Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ubl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N GLU 54.A O no hydrogen 3.060 N/A LEU 5.A N GLU 29.A O no hydrogen 2.896 N/A HIS 6.A N VAL 52.A O no hydrogen 2.809 N/A HIS 6.A NE2 GLU 54.A OE1 no hydrogen 2.853 N/A GLY 7.A N ILE 31.A O no hydrogen 2.845 N/A SER 9.A OG GLN 30.A OE1 no hydrogen 3.323 N/A SER 11.A N ALA 8.A O no hydrogen 3.188 N/A TYR 13.A OH ASP 103.A OD2 no hydrogen 2.944 N/A VAL 14.A N SER 11.A OG no hydrogen 3.052 N/A ASN 15.A N SER 11.A O no hydrogen 2.916 N/A ASN 15.A ND2 SER 9.A O no hydrogen 2.940 N/A LYS 16.A N ASN 12.A O no hydrogen 2.911 N/A LYS 16.A NZ SER 63.A OG no hydrogen 2.840 N/A LYS 16.A NZ GLU 99.A OE1 no hydrogen 3.415 N/A LYS 16.A NZ GLU 99.A OE2 no hydrogen 2.543 N/A VAL 17.A N TYR 13.A O no hydrogen 3.463 N/A LYS 18.A N VAL 14.A O no hydrogen 3.015 N/A LYS 18.A NZ SER 9.A OG no hydrogen 2.864 N/A LYS 18.A NZ GLN 30.A OE1 no hydrogen 2.527 N/A LYS 18.A NZ ASP 201.A OD2 no hydrogen 2.817 N/A LEU 19.A N ASN 15.A O no hydrogen 2.936 N/A ILE 21.A N VAL 17.A O no hydrogen 3.003 N/A LEU 22.A N LYS 18.A O no hydrogen 2.845 N/A GLU 23.A N LEU 19.A O no hydrogen 2.976 N/A LYS 24.A N GLY 20.A O no hydrogen 3.285 N/A LYS 24.A NZ ASP 71.A OD1 no hydrogen 2.713 N/A LYS 24.A NZ PHE 74.A O no hydrogen 2.730 N/A LYS 24.A NZ GLN 76.A O no hydrogen 2.875 N/A LYS 24.A NZ PRO 78.A O no hydrogen 2.916 N/A GLY 25.A N LEU 22.A O no hydrogen 2.909 N/A LEU 26.A N ILE 21.A O no hydrogen 3.149 N/A GLU 29.A N ILE 3.A O no hydrogen 3.047 N/A GLN 30.A NE2 GLY 7.A O no hydrogen 2.747 N/A GLN 30.A NE2 SER 9.A OG no hydrogen 3.003 N/A ILE 31.A N LEU 5.A O no hydrogen 2.813 N/A SER 36.A N GLY 48.A O no hydrogen 3.305 N/A GLN 37.A NE2 MET 47.A O no hydrogen 3.153 N/A GLU 38.A N SER 36.A OG no hydrogen 3.078 N/A ASP 40.A N GLU 38.A OE1 no hydrogen 2.750 N/A PHE 41.A N GLU 38.A O no hydrogen 2.758 N/A LEU 42.A N GLU 38.A O no hydrogen 3.057 N/A LYS 43.A N GLU 39.A O no hydrogen 3.111 N/A ILE 44.A N PHE 41.A O no hydrogen 2.839 N/A SER 45.A N PHE 41.A O no hydrogen 2.786 N/A SER 45.A OG LYS 49.A O no hydrogen 2.747 N/A GLY 48.A N SER 45.A O no hydrogen 2.625 N/A VAL 52.A N HIS 6.A O no hydrogen 3.087 N/A LEU 53.A N ILE 60.A O no hydrogen 2.692 N/A GLU 54.A N LYS 4.A O no hydrogen 2.812 N/A MET 55.A N LYS 58.A O no hydrogen 2.733 N/A LYS 58.A N MET 55.A O no hydrogen 2.878 N/A ILE 60.A N LEU 53.A O no hydrogen 2.760 N/A ILE 66.A N GLU 62.A O no hydrogen 2.955 N/A LEU 67.A N SER 63.A O no hydrogen 2.996 N/A GLU 68.A N GLY 64.A O no hydrogen 3.012 N/A PHE 69.A N ALA 65.A O no hydrogen 2.906 N/A LEU 70.A N ILE 66.A O no hydrogen 2.870 N/A ASP 71.A N LEU 67.A O no hydrogen 2.970 N/A THR 72.A N GLU 68.A O no hydrogen 3.084 N/A THR 72.A OG1 GLU 68.A O no hydrogen 2.775 N/A ILE 73.A N PHE 69.A O no hydrogen 2.934 N/A PHE 74.A N LEU 70.A O no hydrogen 2.708 N/A GLN 76.A N GLN 76.A OE1 no hydrogen 2.877 N/A LYS 79.A NZ.A ASP 71.A O no hydrogen 3.053 N/A LYS 79.A NZ.A ASP 71.A OD2 no hydrogen 3.144 N/A LYS 79.A NZ.B GLU 83.A OE1 no hydrogen 3.241 N/A LEU 80.A N ASP 71.A OD1 no hydrogen 2.811 N/A ILE 81.A N ASP 71.A OD2 no hydrogen 2.979 N/A GLU 87.A N ASP 84.A OD1 no hydrogen 3.028 N/A ALA 88.A N ASP 84.A O no hydrogen 2.943 N/A ALA 89.A N PRO 85.A O no hydrogen 3.004 N/A ARG 90.A N TRP 86.A O no hydrogen 3.102 N/A ARG 90.A NH1 VAL 136.A O no hydrogen 2.479 N/A VAL 91.A N GLU 87.A O no hydrogen 2.925 N/A ARG 92.A N ALA 88.A O no hydrogen 2.830 N/A ARG 92.A NE GLU 68.A OE2 no hydrogen 2.999 N/A ARG 92.A NH2 GLU 68.A OE1 no hydrogen 3.092 N/A ARG 92.A NH2 GLU 68.A OE2 no hydrogen 3.482 N/A GLU 93.A N ALA 89.A O no hydrogen 2.742 N/A ILE 94.A N ARG 90.A O no hydrogen 2.944 N/A SER 95.A N VAL 91.A O no hydrogen 3.229 N/A SER 95.A OG SER 154.A OG no hydrogen 2.584 N/A THR 96.A N ARG 92.A O no hydrogen 3.013 N/A THR 96.A OG1 ARG 92.A O no hydrogen 2.906 N/A ILE 97.A N GLU 93.A O no hydrogen 2.858 N/A ILE 98.A N ILE 94.A O no hydrogen 3.007 N/A GLU 99.A N SER 95.A O no hydrogen 3.017 N/A THR 100.A N THR 96.A O no hydrogen 2.696 N/A TYR 101.A N ILE 97.A O no hydrogen 2.927 N/A ASP 103.A N ILE 98.A O no hydrogen 3.016 N/A ILE 104.A N GLU 99.A O no hydrogen 3.202 N/A ALA 106.A N LEU 102.A O no hydrogen 3.113 N/A ARG 107.A N ASP 103.A O no hydrogen 2.922 N/A ARG 107.A NH2 ASP 103.A OD2 no hydrogen 3.292 N/A ARG 108.A N PRO 105.A O no hydrogen 2.849 N/A ARG 108.A NH1 GLU 121.A OE1 no hydrogen 3.521 N/A ARG 108.A NH2 GLU 121.A OE1 no hydrogen 3.255 N/A ILE 109.A N ALA 106.A O no hydrogen 2.901 N/A TYR 110.A N ALA 106.A O no hydrogen 3.017 N/A TYR 110.A OH ASP 103.A OD1 no hydrogen 2.763 N/A LEU 111.A N ARG 107.A O no hydrogen 3.374 N/A VAL 119.A N SER 115.A O no hydrogen 2.792 N/A GLU 120.A N PRO 116.A O no hydrogen 2.615 N/A GLU 121.A N GLU 117.A O no hydrogen 2.627 N/A VAL 122.A N ILE 118.A O no hydrogen 3.145 N/A HIS 123.A N VAL 119.A O no hydrogen 3.059 N/A HIS 123.A NE2 ASN 173.A O no hydrogen 2.542 N/A SER 124.A N GLU 120.A O no hydrogen 3.213 N/A SER 124.A OG GLU 121.A O no hydrogen 2.608 N/A THR 125.A N GLU 121.A O no hydrogen 3.038 N/A THR 125.A OG1 GLU 121.A O no hydrogen 3.312 N/A LEU 126.A N VAL 122.A O no hydrogen 2.918 N/A VAL 127.A N HIS 123.A O no hydrogen 3.114 N/A LYS 128.A N SER 124.A O no hydrogen 3.077 N/A GLY 129.A N THR 125.A O no hydrogen 2.954 N/A ILE 130.A N LEU 126.A O no hydrogen 2.768 N/A LYS 131.A N VAL 127.A O no hydrogen 3.188 N/A ALA 132.A N LYS 128.A O no hydrogen 3.067 N/A LEU 133.A N GLY 129.A O no hydrogen 2.763 N/A GLN 134.A N ILE 130.A O no hydrogen 2.854 N/A GLN 134.A NE2 GLN 134.A O no hydrogen 3.610 N/A ARG 135.A N ALA 132.A O no hydrogen 2.821 N/A VAL 136.A N LEU 133.A O no hydrogen 2.931 N/A VAL 137.A N LEU 133.A O no hydrogen 3.245 N/A ARG 138.A N ILE 143.A O no hydrogen 2.811 N/A ARG 138.A NH1 GLU 87.A OE1 no hydrogen 2.857 N/A ARG 138.A NH1 ALA 144.A O no hydrogen 2.862 N/A ARG 138.A NH2 GLU 87.A OE2 no hydrogen 3.145 N/A PHE 139.A N ILE 143.A O no hydrogen 3.288 N/A SER 140.A N TYR 142.A O no hydrogen 2.988 N/A ILE 143.A N ASP 152.A OD1 no hydrogen 2.954 N/A GLY 145.A N TYR 142.A O no hydrogen 3.191 N/A THR 149.A N ASP 152.A OD2 no hydrogen 2.855 N/A LEU 150.A N LEU 80.A O no hydrogen 2.904 N/A ALA 151.A N THR 149.A OG1 no hydrogen 3.088 N/A ASP 152.A N THR 149.A O no hydrogen 2.911 N/A CYS 153.A SG THR 149.A O no hydrogen 3.931 N/A SER 154.A N LEU 150.A O no hydrogen 3.099 N/A SER 154.A OG SER 95.A OG no hydrogen 2.584 N/A GLY 155.A N ALA 151.A O no hydrogen 2.692 N/A PHE 156.A N ASP 152.A O no hydrogen 2.898 N/A ALA 157.A N CYS 153.A O no hydrogen 3.263 N/A HIS 158.A N SER 154.A O no hydrogen 2.882 N/A HIS 158.A ND1 ASN 12.A OD1 no hydrogen 2.782 N/A HIS 158.A NE2 GLU 99.A OE2 no hydrogen 2.934 N/A LEU 159.A N GLY 155.A O no hydrogen 2.866 N/A SER 160.A N PHE 156.A O no hydrogen 3.366 N/A SER 160.A OG PHE 156.A O no hydrogen 2.722 N/A SER 160.A OG ALA 157.A O no hydrogen 3.340 N/A LEU 162.A N HIS 158.A O no hydrogen 2.805 N/A ASP 163.A N LEU 159.A O no hydrogen 2.785 N/A GLU 164.A N SER 160.A O no hydrogen 3.125 N/A GLU 165.A N VAL 161.A O no hydrogen 2.951 N/A LEU 166.A N LEU 162.A O no hydrogen 3.100 N/A ARG 167.A NH1 ASP 163.A OD1 no hydrogen 3.334 N/A ARG 167.A NH2 ASP 177.A OD1 no hydrogen 3.128 N/A TYR 170.A N LEU 166.A O no hydrogen 2.693 N/A TYR 170.A OH VAL 119.A O no hydrogen 2.847 N/A ASN 173.A N TYR 170.A O no hydrogen 3.078 N/A ASP 177.A N HIS 174.A O no hydrogen 3.143 N/A LEU 178.A N PRO 175.A O no hydrogen 2.863 N/A LEU 179.A N LEU 176.A O no hydrogen 2.491 N/A ASN 180.A N GLN 134.A OE1 no hydrogen 2.917 N/A TRP 182.A N LEU 179.A O no hydrogen 3.157 N/A TRP 182.A NE1 ASP 163.A OD2 no hydrogen 3.352 N/A LYS 183.A NZ ASP 177.A OD1 no hydrogen 2.891 N/A TYR 185.A N GLY 181.A O no hydrogen 2.954 N/A TYR 185.A OH ASP 152.A OD1 no hydrogen 2.723 N/A PHE 186.A N TRP 182.A O no hydrogen 2.885 N/A VAL 187.A N LYS 183.A O no hydrogen 3.033 N/A PHE 188.A N GLU 184.A O no hydrogen 2.795 N/A MET 189.A N TYR 185.A O no hydrogen 2.774 N/A LYS 190.A N PHE 186.A O no hydrogen 3.134 N/A LYS 190.A N VAL 187.A O no hydrogen 3.173 N/A THR 191.A N PHE 188.A O no hydrogen 2.892 N/A THR 191.A OG1 PHE 188.A O no hydrogen 2.711 N/A LYS 192.A N MET 189.A O no hydrogen 3.062 N/A LYS 192.A NZ GLU 23.A OE2 no hydrogen 2.703 N/A LYS 192.A NZ TYR 142.A OH no hydrogen 2.876 N/A ALA 196.A N LYS 192.A O no hydrogen 2.951 N/A LEU 197.A N ALA 193.A O no hydrogen 2.923 N/A VAL 198.A N GLY 194.A O no hydrogen 2.922 N/A GLU 199.A N PRO 195.A O no hydrogen 3.060 N/A LYS 200.A N ALA 196.A O no hydrogen 2.933 N/A LYS 200.A NZ GLN 203.A OE1 no hydrogen 2.839 N/A ASP 201.A N LEU 197.A O no hydrogen 2.947 N/A LYS 202.A N VAL 198.A O no hydrogen 3.195 N/A LYS 202.A NZ GLU 199.A OE2 no hydrogen 2.883 N/A GLN 203.A N GLU 199.A O no hydrogen 2.885 N/A ILE 204.A N LYS 200.A O no hydrogen 2.816 N/A LEU 205.A N ASP 201.A O no hydrogen 3.283 N/A LYS 206.A N LYS 202.A O no hydrogen 2.873 N/A LYS 206.A NZ GLU 164.A OE2 no hydrogen 3.271 N/A LYS 207.A N GLN 203.A O no hydrogen 2.999 N/A ILE 208.A N ILE 204.A O no hydrogen 3.200 N/A LEU 209.A N LEU 205.A O no hydrogen 2.822 N/A ALA 210.A N LYS 206.A O no hydrogen 2.972 N/A ARG 211.A N ILE 208.A O no hydrogen 3.230 N/A ALA 212.A N LEU 209.A O no hydrogen 2.756 N/A