Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1sqw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N LEU 39.A O no hydrogen 2.895 N/A ARG 2.A NH1 PRO 3.A O no hydrogen 2.739 N/A ARG 2.A NH1 GLU 8.A OE1 no hydrogen 2.972 N/A ARG 2.A NH2 GLU 8.A OE1 no hydrogen 3.516 N/A ARG 2.A NH2 GLU 8.A OE2 no hydrogen 2.863 N/A THR 5.A N GLU 8.A OE1 no hydrogen 2.619 N/A GLU 8.A N THR 5.A OG1 no hydrogen 2.974 N/A THR 9.A N THR 5.A O no hydrogen 2.847 N/A THR 9.A OG1 THR 5.A O no hydrogen 2.911 N/A ARG 10.A N GLU 6.A O no hydrogen 3.009 N/A ARG 10.A NE GLU 7.A OE1 no hydrogen 3.194 N/A ARG 10.A NE GLU 7.A OE2 no hydrogen 3.166 N/A ARG 10.A NH1 GLU 14.A OE1 no hydrogen 2.996 N/A ARG 10.A NH2 GLU 7.A OE2 no hydrogen 2.676 N/A VAL 11.A N GLU 7.A O no hydrogen 3.070 N/A MET 12.A N GLU 8.A O no hydrogen 2.952 N/A PHE 13.A N THR 9.A O no hydrogen 2.794 N/A GLU 14.A N ARG 10.A O no hydrogen 2.857 N/A LYS 15.A N VAL 11.A O no hydrogen 3.157 N/A LYS 15.A NZ PHE 79.A O no hydrogen 2.820 N/A ILE 16.A N MET 12.A O no hydrogen 2.984 N/A ALA 17.A N PHE 13.A O no hydrogen 2.855 N/A LYS 18.A N GLU 14.A O no hydrogen 3.126 N/A LYS 18.A N LYS 15.A O no hydrogen 2.874 N/A TYR 19.A N ILE 16.A O no hydrogen 2.930 N/A ILE 20.A N ILE 16.A O no hydrogen 2.950 N/A GLY 21.A N ALA 17.A O no hydrogen 2.810 N/A ASN 23.A N ILE 20.A O no hydrogen 2.938 N/A ASN 23.A ND2 TYR 92.A O no hydrogen 2.915 N/A GLN 25.A NE2 GLU 22.A O no hydrogen 3.272 N/A LEU 26.A N ASN 23.A O no hydrogen 2.837 N/A LEU 27.A N LEU 24.A O no hydrogen 2.765 N/A VAL 28.A N LEU 24.A O no hydrogen 3.322 N/A VAL 28.A N GLN 25.A O no hydrogen 3.190 N/A ASP 29.A N GLN 25.A O no hydrogen 2.897 N/A ARG 30.A N GLY 33.A O no hydrogen 3.213 N/A ARG 30.A NH1 LEU 26.A O no hydrogen 2.941 N/A ARG 30.A NH1 TYR 92.A OH no hydrogen 2.873 N/A GLY 33.A N ARG 30.A O no hydrogen 3.191 N/A TYR 35.A N VAL 28.A O no hydrogen 2.808 N/A TYR 35.A OH ASP 32.A OD2 no hydrogen 2.537 N/A CYS 36.A N VAL 47.A O no hydrogen 2.716 N/A CYS 36.A SG VAL 47.A O no hydrogen 3.530 N/A ARG 38.A N TYR 45.A O no hydrogen 3.034 N/A ARG 38.A NH1 PHE 37.A O no hydrogen 2.776 N/A LEU 39.A N ARG 2.A O no hydrogen 2.653 N/A HIS 40.A N ARG 43.A O no hydrogen 2.905 N/A ARG 43.A N HIS 40.A O no hydrogen 3.034 N/A VAL 44.A N GLY 71.A O no hydrogen 2.826 N/A TYR 45.A N ARG 38.A O no hydrogen 2.820 N/A TYR 46.A N THR 68.A O no hydrogen 2.746 N/A TYR 46.A OH LEU 27.A O no hydrogen 2.514 N/A VAL 47.A N CYS 36.A O no hydrogen 2.980 N/A GLU 49.A N THR 34.A O no hydrogen 2.934 N/A LYS 50.A NZ ASP 32.A O no hydrogen 2.856 N/A ILE 51.A N SER 48.A OG no hydrogen 3.200 N/A MET 52.A N SER 48.A O no hydrogen 3.347 N/A LYS 53.A N GLU 49.A O no hydrogen 3.025 N/A LEU 54.A N ILE 51.A O no hydrogen 3.361 N/A ALA 55.A N MET 52.A O no hydrogen 2.921 N/A ASN 57.A N LEU 54.A O no hydrogen 3.330 N/A LYS 62.A N SER 59.A O no hydrogen 3.226 N/A LYS 62.A N SER 59.A OG no hydrogen 3.165 N/A LEU 63.A N SER 59.A O no hydrogen 2.912 N/A VAL 64.A N GLY 60.A O no hydrogen 2.719 N/A SER 65.A N ASP 61.A O no hydrogen 3.350 N/A SER 65.A OG LYS 62.A O no hydrogen 2.522 N/A LEU 66.A N LYS 62.A O no hydrogen 3.201 N/A LEU 66.A N LEU 63.A O no hydrogen 2.897 N/A GLY 67.A N VAL 64.A O no hydrogen 3.212 N/A THR 68.A N TYR 46.A O no hydrogen 2.919 N/A THR 68.A OG1 TYR 88.A OH no hydrogen 3.308 N/A CYS 69.A SG VAL 44.A O no hydrogen 3.782 N/A CYS 69.A SG GLY 71.A O no hydrogen 3.599 N/A CYS 69.A SG HIS 82.A ND1 no hydrogen 3.635 N/A PHE 70.A N VAL 44.A O no hydrogen 2.917 N/A LYS 72.A N ARG 80.A O no hydrogen 2.967 N/A PHE 73.A N ASP 42.A O no hydrogen 3.013 N/A THR 74.A N LYS 78.A O no hydrogen 2.979 N/A THR 74.A OG1 THR 76.A OG1 no hydrogen 2.729 N/A THR 74.A OG1 LYS 78.A O no hydrogen 3.566 N/A THR 76.A OG1 THR 74.A OG1 no hydrogen 2.729 N/A HIS 77.A N THR 74.A O no hydrogen 2.668 N/A LYS 78.A N THR 74.A OG1 no hydrogen 3.097 N/A ARG 80.A N LYS 72.A O no hydrogen 2.730 N/A HIS 82.A N PHE 70.A O no hydrogen 2.795 N/A THR 84.A OG1 CYS 69.A O no hydrogen 2.706 N/A ALA 85.A N HIS 82.A O no hydrogen 2.950 N/A LEU 86.A N VAL 83.A O no hydrogen 2.981 N/A TYR 88.A N ALA 85.A O no hydrogen 3.126 N/A TYR 88.A OH THR 68.A OG1 no hydrogen 3.308 N/A LEU 89.A N ALA 85.A O no hydrogen 3.129 N/A ALA 90.A N LEU 86.A O no hydrogen 2.935 N/A TYR 92.A N LEU 89.A O no hydrogen 2.767 N/A ALA 93.A N ALA 90.A O no hydrogen 3.256 N/A LYS 94.A NZ TYR 95.A OH no hydrogen 3.553 N/A LYS 96.A N THR 122.A OG1 no hydrogen 2.868 N/A LYS 96.A NZ ALA 93.A O no hydrogen 2.749 N/A LYS 96.A NZ TYR 134.A OH no hydrogen 2.919 N/A VAL 97.A N VAL 132.A O no hydrogen 3.063 N/A TRP 98.A N ARG 120.A O no hydrogen 2.662 N/A TRP 98.A NE1 ASP 138.A OD2 no hydrogen 2.785 N/A ILE 99.A N TYR 134.A O no hydrogen 2.784 N/A LYS 100.A N GLY 117.A O no hydrogen 2.695 N/A GLU 104.A N LYS 100.A O no hydrogen 2.774 N/A GLN 105.A N PRO 101.A O no hydrogen 3.011 N/A SER 106.A N GLY 102.A O no hydrogen 3.178 N/A PHE 107.A N ALA 103.A O no hydrogen 2.832 N/A LEU 108.A N GLU 104.A O no hydrogen 3.082 N/A TYR 109.A N SER 106.A O no hydrogen 2.934 N/A GLY 110.A N PHE 107.A O no hydrogen 2.782 N/A ASN 111.A N SER 106.A O no hydrogen 2.837 N/A ASN 111.A ND2 SER 106.A O no hydrogen 3.620 N/A ASN 111.A ND2 SER 106.A OG no hydrogen 3.281 N/A VAL 113.A N VAL 163.A O no hydrogen 2.940 N/A LYS 115.A N ALA 160.A O no hydrogen 2.806 N/A LYS 115.A NZ CYS 153.A O no hydrogen 2.997 N/A SER 116.A N PRO 158.A O no hydrogen 2.998 N/A GLY 117.A N LEU 114.A O no hydrogen 2.803 N/A LEU 118.A N LYS 115.A O no hydrogen 2.986 N/A GLY 119.A N TRP 98.A O no hydrogen 2.697 N/A ARG 120.A N TRP 98.A O no hydrogen 3.111 N/A THR 122.A N LYS 96.A O no hydrogen 2.944 N/A THR 122.A OG1 LYS 94.A O no hydrogen 3.412 N/A THR 122.A OG1 LYS 96.A O no hydrogen 3.194 N/A THR 125.A N THR 150.A OG1 no hydrogen 2.942 N/A THR 125.A OG1 THR 122.A O no hydrogen 2.731 N/A GLN 127.A NE2 ALA 147.A O no hydrogen 2.838 N/A TYR 128.A N ALA 146.A O no hydrogen 2.635 N/A GLN 129.A N SER 126.A O no hydrogen 3.154 N/A GLN 129.A NE2 GLY 130.A O no hydrogen 3.081 N/A VAL 131.A N GLY 144.A O no hydrogen 2.790 N/A VAL 132.A N TYR 95.A O no hydrogen 3.251 N/A VAL 133.A N GLY 142.A O no hydrogen 2.860 N/A TYR 134.A N VAL 97.A O no hydrogen 2.746 N/A SER 135.A N ILE 139.A O no hydrogen 2.979 N/A ALA 137.A N SER 135.A OG no hydrogen 2.976 N/A ASP 138.A N SER 135.A O no hydrogen 2.938 N/A ILE 139.A N SER 135.A OG no hydrogen 3.261 N/A LEU 141.A N VAL 133.A O no hydrogen 2.771 N/A PHE 143.A N ALA 167.A O no hydrogen 2.829 N/A GLY 144.A N VAL 131.A O no hydrogen 2.957 N/A VAL 145.A N PHE 164.A O no hydrogen 2.859 N/A ALA 146.A N GLN 129.A O no hydrogen 2.948 N/A ALA 147.A N VAL 162.A O no hydrogen 2.660 N/A THR 150.A N THR 125.A O no hydrogen 3.019 N/A THR 150.A OG1 THR 122.A O no hydrogen 2.720 N/A ASP 152.A N SER 149.A OG no hydrogen 3.191 N/A CYS 153.A N SER 149.A O no hydrogen 2.824 N/A CYS 153.A SG LYS 148.A O no hydrogen 3.904 N/A CYS 153.A SG SER 149.A O no hydrogen 3.344 N/A ARG 154.A N GLN 151.A O no hydrogen 3.244 N/A LYS 155.A N ASP 152.A O no hydrogen 2.938 N/A MET 159.A N ASP 157.A OD2 no hydrogen 2.813 N/A ALA 160.A N ASP 157.A O no hydrogen 2.914 N/A VAL 162.A N VAL 113.A O no hydrogen 2.768 N/A VAL 163.A N VAL 113.A O no hydrogen 3.214 N/A PHE 164.A N VAL 145.A O no hydrogen 2.773 N/A HIS 165.A NE2 ASP 168.A OD1 no hydrogen 2.662 N/A GLN 166.A N PHE 143.A O no hydrogen 2.817 N/A ALA 167.A N PHE 143.A O no hydrogen 3.083 N/A ASP 168.A N GLU 171.A OE2 no hydrogen 3.246 N/A ILE 169.A N LEU 141.A O no hydrogen 2.842 N/A GLY 170.A N ASP 168.A OD2 no hydrogen 2.656 N/A GLU 171.A N ASP 168.A O no hydrogen 3.378 N/A GLU 171.A N ASP 168.A OD2 no hydrogen 3.106 N/A VAL 173.A N ILE 169.A O no hydrogen 2.957 N/A ARG 174.A NE GLU 171.A O no hydrogen 3.225 N/A ARG 174.A NH2 GLU 171.A O no hydrogen 3.202 N/A