823 N/A ASN 89.A ND2 VAL 56.A O no hydrogen 3.537 N/A GLY 92.A N ASN 89.A O no hydrogen 3.099 N/A ARG 94.A N ASN 89.A OD1 no hydrogen 2.960 N/A ARG 94.A NH1 SER 91.A O no hydrogen 3.363 N/A ARG 94.A NH1 PRO 93.A O no hydrogen 3.135 N/A ARG 94.A NH2 SER 91.A O no hydrogen 3.428 N/A ARG 95.A N THR 114.A O no hydrogen 2.825 N/A ARG 95.A NE CYS 1.A O no hydrogen 3.426 N/A TYR 96.A N PRO 2.A O no hydrogen 2.747 N/A THR 97.A N VAL 112.A O no hydrogen 2.857 N/A ILE 98.A N MET 4.A O no hydrogen 2.790 N/A ALA 99.A N THR 110.A O no hydrogen 2.881 N/A ALA 100.A N LYS 6.A O no hydrogen 2.840 N/A LEU 101.A N SER 108.A O no hydrogen 2.876 N/A LEU 102.A N LEU 8.A O no hydrogen 2.875 N/A SER 103.A N SER 106.A O no hydrogen 2.876 N/A SER 106.A N SER 103.A O no hydrogen 3.280 N/A SER 108.A N LEU 101.A O no hydrogen 3.037 N/A THR 109.A OG1 ALA 99.A O no hydrogen 3.153 N/A THR 110.A N ALA 99.A O no hydrogen 2.898 N/A VAL 112.A N THR 97.A O no hydrogen 2.922 N/A THR 114.A N ARG 95.A O no hydrogen 2.963 N/A