Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p3u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG GLU 52.A OE2.A no hydrogen 3.711 N/A MET 4.A N TYR 96.A O no hydrogen 2.922 N/A VAL 5.A N LEU 46.A O no hydrogen 3.042 N/A LYS 6.A N ILE 98.A O no hydrogen 2.880 N/A LYS 6.A NZ SER 43.A O no hydrogen 3.024 N/A LYS 6.A NZ GLU 45.A OE2 no hydrogen 3.244 N/A VAL 7.A N GLY 44.A O no hydrogen 2.858 N/A LEU 8.A N ALA 100.A O no hydrogen 2.910 N/A ASP 9.A N SER 14.A O no hydrogen 2.781 N/A ALA 10.A N LEU 102.A O no hydrogen 2.864 N/A VAL 11.A N ASP 9.A OD1 no hydrogen 2.786 N/A ARG 12.A N ASP 9.A OD1 no hydrogen 2.850 N/A GLY 13.A N ASP 9.A O no hydrogen 2.953 N/A SER 14.A N ASP 9.A O no hydrogen 3.337 N/A SER 14.A OG.A PRO 15.A O no hydrogen 2.924 N/A SER 14.A OG.B ARG 12.A O no hydrogen 3.553 N/A ALA 16.A N VAL 7.A O no hydrogen 2.941 N/A ASN 18.A N THR 40.A O no hydrogen 2.953 N/A VAL 19.A N THR 40.A OG1 no hydrogen 2.949 N/A VAL 21.A N GLY 38.A O no hydrogen 2.849 N/A HIS 22.A N GLU 63.A O no hydrogen 2.872 N/A VAL 23.A N ALA 36.A O no hydrogen 2.644 N/A PHE 24.A N LYS 61.A O no hydrogen 2.746 N/A ARG 25.A N GLU 33.A O no hydrogen 2.883 N/A ARG 25.A NE GLU 57.A O no hydrogen 3.265 N/A ARG 25.A NH2 GLU 57.A O no hydrogen 2.736 N/A LYS 26.A N ILE 59.A O no hydrogen 2.841 N/A ALA 27.A N THR 31.A O no hydrogen 2.799 N/A ASP 30.A N ALA 27.A O no hydrogen 2.837 N/A THR 31.A N ASP 29.A OD1 no hydrogen 3.089 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.687 N/A GLU 33.A N ARG 25.A O no hydrogen 2.903 N/A PHE 35.A N VAL 23.A O no hydrogen 2.838 N/A ALA 36.A N VAL 23.A O no hydrogen 3.212 N/A GLY 38.A N VAL 21.A O no hydrogen 2.994 N/A THR 40.A N VAL 19.A O no hydrogen 2.899 N/A THR 40.A OG1 ALA 16.A O no hydrogen 2.717 N/A SER 41.A N GLU 45.A O no hydrogen 2.857 N/A SER 41.A OG SER 43.A OG no hydrogen 2.952 N/A SER 41.A OG GLU 45.A O no hydrogen 3.224 N/A GLU 42.A OE1.B GLU 42.A OE2.B no hydrogen 2.199 N/A GLU 42.A OE1.C GLU 42.A OE2.C no hydrogen 2.216 N/A GLU 42.A OE2.B GLU 42.A OE1.B no hydrogen 2.199 N/A GLU 42.A OE2.C GLU 42.A OE1.C no hydrogen 2.216 N/A SER 43.A N SER 41.A OG no hydrogen 3.074 N/A SER 43.A OG SER 41.A OG no hydrogen 2.952 N/A GLY 44.A N SER 41.A O no hydrogen 2.897 N/A GLU 45.A N SER 41.A OG no hydrogen 3.414 N/A LEU 46.A N VAL 5.A O no hydrogen 2.865 N/A HIS 47.A NE2 GLU 45.A OE1 no hydrogen 2.924 N/A THR 50.A OG1 THR 51.A O no hydrogen 3.391 N/A THR 50.A OG1 GLU 54.A OE1.A no hydrogen 2.798 N/A THR 51.A N THR 50.A OG1 no hydrogen 2.765 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.110 N/A PHE 55.A N THR 51.A O no hydrogen 2.986 N/A VAL 56.A N GLU 54.A O no hydrogen 2.977 N/A GLY 58.A N ALA 88.A O no hydrogen 3.311 N/A TYR 60.A N PHE 86.A O no hydrogen 2.833 N/A TYR 60.A OH VAL 56.A O no hydrogen 2.721 N/A LYS 61.A N PHE 24.A O no hydrogen 2.868 N/A LYS 61.A NZ GLU 83.A OE2.B no hydrogen 3.407 N/A VAL 62.A N VAL 84.A O no hydrogen 2.829 N/A GLU 63.A N HIS 22.A O no hydrogen 2.784 N/A ILE 64.A N ALA 82.A O no hydrogen 2.777 N/A ASP 65.A N ALA 20.A O no hydrogen 2.868 N/A THR 66.A N ILE 64.A O no hydrogen 2.839 N/A LYS 67.A N GLU 80.A O no hydrogen 3.429 N/A LYS 67.A NZ GLU 80.A OE1 no hydrogen 3.365 N/A LYS 67.A NZ GLU 80.A OE2 no hydrogen 2.814 N/A TYR 69.A N.B ASP 65.A O no hydrogen 3.073 N/A TYR 69.A OH.A ASP 9.A OD2 no hydrogen 2.518 N/A TYR 69.A OH.B ASP 9.A OD2 no hydrogen 2.675 N/A TRP 70.A N.A THR 66.A O no hydrogen 3.201 N/A TRP 70.A N.B THR 66.A O no hydrogen 2.942 N/A LYS 71.A N.A LYS 67.A O no hydrogen 3.195 N/A LYS 71.A N.B LYS 67.A O no hydrogen 2.735 N/A LYS 71.A NZ.B SER 76.A OG.A no hydrogen 2.609 N/A ALA 72.A N.A SER 68.A O.A no hydrogen 2.879 N/A ALA 72.A N.B SER 68.A O.A no hydrogen 2.310 N/A ALA 72.A N.B SER 68.A O.B no hydrogen 3.085 N/A LEU 73.A N.B TYR 69.A O.A no hydrogen 2.986 N/A LEU 73.A N.B TYR 69.A O.B no hydrogen 3.333 N/A GLY 74.A N.A LYS 71.A O.A no hydrogen 2.664 N/A GLY 74.A N.B LYS 71.A O.B no hydrogen 2.874 N/A ILE 75.A N.A TRP 70.A O.A no hydrogen 2.689 N/A ILE 75.A N.A TRP 70.A O.B no hydrogen 3.266 N/A ILE 75.A N.B TRP 70.A O.A no hydrogen 2.552 N/A ILE 75.A N.B TRP 70.A O.B no hydrogen 2.989 N/A PHE 78.A N PRO 104.A O no hydrogen 2.897 N/A ALA 82.A N ILE 64.A O no hydrogen 2.966 N/A VAL 84.A N VAL 62.A O no hydrogen 2.824 N/A PHE 86.A N TYR 60.A O no hydrogen 2.951 N/A ALA 88.A N GLY 58.A O no hydrogen 2.878 N/A ASN 89.A N TYR 96.A OH no hydrogen 2.860 N/A ASN 89.A ND2 VAL 56.A O no hydrogen 3.346 N/A ASP 90.A N ASP 90.A OD1 no hydrogen 2.627 N/A GLY 92.A N ASN 89.A O no hydrogen 3.269 N/A ARG 94.A N ASN 89.A OD1 no hydrogen 2.964 N/A ARG 94.A NH1 SER 91.A O no hydrogen 3.165 N/A ARG 94.A NH1 PRO 93.A O no hydrogen 3.035 N/A ARG 94.A NH2 SER 91.A O no hydrogen 3.395 N/A ARG 95.A N THR 114.A O no hydrogen 2.913 N/A ARG 95.A NH1 GLU 52.A OE2.A no hydrogen 2.985 N/A TYR 96.A N PRO 2.A O no hydrogen 2.883 N/A THR 97.A N VAL 112.A O no hydrogen 2.812 N/A ILE 98.A N MET 4.A O no hydrogen 2.902 N/A ALA 99.A N THR 110.A O no hydrogen 2.957 N/A ALA 100.A N LYS 6.A O no hydrogen 2.866 N/A LEU 101.A N SER 108.A O no hydrogen 2.852 N/A LEU 102.A N LEU 8.A O no hydrogen 2.849 N/A SER 103.A N SER 106.A O no hydrogen 2.862 N/A SER 106.A N SER 103.A O no hydrogen 3.326 N/A SER 108.A N LEU 101.A O no hydrogen 3.042 N/A THR 109.A OG1 ALA 99.A O no hydrogen 2.887 N/A THR 110.A N ALA 99.A O no hydrogen 2.941 N/A VAL 112.A N THR 97.A O no hydrogen 2.880 N/A THR 114.A N ARG 95.A O no hydrogen 2.883 N/A