Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5wxt_U.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 141.A O no hydrogen 2.967 N/A ILE 1.A N LYS 142.A O no hydrogen 2.892 N/A ILE 1.A N ASP 197.A OD1 no hydrogen 3.462 N/A ILE 1.A N ASP 197.A OD2 no hydrogen 2.656 N/A ILE 2.A N ASP 192.A O no hydrogen 2.591 N/A GLU 5.A N MET 156.A O no hydrogen 2.941 N/A THR 7.A N LEU 154.A O no hydrogen 2.932 N/A THR 7.A OG1 THR 8.A O no hydrogen 3.353 N/A THR 8.A OG1 GLU 10.A OE1 no hydrogen 2.867 N/A ILE 9.A N SER 64.A OG no hydrogen 2.760 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.744 N/A ASN 11.A N THR 8.A O no hydrogen 3.124 N/A ASN 11.A ND2 THR 7.A OG1 no hydrogen 3.368 N/A GLN 12.A N ILE 9.A O no hydrogen 2.840 N/A GLN 12.A NE2 ASN 11.A O no hydrogen 3.279 N/A GLN 12.A NE2 GLU 136.A OE1 no hydrogen 2.841 N/A TRP 14.A NE1 GLN 12.A OE1 no hydrogen 2.650 N/A PHE 15.A N GLN 12.A O no hydrogen 2.825 N/A ALA 16.A N GLY 33.A O no hydrogen 3.035 N/A ALA 17.A N TYR 60.A O no hydrogen 2.874 N/A ILE 18.A N CYS 31.A O no hydrogen 3.045 N/A TYR 19.A N ILE 58.A O no hydrogen 2.870 N/A TYR 19.A OH LEU 66.A O no hydrogen 2.671 N/A ARG 20.A N THR 28.A O no hydrogen 2.916 N/A ARG 21.A N ASP 56.A O no hydrogen 2.863 N/A ARG 21.A NH1 GLU 77.A OE1 no hydrogen 3.349 N/A ARG 21.A NH1 GLU 55A.A O no hydrogen 3.120 N/A HIS 22.A ND1 SER 26D.A O no hydrogen 2.866 N/A THR 28.A N ARG 20.A O no hydrogen 3.088 N/A VAL 30.A N ILE 18.A O no hydrogen 2.791 N/A CYS 31.A N ILE 18.A O no hydrogen 3.296 N/A CYS 31.A SG VAL 30.A O no hydrogen 3.014 N/A GLY 32.A N ALA 198.A O no hydrogen 2.878 N/A SER 34.A N ILE 42.A O no hydrogen 2.789 N/A LEU 35.A N TRP 14.A O no hydrogen 2.856 N/A ILE 36.A N TRP 40.A O no hydrogen 3.032 N/A SER 37.A N TRP 40.A O no hydrogen 3.507 N/A TRP 40.A N SER 37.A O no hydrogen 3.154 N/A VAL 41.A N LEU 101.A O no hydrogen 2.727 N/A ILE 42.A N SER 34.A O no hydrogen 2.807 N/A SER 43.A N ALA 99.A O no hydrogen 2.932 N/A SER 43.A OG GLY 32.A O no hydrogen 2.940 N/A ALA 44.A N SER 43.A OG no hydrogen 2.670 N/A THR 45.A OG1 ILE 98.A O no hydrogen 2.437 N/A HIS 46.A N ASP 97.A OD1 no hydrogen 2.912 N/A HIS 46.A ND1 ASP 97.A OD2 no hydrogen 2.525 N/A CYS 47.A N ALA 44.A O no hydrogen 3.399 N/A PHE 48.A N THR 45.A O no hydrogen 2.965 N/A LYS 53.A N TYR 51B.A O no hydrogen 2.825 N/A LYS 54.A NZ GLU 79.A O no hydrogen 3.167 N/A ASP 56.A N LYS 53.A O no hydrogen 3.072 N/A TYR 57.A N LYS 54.A O no hydrogen 3.087 N/A TYR 57.A OH TYR 51B.A O no hydrogen 2.814 N/A ILE 58.A N TYR 19.A O no hydrogen 2.987 N/A VAL 59.A N PHE 76.A O no hydrogen 2.989 N/A TYR 60.A N ALA 17.A O no hydrogen 2.828 N/A LEU 61.A N MET 74.A O no hydrogen 2.981 N/A ARG 63.A NE TYR 19.A OH no hydrogen 3.272 N/A ARG 63.A NH1 GLU 73.A OE1 no hydrogen 3.257 N/A ARG 63.A NH1 GLU 73.A OE2 no hydrogen 3.076 N/A ARG 63.A NH2 LEU 66.A O no hydrogen 3.298 N/A SER 64.A N THR 70.A OG1 no hydrogen 3.014 N/A ARG 65.A NH1 GLN 153.A OE1 no hydrogen 2.759 N/A LEU 66.A N GLU 152.A O no hydrogen 2.868 N/A ASN 67.A N GLU 152.A OE2 no hydrogen 2.347 N/A ASN 67.A ND2 GLU 152.A OE1 no hydrogen 2.842 N/A ASN 67.A ND2 GLU 152.A OE2 no hydrogen 3.557 N/A THR 70.A N GLU 73.A OE1 no hydrogen 2.853 N/A GLU 73.A N THR 70.A O no hydrogen 3.173 N/A MET 74.A N LEU 61.A O no hydrogen 3.061 N/A PHE 76.A N VAL 59.A O no hydrogen 2.724 N/A GLU 77.A N ARG 104.A O no hydrogen 2.897 N/A GLU 79.A N LYS 102.A O no hydrogen 2.814 N/A ASN 80.A N LYS 102.A O no hydrogen 3.373 N/A ILE 82.A N LEU 100.A O no hydrogen 2.826 N/A HIS 84.A N THR 45.A OG1 no hydrogen 3.153 N/A ASP 86.A N HIS 84.A ND1 no hydrogen 3.229 N/A TYR 87.A N HIS 84.A O no hydrogen 3.045 N/A TYR 87.A OH HIS 94.A ND1 no hydrogen 2.878 N/A SER 88.A N HIS 95.A O no hydrogen 3.256 N/A ASP 90.A N ALA 93.A O no hydrogen 2.942 N/A HIS 94.A ND1 TYR 87.A OH no hydrogen 2.878 N/A HIS 95.A N SER 88.A O no hydrogen 2.712 N/A ASN 96.A ND2 ASP 86.A O no hydrogen 2.815 N/A ALA 99.A N SER 43.A O no hydrogen 2.785 N/A LEU 100.A N ILE 82.A O no hydrogen 2.862 N/A LEU 101.A N VAL 41.A O no hydrogen 2.734 N/A LYS 102.A N ASN 80.A O no hydrogen 2.800 N/A ILE 103.A N CYS 39.A O no hydrogen 2.779 N/A ARG 104.A N GLU 77.A O no hydrogen 3.097 N/A SER 105.A N ARG 109D.A O no hydrogen 2.656 N/A SER 105.A OG GLU 107B.A OE1 no hydrogen 2.842 N/A SER 105.A OG ARG 109D.A O no hydrogen 3.497 N/A CYS 110.A SG ILE 103.A O no hydrogen 3.862 N/A ALA 111.A N PRO 38.A O no hydrogen 3.015 N/A SER 114.A N ILE 117.A O no hydrogen 2.821 N/A SER 114.A OG THR 116.A OG1 no hydrogen 3.305 N/A THR 116.A N SER 114.A OG no hydrogen 3.174 N/A THR 116.A OG1 GLY 72.A O no hydrogen 3.312 N/A THR 116.A OG1 SER 114.A OG no hydrogen 3.305 N/A ILE 117.A N SER 114.A O no hydrogen 3.254 N/A GLN 118.A N PRO 13.A O no hydrogen 3.178 N/A GLN 118.A NE2 SER 114.A O no hydrogen 2.864 N/A ILE 120.A N LEU 35.A O no hydrogen 3.003 N/A TYR 126.A N SER 235.A O no hydrogen 2.765 N/A ASN 127.A N SER 124.A O no hydrogen 2.832 N/A ASN 127.A ND2 SER 124.A OG no hydrogen 3.168 N/A ASN 127.A ND2 GLN 207.A OE1 no hydrogen 3.140 N/A GLY 132.A N LEU 161.A O no hydrogen 2.757 N/A THR 133.A N GLN 130.A O no hydrogen 3.120 N/A THR 133.A OG1 GLN 130.A O no hydrogen 2.449 N/A CYS 135.A N VAL 159.A O no hydrogen 2.788 N/A CYS 135.A SG THR 133.A O no hydrogen 4.027 N/A GLU 136.A N VAL 203.A O no hydrogen 2.833 N/A ILE 137.A N THR 157.A O no hydrogen 3.090 N/A GLY 139.A N LYS 155.A O no hydrogen 3.063 N/A GLY 141.A N ASP 197.A OD1 no hydrogen 2.668 N/A LYS 142.A N GLN 195.A O no hydrogen 2.983 N/A LYS 142.A NZ GLN 195.A OE1 no hydrogen 2.603 N/A GLN 144.A NE2 ASP 147.A OD1 no hydrogen 2.556 N/A ASP 147.A N GLN 144.A O no hydrogen 3.020 N/A GLN 153.A NE2 THR 7.A O no hydrogen 2.697 N/A LEU 154.A N SER 64.A O no hydrogen 3.095 N/A LYS 155.A N GLY 139.A O no hydrogen 3.208 N/A LYS 155.A NZ ILE 1.A O no hydrogen 3.021 N/A LYS 155.A NZ GLY 3.A O no hydrogen 2.695 N/A LYS 155.A NZ GLU 143.A OE2 no hydrogen 3.020 N/A MET 156.A N GLU 5.A O no hydrogen 2.917 N/A THR 157.A N ILE 137.A O no hydrogen 3.029 N/A THR 157.A OG1 THR 191.A OG1 no hydrogen 2.932 N/A VAL 159.A N CYS 135.A O no hydrogen 3.007 N/A LYS 160.A N ALA 185.A O no hydrogen 3.016 N/A LEU 161.A N THR 133.A O no hydrogen 2.842 N/A ILE 162.A N CYS 183.A O no hydrogen 2.794 N/A HIS 164.A NE2 MET 181.A O no hydrogen 2.959 N/A GLU 166.A N SER 163.A OG no hydrogen 2.901 N/A CYS 167.A N SER 163.A O no hydrogen 2.884 N/A GLN 168.A N HIS 164.A O no hydrogen 2.928 N/A GLN 168.A NE2 VAL 177.A O no hydrogen 3.582 N/A GLN 169.A N GLU 166.A O no hydrogen 3.283 N/A GLN 169.A NE2 GLU 166.A O no hydrogen 3.058 N/A TYR 172.A N GLN 169.A O no hydrogen 2.794 N/A TYR 172.A OH GLU 166.A OE2 no hydrogen 2.711 N/A TYR 173.A N CYS 167.A O no hydrogen 3.002 N/A TYR 173.A OH PRO 228.A O no hydrogen 2.646 N/A GLY 174.A N GLN 169.A O no hydrogen 3.217 N/A LYS 180.A N THR 178.A OG1 no hydrogen 3.279 N/A LYS 180.A NZ ASN 96.A OD1 no hydrogen 2.831 N/A MET 181.A N THR 178.A O no hydrogen 3.088 N/A LEU 182.A N TYR 231.A O no hydrogen 2.743 N/A ALA 184.A N GLY 229.A O no hydrogen 2.986 N/A ALA 185.A N LYS 160.A O no hydrogen 3.072 N/A TRP 189.A N ASP 186.A O no hydrogen 2.953 N/A LYS 190.A N ASP 186.A OD2 no hydrogen 2.715 N/A THR 191.A OG1 ILE 2.A O no hydrogen 2.134 N/A THR 191.A OG1 THR 157.A OG1 no hydrogen 2.932 N/A ASP 192.A N ILE 2.A O no hydrogen 3.073 N/A SER 193.A OG ASP 192.A OD1 no hydrogen 3.467 N/A SER 193.A OG TYR 231.A OH no hydrogen 2.917 N/A CYS 194.A N ASP 197.A OD2 no hydrogen 2.916 N/A ASP 197.A N CYS 194.A O no hydrogen 2.985 N/A GLY 199.A N VAL 216.A O no hydrogen 3.051 N/A GLY 200.A N ASP 197.A O no hydrogen 3.158 N/A LEU 202.A N GLY 214.A O no hydrogen 2.912 N/A VAL 203.A N GLU 136.A O no hydrogen 2.726 N/A CYS 204.A N THR 211.A O no hydrogen 3.061 N/A LEU 206.A N ARG 209.A O no hydrogen 2.801 N/A ARG 209.A N LEU 206.A O no hydrogen 3.121 N/A THR 211.A N CYS 204.A O no hydrogen 2.777 N/A THR 211.A OG1 ARG 209.A O no hydrogen 3.109 N/A LEU 212.A N ALA 121.A O no hydrogen 2.861 N/A THR 213.A N LEU 202.A O no hydrogen 2.965 N/A GLY 214.A N LEU 202.A O no hydrogen 3.156 N/A ILE 215.A N THR 232.A O no hydrogen 3.165 N/A VAL 216.A N GLY 200.A O no hydrogen 2.910 N/A SER 217.A N VAL 230.A O no hydrogen 3.029 N/A SER 217.A OG ASP 97.A OD2 no hydrogen 2.825 N/A TRP 218.A N VAL 230.A O no hydrogen 3.053 N/A ARG 220.A N TYR 173.A OH no hydrogen 2.924 N/A CYS 222.A SG SER 193.A O no hydrogen 3.863 N/A ALA 223.A N ASP 192.A OD2 no hydrogen 2.882 N/A LYS 225.A NZ ASP 226A.A OD2 no hydrogen 3.155 N/A LYS 227.A N LEU 224.A O no hydrogen 3.193 N/A LYS 227.A NZ TYR 172.A O no hydrogen 2.508 N/A LYS 227.A NZ HIS 171B.A O no hydrogen 2.838 N/A GLY 229.A N ALA 184.A O no hydrogen 2.818 N/A VAL 230.A N TRP 218.A O no hydrogen 2.688 N/A TYR 231.A N LEU 182.A O no hydrogen 2.818 N/A THR 232.A N ILE 215.A O no hydrogen 2.843 N/A THR 232.A OG1 ASP 97.A O no hydrogen 2.742 N/A ARG 233.A N LYS 180.A O no hydrogen 3.077 N/A ARG 233.A NE ASP 128.A OD2 no hydrogen 2.644 N/A ARG 233.A NH1 THR 179.A O no hydrogen 3.062 N/A ARG 233.A NH2 ASP 128.A OD2 no hydrogen 3.108 N/A VAL 234.A N THR 213.A O no hydrogen 3.119 N/A SER 235.A OG ASP 128.A OD1 no hydrogen 3.258 N/A SER 235.A OG ASP 128.A OD2 no hydrogen 2.910 N/A SER 235.A OG HIS 236.A ND1 no hydrogen 3.109 N/A HIS 236.A N ARG 233.A O no hydrogen 3.185 N/A HIS 236.A ND1 SER 235.A OG no hydrogen 3.109 N/A PHE 237.A N VAL 234.A O no hydrogen 2.891 N/A ILE 241.A N PHE 237.A O no hydrogen 2.938 N/A ARG 242.A N LEU 238.A O no hydrogen 2.664 N/A SER 243.A N PRO 239.A O no hydrogen 2.725 N/A SER 243.A OG TRP 240.A O no hydrogen 2.830 N/A HIS 244.A N TRP 240.A O no hydrogen 2.852 N/A HIS 244.A ND1 TRP 240.A O no hydrogen 3.184 N/A THR 245.A OG1 ILE 241.A O no hydrogen 2.395 N/A THR 245.A OG1 ARG 242.A O no hydrogen 3.312 N/A ARG 23A.A NH1 TYR 51B.A OH no hydrogen 3.456 N/A THR 91A.A OG1 GLU 176.A OE1 no hydrogen 2.964 N/A TYR 51B.A N PHE 48.A O no hydrogen 3.042 N/A GLU 107B.A N SER 105.A OG no hydrogen 3.212 N/A HIS 171B.A N HIS 171B.A ND1 no hydrogen 2.913 N/A GLY 25C.A N HIS 22.A O no hydrogen 2.273 N/A GLY 108C.A N SER 105.A O no hydrogen 2.772 N/A ARG 109D.A N SER 105.A OG no hydrogen 2.940 N/A