Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bui_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 6.A N PRO 120.A O no hydrogen 3.163 N/A VAL 18.A N GLY 142.A O no hydrogen 3.376 N/A CYS 22.A N GLU 155.A O no hydrogen 2.934 N/A CYS 22.A SG VAL 23.A O no hydrogen 3.772 N/A ALA 24.A N LEU 153.A O no hydrogen 2.623 N/A SER 28.A N HIS 25.A O no hydrogen 2.853 N/A SER 28.A OG HIS 25.A O no hydrogen 2.934 N/A TRP 29.A NE1 GLU 155.A OE1 no hydrogen 2.714 N/A GLN 32.A N TRP 29.A O no hydrogen 3.195 N/A VAL 33.A N GLY 46.A O no hydrogen 2.968 N/A SER 34.A OG HIS 42.A ND1 no hydrogen 2.462 N/A LEU 35.A N CYS 44.A O no hydrogen 3.042 N/A ARG 36.A N LYS 71.A O no hydrogen 2.820 N/A ARG 36.A NE SER 34.A OG no hydrogen 3.119 N/A ARG 36.A NH2 GLU 79.A O no hydrogen 2.627 N/A THR 37.A OG1 ARG 38.A O no hydrogen 3.242 N/A THR 37.A OG1 SER 69.A O no hydrogen 3.389 N/A ARG 38.A N SER 69.A O no hydrogen 3.457 N/A HIS 42.A ND1 SER 34.A OG no hydrogen 2.462 N/A PHE 43.A N LEU 35.A O no hydrogen 3.141 N/A CYS 44.A SG PHE 43.A O no hydrogen 3.268 N/A GLY 45.A N SER 197.A O no hydrogen 2.775 N/A THR 47.A N LEU 55.A O no hydrogen 3.144 N/A LEU 48.A N TRP 31.A O no hydrogen 2.664 N/A ILE 49.A N TRP 53.A O no hydrogen 3.024 N/A SER 50.A N TRP 53.A O no hydrogen 3.126 N/A VAL 54.A N LEU 106.A O no hydrogen 3.097 N/A LEU 55.A N THR 47.A O no hydrogen 3.010 N/A THR 56.A N ALA 104.A O no hydrogen 2.946 N/A THR 56.A OG1 GLY 45.A O no hydrogen 2.958 N/A HIS 59.A N ASP 102.A OD1 no hydrogen 2.883 N/A HIS 59.A ND1 ASP 102.A OD2 no hydrogen 2.505 N/A HIS 59.A NE2 SER 197.A OG no hydrogen 3.144 N/A CYS 60.A N ALA 57.A O no hydrogen 2.780 N/A CYS 60.A SG SER 197.A O no hydrogen 3.976 N/A LEU 61.A N ALA 58.A O no hydrogen 3.306 N/A SER 69.A N ARG 66D.A O no hydrogen 3.324 N/A SER 69.A OG SER 64B.A OG no hydrogen 2.837 N/A SER 69.A OG ARG 66D.A O no hydrogen 2.937 N/A TYR 70.A N PRO 67.A O no hydrogen 2.780 N/A TYR 70.A OH SER 64B.A O no hydrogen 2.485 N/A LYS 71.A N ARG 36.A O no hydrogen 2.689 N/A LYS 71.A NZ GLU 90.A OE1 no hydrogen 3.172 N/A LYS 71.A NZ GLU 90.A OE2 no hydrogen 3.083 N/A VAL 72.A N ILE 89.A O no hydrogen 2.807 N/A ILE 73.A N SER 34.A O no hydrogen 3.079 N/A LEU 74.A N GLN 87.A O no hydrogen 2.915 N/A HIS 77.A N GLU 83.A OE2 no hydrogen 3.386 N/A HIS 77.A NE2 ALA 24.A O no hydrogen 2.964 N/A GLU 79.A N GLY 151.A O no hydrogen 2.822 N/A VAL 86.A N GLU 83.A O no hydrogen 3.384 N/A GLN 87.A N LEU 74.A O no hydrogen 2.878 N/A VAL 91.A N TYR 70.A O no hydrogen 3.368 N/A SER 92.A N LYS 107.A O no hydrogen 2.526 N/A ARG 93.A N LYS 107.A O no hydrogen 3.286 N/A PHE 95.A N LEU 105.A O no hydrogen 2.774 N/A GLU 97.A N ILE 103.A O no hydrogen 2.975 N/A THR 99.A OG1 GLU 97.A OE2 no hydrogen 2.881 N/A ARG 100.A N GLU 97.A O no hydrogen 3.336 N/A LYS 101.A NZ GLN 177.A OE1 no hydrogen 3.180 N/A ILE 103.A N LYS 101.A O no hydrogen 2.868 N/A LEU 105.A N PHE 95.A O no hydrogen 2.595 N/A LEU 106.A N VAL 54.A O no hydrogen 2.909 N/A LYS 107.A N ARG 93.A O no hydrogen 2.757 N/A LYS 107.A NZ ASN 247.A O no hydrogen 3.539 N/A LYS 107.A NZ ASN 247.A OXT no hydrogen 2.890 N/A LEU 108.A N GLU 52.A O no hydrogen 2.922 N/A SER 109.A N GLU 90.A O no hydrogen 2.751 N/A SER 109.A OG GLU 90.A O no hydrogen 2.475 N/A SER 110.A OG SER 109.A O no hydrogen 2.699 N/A ALA 112.A N PRO 51.A O no hydrogen 2.621 N/A THR 115.A N VAL 118.A O no hydrogen 3.066 N/A LYS 117.A N THR 115.A OG1 no hydrogen 2.891 N/A LYS 117.A NZ THR 115.A OG1 no hydrogen 3.314 N/A VAL 118.A N THR 115.A O no hydrogen 3.088 N/A ALA 121.A N LEU 48.A O no hydrogen 2.826 N/A CYS 122.A SG CYS 5.A O no hydrogen 2.739 N/A ASN 127.A N SER 234.A O no hydrogen 2.628 N/A TYR 128.A N SER 125.A O no hydrogen 3.112 N/A CYS 136.A N LEU 158.A O no hydrogen 2.836 N/A CYS 136.A SG THR 134.A O no hydrogen 3.844 N/A PHE 137.A N VAL 202.A O no hydrogen 2.803 N/A ILE 138.A N ALA 156.A O no hydrogen 3.021 N/A GLY 140.A N LYS 154.A O no hydrogen 3.315 N/A TRP 141.A NE1 HIS 77.A O no hydrogen 2.832 N/A GLY 142.A N ASP 196.A OD1 no hydrogen 2.776 N/A GLU 143.A N GLN 194.A O no hydrogen 2.870 N/A THR 144.A OG1 THR 147.A OG1 no hydrogen 2.357 N/A THR 147.A OG1 THR 144.A OG1 no hydrogen 2.357 N/A LYS 154.A NZ VAL 18.A O no hydrogen 2.942 N/A LYS 154.A NZ GLY 20.A O no hydrogen 2.510 N/A GLU 155.A N CYS 22.A O no hydrogen 2.576 N/A LEU 158.A N CYS 136.A O no hydrogen 2.923 N/A VAL 160.A N THR 134.A O no hydrogen 2.739 N/A ILE 161.A N CYS 182.A O no hydrogen 2.887 N/A ASN 163.A ND2 GLN 177.A O no hydrogen 2.756 N/A ASN 163.A ND2 GLU 180.A O no hydrogen 3.338 N/A VAL 165.A N GLU 162.A O no hydrogen 2.535 N/A CYS 166.A N GLU 162.A O no hydrogen 2.805 N/A CYS 166.A SG GLU 162.A O no hydrogen 3.957 N/A ASN 167.A N ASN 163.A O no hydrogen 2.869 N/A ASN 167.A ND2 VAL 176.A O no hydrogen 3.104 N/A ARG 168.A N VAL 165.A O no hydrogen 2.797 N/A LEU 172.A N CYS 166.A O no hydrogen 2.668 N/A ASN 173.A N ARG 168.A O no hydrogen 2.953 N/A GLY 174.A N ASN 167.A O no hydrogen 2.751 N/A ARG 175.A N LEU 172.A O no hydrogen 3.305 N/A ARG 175.A NE LEU 172.A O no hydrogen 2.960 N/A VAL 176.A N ASN 167.A OD1 no hydrogen 2.896 N/A GLN 177.A N GLU 180.A OE1 no hydrogen 3.462 N/A GLU 180.A N GLN 177.A O no hydrogen 3.317 N/A LEU 181.A N TYR 230.A O no hydrogen 2.594 N/A ALA 183.A N GLY 228.A O no hydrogen 3.271 N/A GLY 184.A N PRO 159.A O no hydrogen 2.935 N/A GLY 188.A N HIS 185A.A O no hydrogen 2.682 N/A GLY 189.A N ALA 222.A O no hydrogen 2.808 N/A ASP 191.A N VAL 19.A O no hydrogen 2.907 N/A SER 192.A OG TYR 230.A OH no hydrogen 2.743 N/A CYS 193.A N ASP 196.A OD2 no hydrogen 2.628 N/A CYS 193.A SG GLN 194.A OE1 no hydrogen 3.729 N/A ASP 196.A N CYS 193.A O no hydrogen 3.003 N/A SER 197.A OG HIS 59.A NE2 no hydrogen 3.144 N/A GLY 198.A N THR 215.A O no hydrogen 2.823 N/A GLY 199.A N ASP 196.A O no hydrogen 2.856 N/A LEU 201.A N GLY 213.A O no hydrogen 2.991 N/A VAL 202.A N PHE 137.A O no hydrogen 2.847 N/A CYS 203.A N ILE 210.A O no hydrogen 2.904 N/A GLU 205.A N LYS 208.A O no hydrogen 3.052 N/A ASP 207.A N GLU 205.A O no hydrogen 3.234 N/A TYR 209.A N GLY 6.A O no hydrogen 3.000 N/A ILE 210.A N CYS 203.A O no hydrogen 3.142 N/A LEU 211.A N CYS 122.A O no hydrogen 2.770 N/A GLN 212.A N LEU 201.A O no hydrogen 2.962 N/A GLN 212.A NE2 GLU 205.A OE2 no hydrogen 2.896 N/A THR 215.A N GLY 199.A O no hydrogen 2.956 N/A SER 216.A N VAL 229.A O no hydrogen 3.343 N/A SER 216.A OG ASP 102.A OD2 no hydrogen 2.933 N/A TRP 217.A N VAL 229.A O no hydrogen 3.220 N/A TRP 217.A NE1 GLU 180.A OE2 no hydrogen 2.796 N/A CYS 221.A SG SER 192.A O no hydrogen 3.758 N/A CYS 221.A SG GLN 194.A OE1 no hydrogen 3.433 N/A ALA 222.A N ASP 191.A OD2 no hydrogen 3.040 N/A ASN 225.A N LEU 186.A O no hydrogen 2.918 N/A LYS 226.A NZ PHE 171.A O no hydrogen 3.032 N/A LYS 226.A NZ GLU 170B.A O no hydrogen 3.069 N/A GLY 228.A N ALA 183.A O no hydrogen 3.213 N/A VAL 229.A N TRP 217.A O no hydrogen 2.834 N/A TYR 230.A N LEU 181.A O no hydrogen 2.873 N/A TYR 230.A OH SER 192.A OG no hydrogen 2.743 N/A VAL 231.A N VAL 214.A O no hydrogen 3.170 N/A ARG 232.A N THR 179.A O no hydrogen 2.500 N/A ARG 232.A NE SER 178.A O no hydrogen 3.149 N/A SER 234.A OG TYR 128.A O no hydrogen 2.592 N/A ARG 235.A N ARG 232.A O no hydrogen 2.833 N/A ARG 235.A NH1 SER 178.A OG no hydrogen 3.172 N/A PHE 236.A N VAL 233.A O no hydrogen 3.015 N/A ILE 240.A N PHE 236.A O no hydrogen 2.695 N/A GLU 241.A N VAL 237.A O no hydrogen 3.045 N/A GLY 242.A N THR 238.A O no hydrogen 2.827 N/A VAL 243.A N TRP 239.A O no hydrogen 2.982 N/A MET 244.A N ILE 240.A O no hydrogen 3.038 N/A ARG 245.A N GLU 241.A O no hydrogen 2.879 N/A ASN 246.A N GLY 242.A O no hydrogen 3.060 N/A THR 190A.A OG1 GLY 17.A O no hydrogen 3.104 N/A SER 64B.A N TYR 70.A OH no hydrogen 2.745 N/A SER 64B.A OG SER 69.A OG no hydrogen 2.837 N/A SER 64B.A OG ARG 66D.A O no hydrogen 3.460 N/A ARG 66D.A N SER 64B.A OG no hydrogen 2.840 N/A ARG 66D.A NH1 SER 64B.A OG no hydrogen 2.940 N/A