Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fub_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 141.A O no hydrogen 3.161 N/A ILE 1.A N LYS 142.A O no hydrogen 2.980 N/A ILE 1.A N ASP 197.A OD2 no hydrogen 2.789 N/A ILE 2.A N ASP 192.A O no hydrogen 2.847 N/A GLU 5.A N MET 156.A O no hydrogen 2.936 N/A THR 7.A N LEU 154.A O no hydrogen 2.893 N/A THR 7.A OG1 THR 8.A O no hydrogen 3.444 N/A THR 7.A OG1 ASN 11.A OD1 no hydrogen 3.167 N/A THR 8.A N THR 7.A OG1 no hydrogen 2.760 N/A THR 8.A OG1 ASN 11.A OD1 no hydrogen 3.439 N/A ILE 9.A N SER 64.A OG no hydrogen 2.896 N/A ASN 11.A N THR 8.A O no hydrogen 3.102 N/A GLN 12.A N ILE 9.A O no hydrogen 3.025 N/A GLN 12.A NE2 GLU 136.A OE2 no hydrogen 2.923 N/A PHE 15.A N GLN 12.A O no hydrogen 3.032 N/A ALA 16.A N GLY 33.A O no hydrogen 2.862 N/A ALA 17.A N TYR 60.A O no hydrogen 2.931 N/A ILE 18.A N CYS 31.A O no hydrogen 3.056 N/A TYR 19.A N ILE 58.A O no hydrogen 2.758 N/A TYR 19.A OH LEU 66.A O no hydrogen 2.754 N/A ARG 20.A N THR 28.A O no hydrogen 2.917 N/A ARG 21.A N ASP 56.A O no hydrogen 2.819 N/A ARG 21.A NH1.A GLU 55.A O no hydrogen 3.353 N/A HIS 22.A N SER 26.A O no hydrogen 2.812 N/A HIS 22.A NE2 THR 28.A OG1 no hydrogen 2.731 N/A GLY 25.A N HIS 22.A O no hydrogen 2.986 N/A THR 28.A N ARG 20.A O no hydrogen 3.138 N/A THR 28.A OG1 HIS 22.A NE2 no hydrogen 2.731 N/A VAL 30.A N ILE 18.A O no hydrogen 2.807 N/A CYS 31.A N ILE 18.A O no hydrogen 3.303 N/A CYS 31.A SG VAL 30.A O no hydrogen 3.222 N/A GLY 32.A N SER 198.A O no hydrogen 2.993 N/A SER 34.A N ILE 42.A O no hydrogen 2.918 N/A LEU 35.A N TRP 14.A O no hydrogen 2.855 N/A ILE 36.A N TRP 40.A O no hydrogen 2.976 N/A TRP 40.A N SER 37.A O no hydrogen 3.002 N/A VAL 41.A N LEU 101.A O no hydrogen 2.925 N/A ILE 42.A N SER 34.A O no hydrogen 2.873 N/A SER 43.A N ALA 99.A O no hydrogen 2.817 N/A SER 43.A OG GLY 32.A O no hydrogen 2.825 N/A THR 45.A OG1 ILE 98.A O no hydrogen 2.603 N/A HIS 46.A N ASP 97.A OD2 no hydrogen 2.803 N/A HIS 46.A ND1 ASP 97.A OD1 no hydrogen 2.628 N/A CYS 47.A N ALA 44.A O no hydrogen 3.222 N/A PHE 48.A N THR 45.A O no hydrogen 2.972 N/A ILE 49.A N THR 45.A O no hydrogen 3.043 N/A TYR 51.A N PHE 48.A O no hydrogen 2.976 N/A ASP 56.A N LYS 53.A O no hydrogen 3.169 N/A TYR 57.A N LYS 54.A O no hydrogen 3.271 N/A TYR 57.A OH TYR 51.A O no hydrogen 2.671 N/A ILE 58.A N TYR 19.A O no hydrogen 2.926 N/A VAL 59.A N PHE 76.A O no hydrogen 3.040 N/A TYR 60.A N ALA 17.A O no hydrogen 2.827 N/A LEU 61.A N MET 74.A O no hydrogen 2.978 N/A ARG 63.A NE ARG 65.A O no hydrogen 3.029 N/A ARG 63.A NH1 ASN 69.A OD1 no hydrogen 3.281 N/A ARG 63.A NH1 GLU 73.A OE1 no hydrogen 3.042 N/A ARG 63.A NH2 LEU 66.A O no hydrogen 3.071 N/A SER 64.A N THR 70.A OG1 no hydrogen 2.904 N/A LEU 66.A N GLU 152.A O no hydrogen 2.884 N/A ASN 67.A N GLU 152.A OE2 no hydrogen 2.784 N/A GLU 73.A N THR 70.A O no hydrogen 2.991 N/A MET 74.A N LEU 61.A O no hydrogen 2.851 N/A PHE 76.A N VAL 59.A O no hydrogen 2.821 N/A GLU 77.A N ARG 104.A O no hydrogen 2.895 N/A GLU 79.A N LYS 102.A O no hydrogen 2.683 N/A ASN 80.A N LYS 102.A O no hydrogen 3.467 N/A ILE 82.A N LEU 100.A O no hydrogen 2.853 N/A HIS 84.A N THR 45.A OG1 no hydrogen 3.391 N/A ASP 86.A N HIS 84.A ND1 no hydrogen 3.257 N/A TYR 87.A N HIS 84.A O no hydrogen 3.265 N/A SER 88.A N HIS 95.A O no hydrogen 3.334 N/A ASP 90.A N ALA 93.A O no hydrogen 2.785 N/A HIS 95.A N SER 88.A O no hydrogen 2.784 N/A HIS 95.A NE2 ASP 90.A OD2 no hydrogen 2.590 N/A ASN 96.A ND2 ASP 86.A O no hydrogen 2.796 N/A ALA 99.A N SER 43.A O no hydrogen 2.947 N/A LEU 100.A N ILE 82.A O no hydrogen 2.916 N/A LEU 101.A N VAL 41.A O no hydrogen 2.774 N/A LYS 102.A N ASN 80.A O no hydrogen 2.906 N/A ILE 103.A N CYS 39.A O no hydrogen 2.939 N/A ARG 104.A N GLU 77.A O no hydrogen 3.057 N/A SER 105.A N ARG 109.A O no hydrogen 2.812 N/A SER 105.A OG ARG 109.A O no hydrogen 3.510 N/A GLU 107.A N SER 105.A OG no hydrogen 3.270 N/A GLY 108.A N SER 105.A O no hydrogen 2.867 N/A ARG 109.A N SER 105.A OG no hydrogen 3.079 N/A CYS 110.A SG ILE 103.A O no hydrogen 3.966 N/A ALA 111.A N PRO 38.A O no hydrogen 2.908 N/A SER 114.A N ILE 117.A O no hydrogen 2.775 N/A ARG 115.A NH1 GLU 10.A OE1 no hydrogen 2.919 N/A THR 116.A N SER 114.A OG no hydrogen 3.295 N/A GLN 118.A N PRO 13.A O no hydrogen 3.051 N/A GLN 118.A NE2 SER 114.A O no hydrogen 3.608 N/A GLN 118.A NE2 ARG 115.A O no hydrogen 3.256 N/A ILE 120.A N LEU 35.A O no hydrogen 2.954 N/A GLY 132.A N LEU 161.A O no hydrogen 2.807 N/A THR 133.A N GLN 130.A O no hydrogen 3.319 N/A THR 133.A OG1.A GLN 130.A O no hydrogen 2.597 N/A CYS 135.A N VAL 159.A O no hydrogen 2.841 N/A GLU 136.A N VAL 203.A O no hydrogen 2.828 N/A ILE 137.A N THR 157.A O no hydrogen 2.988 N/A THR 138.A OG1 GLN 12.A OE1 no hydrogen 2.627 N/A GLY 139.A N LYS 155.A O no hydrogen 3.096 N/A GLY 141.A N ASP 197.A OD1 no hydrogen 2.882 N/A LYS 142.A N GLN 195.A O no hydrogen 3.026 N/A LYS 142.A NZ SER 145.A O no hydrogen 3.379 N/A LYS 142.A NZ ASP 147.A O no hydrogen 2.814 N/A ASP 147.A N GLN 144.A O no hydrogen 3.037 N/A GLN 153.A NE2 THR 7.A O no hydrogen 3.089 N/A LEU 154.A N SER 64.A O no hydrogen 3.228 N/A LYS 155.A N GLY 139.A O no hydrogen 3.163 N/A LYS 155.A NZ ILE 1.A O no hydrogen 3.045 N/A LYS 155.A NZ GLY 3.A O no hydrogen 2.778 N/A LYS 155.A NZ GLU 143.A OE1 no hydrogen 2.880 N/A MET 156.A N GLU 5.A O no hydrogen 2.933 N/A THR 157.A N ILE 137.A O no hydrogen 3.052 N/A THR 157.A OG1 THR 191.A OG1 no hydrogen 2.693 N/A VAL 159.A N CYS 135.A O no hydrogen 2.924 N/A LYS 160.A N ALA 185.A O no hydrogen 2.879 N/A LEU 161.A N THR 133.A O no hydrogen 3.046 N/A ILE 162.A N CYS 183.A O no hydrogen 2.840 N/A GLU 166.A N SER 163.A OG no hydrogen 3.114 N/A CYS 167.A N SER 163.A O no hydrogen 2.992 N/A GLN 168.A N HIS 164.A O no hydrogen 3.022 N/A GLN 169.A N GLU 166.A O no hydrogen 3.176 N/A GLN 169.A NE2 ARG 165.A O no hydrogen 2.992 N/A TYR 172.A N GLN 169.A O no hydrogen 3.043 N/A TYR 173.A N CYS 167.A O no hydrogen 2.992 N/A TYR 173.A OH PRO 228.A O no hydrogen 2.721 N/A GLY 174.A N GLN 169.A O no hydrogen 3.089 N/A GLU 176.A N TYR 173.A O no hydrogen 3.128 N/A LYS 180.A N THR 178.A OG1 no hydrogen 3.379 N/A LYS 180.A NZ ASN 96.A OD1 no hydrogen 2.655 N/A MET 181.A N THR 178.A O no hydrogen 3.081 N/A LEU 182.A N TYR 231.A O no hydrogen 2.737 N/A ALA 184.A N GLY 229.A O no hydrogen 3.078 N/A ALA 185.A N LYS 160.A O no hydrogen 3.018 N/A GLN 188.A N ASP 186.A OD1 no hydrogen 3.034 N/A TRP 189.A N ASP 186.A O no hydrogen 2.901 N/A LYS 190.A N ASP 186.A OD2 no hydrogen 2.776 N/A THR 191.A N ASP 186.A OD2 no hydrogen 3.223 N/A THR 191.A OG1 ILE 2.A O no hydrogen 2.643 N/A THR 191.A OG1 THR 157.A OG1 no hydrogen 2.693 N/A ASP 192.A N ILE 2.A O no hydrogen 3.199 N/A SER 193.A N ASP 192.A OD1 no hydrogen 2.885 N/A SER 193.A OG TYR 231.A OH no hydrogen 2.984 N/A CYS 194.A N ASP 197.A OD2 no hydrogen 2.838 N/A ASP 197.A N CYS 194.A O no hydrogen 2.875 N/A SER 198.A OG HIS 46.A NE2 no hydrogen 3.030 N/A GLY 199.A N VAL 216.A O no hydrogen 2.853 N/A GLY 200.A N ASP 197.A O no hydrogen 3.156 N/A LEU 202.A N GLY 214.A O no hydrogen 2.893 N/A VAL 203.A N GLU 136.A O no hydrogen 2.863 N/A CYS 204.A N THR 211.A O no hydrogen 2.965 N/A CYS 204.A SG THR 213.A OG1 no hydrogen 3.408 N/A LEU 206.A N ARG 209.A O no hydrogen 2.800 N/A ARG 209.A N LEU 206.A O no hydrogen 3.033 N/A THR 211.A N CYS 204.A O no hydrogen 2.811 N/A THR 211.A OG1 ARG 209.A O no hydrogen 2.914 N/A LEU 212.A N ALA 121.A O no hydrogen 2.834 N/A THR 213.A N LEU 202.A O no hydrogen 3.064 N/A GLY 214.A N LEU 202.A O no hydrogen 3.077 N/A ILE 215.A N THR 232.A O no hydrogen 3.382 N/A VAL 216.A N GLY 200.A O no hydrogen 2.898 N/A SER 217.A N VAL 230.A O no hydrogen 3.013 N/A SER 217.A OG ASP 97.A OD1 no hydrogen 2.660 N/A TRP 218.A N VAL 230.A O no hydrogen 3.174 N/A ARG 220.A N TYR 173.A OH no hydrogen 2.962 N/A CYS 222.A SG SER 193.A O no hydrogen 4.003 N/A ALA 223.A N ASP 192.A OD2 no hydrogen 2.822 N/A LYS 227.A N LEU 224.A O no hydrogen 3.057 N/A LYS 227.A NZ HIS 171.A O no hydrogen 3.134 N/A LYS 227.A NZ TYR 172.A O no hydrogen 2.986 N/A GLY 229.A N ALA 184.A O no hydrogen 2.985 N/A VAL 230.A N TRP 218.A O no hydrogen 2.710 N/A TYR 231.A N LEU 182.A O no hydrogen 2.762 N/A THR 232.A N ILE 215.A O no hydrogen 2.975 N/A THR 232.A OG1 ASP 97.A O no hydrogen 2.722 N/A ARG 233.A N LYS 180.A O no hydrogen 3.052 N/A ARG 233.A NE THR 179.A O no hydrogen 2.746 N/A ARG 233.A NH1 SER 235.A OG no hydrogen 2.967 N/A ARG 233.A NH2 THR 179.A O no hydrogen 2.946 N/A VAL 234.A N THR 213.A O no hydrogen 3.224 N/A SER 235.A OG ASP 128.A OD1 no hydrogen 2.624 N/A SER 235.A OG ASP 128.A OD2 no hydrogen 3.400 N/A HIS 236.A N ARG 233.A O no hydrogen 3.211 N/A PHE 237.A N VAL 234.A O no hydrogen 2.994 N/A ILE 241.A N PHE 237.A O no hydrogen 2.779 N/A ARG 242.A N LEU 238.A O no hydrogen 2.904 N/A SER 243.A N PRO 239.A O no hydrogen 2.862 N/A SER 243.A OG PRO 239.A O no hydrogen 3.368 N/A SER 243.A OG TRP 240.A O no hydrogen 3.208 N/A SER 243.A OG HIS 244.A ND1 no hydrogen 3.187 N/A HIS 244.A N TRP 240.A O no hydrogen 2.988 N/A HIS 244.A ND1 TRP 240.A O no hydrogen 2.887 N/A THR 245.A OG1 ILE 241.A O no hydrogen 2.826 N/A THR 245.A OG1 ARG 242.A O no hydrogen 3.457 N/A