Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2iex_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N THR 14.A O no hydrogen 2.876 N/A GLN 4.A N TYR 12.A O no hydrogen 2.932 N/A TYR 7.A OH ASP 42.A OD2 no hydrogen 2.635 N/A GLU 8.A N GLU 39.A OE2 no hydrogen 3.183 N/A ASP 9.A N GLU 39.A OE1 no hydrogen 3.204 N/A ASP 9.A N GLU 39.A OE2 no hydrogen 2.853 N/A ILE 10.A N GLU 39.A OE2 no hydrogen 3.322 N/A ILE 11.A N THR 22.A O no hydrogen 2.819 N/A GLU 13.A N LYS 20.A O no hydrogen 3.120 N/A THR 14.A OG1 GLN 4.A OE1 no hydrogen 2.527 N/A TYR 15.A N ILE 18.A O no hydrogen 2.791 N/A ILE 18.A N TYR 15.A O no hydrogen 2.964 N/A ALA 19.A N VAL 55.A O no hydrogen 3.124 N/A LYS 20.A N GLU 13.A O no hydrogen 2.868 N/A ILE 21.A N ILE 57.A O no hydrogen 2.803 N/A THR 22.A N ILE 11.A O no hydrogen 2.850 N/A ILE 23.A N THR 59.A O no hydrogen 3.079 N/A ASN 24.A N ASP 9.A O no hydrogen 2.919 N/A ARG 25.A N ASN 30.A OD1 no hydrogen 3.015 N/A ARG 25.A NE ALA 31.A O no hydrogen 3.203 N/A GLU 27.A N GLU 27.A OE1 no hydrogen 2.709 N/A VAL 28.A N ARG 25.A O no hydrogen 2.856 N/A HIS 29.A N PRO 26.A O no hydrogen 3.002 N/A ASN 30.A N ARG 25.A O no hydrogen 2.805 N/A ASN 30.A ND2 ALA 65.A O no hydrogen 2.735 N/A ALA 31.A N VAL 28.A O no hydrogen 3.271 N/A PHE 32.A N GLY 69.A O no hydrogen 2.616 N/A ARG 33.A NE ASP 9.A OD2 no hydrogen 2.965 N/A ARG 33.A NH2 ASP 9.A OD1 no hydrogen 3.381 N/A LYS 35.A NZ GLU 8.A OE1 no hydrogen 3.416 N/A VAL 37.A N ARG 33.A O no hydrogen 3.307 N/A ASN 38.A N PRO 34.A O no hydrogen 3.307 N/A GLU 39.A N LYS 35.A O no hydrogen 3.129 N/A MET 40.A N THR 36.A O no hydrogen 3.188 N/A ILE 41.A N VAL 37.A O no hydrogen 2.941 N/A ASP 42.A N ASN 38.A O no hydrogen 3.136 N/A ALA 43.A N GLU 39.A O no hydrogen 2.861 N/A PHE 44.A N MET 40.A O no hydrogen 2.862 N/A THR 45.A N ILE 41.A O no hydrogen 2.882 N/A THR 45.A OG1 ILE 41.A O no hydrogen 2.828 N/A LYS 46.A N ASP 42.A O no hydrogen 2.840 N/A LYS 46.A NZ ASP 42.A OD2 no hydrogen 3.164 N/A ALA 47.A N ALA 43.A O no hydrogen 2.869 N/A ARG 48.A N PHE 44.A O no hydrogen 2.616 N/A ASP 49.A N THR 45.A O no hydrogen 2.917 N/A ASP 50.A N LYS 46.A O no hydrogen 3.010 N/A ASN 52.A N ASP 50.A OD1 no hydrogen 2.766 N/A ILE 53.A N ASP 50.A O no hydrogen 2.876 N/A GLY 54.A N GLY 17.A O no hydrogen 2.855 N/A VAL 55.A N GLY 17.A O no hydrogen 3.433 N/A ILE 56.A N PRO 89.A O no hydrogen 2.999 N/A ILE 57.A N ALA 19.A O no hydrogen 2.680 N/A LEU 58.A N ILE 91.A O no hydrogen 2.903 N/A THR 59.A N ILE 21.A O no hydrogen 3.010 N/A THR 59.A OG1 GLY 60.A O no hydrogen 3.411 N/A THR 59.A OG1 MET 93.A O no hydrogen 2.735 N/A ALA 61.A N ILE 23.A O no hydrogen 3.070 N/A PHE 66.A N TYR 97.A O no hydrogen 2.538 N/A CYS 67.A N TYR 97.A O no hydrogen 3.003 N/A CYS 67.A SG ASN 30.A O no hydrogen 3.571 N/A SER 68.A OG VAL 28.A O no hydrogen 3.197 N/A SER 68.A OG HIS 29.A O no hydrogen 3.256 N/A ASP 71.A N PHE 32.A O no hydrogen 3.369 N/A ASN 75.A ND2 PRO 34.A O no hydrogen 2.954 N/A ASN 75.A ND2 ASN 38.A OD1 no hydrogen 3.376 N/A LEU 77.A N LEU 74.A O no hydrogen 3.230 N/A ASP 78.A N ASN 75.A O no hydrogen 3.215 N/A LEU 79.A N ASN 75.A O no hydrogen 3.427 N/A GLN 80.A N VAL 76.A O no hydrogen 2.857 N/A ARG 81.A N LEU 77.A O no hydrogen 3.162 N/A LEU 82.A N ASP 78.A O no hydrogen 3.006 N/A ILE 83.A N LEU 79.A O no hydrogen 2.844 N/A ARG 84.A N GLN 80.A O no hydrogen 3.232 N/A ARG 84.A NH2 ASP 209.A OD2 no hydrogen 3.090 N/A VAL 85.A N ARG 81.A O no hydrogen 2.898 N/A ILE 86.A N LEU 82.A O no hydrogen 3.002 N/A LYS 88.A NZ ALA 47.A O no hydrogen 2.577 N/A LYS 88.A NZ ARG 48.A O no hydrogen 2.889 N/A LYS 88.A NZ ASP 50.A O no hydrogen 3.024 N/A LYS 88.A NZ ILE 53.A O no hydrogen 2.917 N/A VAL 90.A N ASP 110.A OD2 no hydrogen 2.652 N/A ILE 91.A N ILE 56.A O no hydrogen 2.713 N/A ALA 92.A N LEU 111.A O no hydrogen 2.795 N/A MET 93.A N LEU 58.A O no hydrogen 2.729 N/A VAL 94.A N ILE 113.A O no hydrogen 2.826 N/A GLY 96.A N ASN 117.A OD1 no hydrogen 3.294 N/A TYR 97.A N LYS 64.A O no hydrogen 3.093 N/A ALA 98.A N ILE 119.A O no hydrogen 2.856 N/A ILE 99.A N CYS 67.A O no hydrogen 3.079 N/A GLY 100.A N GLY 121.A O no hydrogen 3.178 N/A GLY 102.A N ILE 99.A O no hydrogen 2.719 N/A HIS 103.A N GLY 100.A O no hydrogen 2.799 N/A VAL 104.A N GLY 100.A O no hydrogen 3.171 N/A LEU 105.A N GLY 101.A O no hydrogen 3.088 N/A HIS 106.A N GLY 102.A O no hydrogen 3.388 N/A VAL 107.A N HIS 103.A O no hydrogen 2.954 N/A VAL 108.A N VAL 104.A O no hydrogen 2.951 N/A CYS 109.A N HIS 106.A O no hydrogen 3.294 N/A CYS 109.A SG LEU 105.A O no hydrogen 3.368 N/A LEU 111.A N VAL 90.A O no hydrogen 3.231 N/A ILE 113.A N ALA 92.A O no hydrogen 2.869 N/A ALA 114.A N LYS 171.A O no hydrogen 2.889 N/A ALA 115.A N VAL 94.A O no hydrogen 2.969 N/A ASP 116.A N VAL 173.A O no hydrogen 2.772 N/A ASN 117.A ND2 GLY 63.A O no hydrogen 3.496 N/A ALA 118.A N ALA 115.A O no hydrogen 2.896 N/A ILE 119.A N GLY 96.A O no hydrogen 2.785 N/A PHE 120.A N TYR 158.A O no hydrogen 2.751 N/A LYS 126.A N THR 123.A O no hydrogen 2.740 N/A VAL 127.A N THR 123.A O no hydrogen 3.132 N/A SER 129.A N GLY 124.A O no hydrogen 2.958 N/A GLY 133.A N ASP 131.A OD1 no hydrogen 2.929 N/A TYR 134.A OH ASP 209.A OD2 no hydrogen 2.794 N/A GLY 135.A N ASP 131.A OD1 no hydrogen 3.242 N/A ALA 136.A N GLY 133.A O no hydrogen 3.229 N/A GLY 137.A N GLY 133.A O no hydrogen 3.202 N/A LEU 139.A N TYR 134.A O no hydrogen 3.214 N/A ALA 140.A N ALA 136.A O no hydrogen 2.891 N/A ARG 141.A N GLY 137.A O no hydrogen 3.069 N/A ARG 141.A N TYR 138.A O no hydrogen 2.945 N/A ILE 142.A N LEU 139.A O no hydrogen 2.856 N/A VAL 143.A N LEU 139.A O no hydrogen 2.980 N/A GLY 144.A N ALA 140.A O no hydrogen 2.902 N/A LYS 147.A NZ GLU 150.A OE1 no hydrogen 2.796 N/A ALA 148.A N GLY 144.A O no hydrogen 3.104 N/A ARG 149.A N HIS 145.A O no hydrogen 3.117 N/A ARG 149.A NE HIS 145.A ND1 no hydrogen 3.285 N/A ARG 149.A NH2 HIS 145.A ND1 no hydrogen 3.395 N/A GLU 150.A N LYS 146.A O no hydrogen 3.134 N/A ILE 151.A N LYS 147.A O no hydrogen 2.923 N/A TRP 152.A N ALA 148.A O no hydrogen 3.271 N/A TRP 152.A NE1 GLY 135.A O no hydrogen 2.772 N/A TYR 153.A N ARG 149.A O no hydrogen 2.878 N/A LEU 154.A N GLU 150.A O no hydrogen 3.097 N/A CYS 155.A SG TRP 152.A O no hydrogen 3.449 N/A TYR 158.A N PHE 120.A O no hydrogen 2.714 N/A TYR 158.A OH GLU 150.A OE2 no hydrogen 2.480 N/A THR 159.A N GLU 162.A OE1 no hydrogen 2.852 N/A THR 159.A OG1 GLU 162.A OE1 no hydrogen 3.267 N/A GLN 161.A NE2 GLU 165.A OE1 no hydrogen 3.046 N/A ALA 163.A N THR 159.A O no hydrogen 2.878 N/A LEU 164.A N ALA 160.A O no hydrogen 2.755 N/A GLU 165.A N GLN 161.A O no hydrogen 2.984 N/A MET 166.A N GLU 162.A O no hydrogen 3.172 N/A GLY 167.A N LEU 164.A O no hydrogen 2.954 N/A LEU 168.A N ALA 163.A O no hydrogen 2.878 N/A ASN 170.A N THR 112.A O no hydrogen 2.928 N/A ASN 170.A ND2 THR 112.A O no hydrogen 3.536 N/A VAL 173.A N ALA 114.A O no hydrogen 2.881 N/A GLN 177.A N PRO 174.A O no hydrogen 2.943 N/A LEU 178.A N LEU 175.A O no hydrogen 3.452 N/A GLU 181.A N GLN 177.A O no hydrogen 2.893 N/A THR 182.A N LEU 178.A O no hydrogen 2.951 N/A THR 182.A OG1 LEU 178.A O no hydrogen 2.941 N/A VAL 183.A N GLU 179.A O no hydrogen 2.947 N/A LYS 184.A N GLU 180.A O no hydrogen 3.119 N/A TRP 185.A N GLU 181.A O no hydrogen 2.864 N/A TRP 185.A NE1 GLU 181.A OE2 no hydrogen 2.865 N/A ALA 186.A N THR 182.A O no hydrogen 2.873 N/A GLN 187.A N VAL 183.A O no hydrogen 2.874 N/A GLU 188.A N LYS 184.A O no hydrogen 3.158 N/A ILE 189.A N TRP 185.A O no hydrogen 3.158 N/A LEU 190.A N ALA 186.A O no hydrogen 2.960 N/A GLU 191.A N GLU 188.A O no hydrogen 3.284 N/A LYS 192.A N ILE 189.A O no hydrogen 3.069 N/A ALA 196.A N SER 193.A OG no hydrogen 3.120 N/A ILE 197.A N SER 193.A O no hydrogen 3.137 N/A ARG 198.A N PRO 194.A O no hydrogen 3.115 N/A ARG 198.A NE ASP 220.A OD2 no hydrogen 2.897 N/A ARG 198.A NH2 ASP 220.A OD1 no hydrogen 2.933 N/A PHE 199.A N THR 195.A O no hydrogen 3.192 N/A LEU 200.A N ALA 196.A O no hydrogen 3.342 N/A LYS 201.A N ILE 197.A O no hydrogen 3.001 N/A LYS 201.A NZ ILE 83.A O no hydrogen 3.063 N/A LYS 201.A NZ ILE 86.A O no hydrogen 2.835 N/A LYS 201.A NZ LYS 88.A O no hydrogen 2.664 N/A LYS 201.A NZ ASP 110.A OD2 no hydrogen 2.884 N/A ALA 202.A N ARG 198.A O no hydrogen 3.055 N/A ALA 203.A N PHE 199.A O no hydrogen 2.897 N/A PHE 204.A N LEU 200.A O no hydrogen 2.829 N/A ASN 205.A N LYS 201.A O no hydrogen 2.979 N/A ASN 205.A ND2 ARG 84.A O no hydrogen 2.711 N/A ASN 205.A ND2 GLN 216.A OE1 no hydrogen 2.771 N/A ALA 206.A N ALA 202.A O no hydrogen 2.784 N/A ASP 207.A N ALA 203.A O no hydrogen 3.185 N/A SER 208.A N ASN 205.A O no hydrogen 3.250 N/A SER 208.A OG ASP 209.A OD1 no hydrogen 2.986 N/A ASP 209.A N ASN 205.A O no hydrogen 2.968 N/A GLY 213.A N ASP 209.A O no hydrogen 3.045 N/A ILE 214.A N GLY 210.A O no hydrogen 2.881 N/A GLN 215.A N LEU 211.A O no hydrogen 2.760 N/A GLN 216.A N GLY 213.A O no hydrogen 3.155 N/A GLN 216.A NE2 ARG 84.A O no hydrogen 3.490 N/A LEU 217.A N GLY 213.A O no hydrogen 3.156 N/A ALA 218.A N ILE 214.A O no hydrogen 2.762 N/A GLY 219.A N GLN 215.A O no hydrogen 2.836 N/A ASP 220.A N GLN 216.A O no hydrogen 2.980 N/A ALA 221.A N LEU 217.A O no hydrogen 3.292 N/A THR 222.A N ALA 218.A O no hydrogen 3.009 N/A THR 222.A OG1 ALA 218.A O no hydrogen 3.125 N/A LEU 223.A N GLY 219.A O no hydrogen 3.000 N/A LEU 224.A N ASP 220.A O no hydrogen 2.900 N/A PHE 225.A N ALA 221.A O no hydrogen 2.754 N/A TYR 226.A N THR 222.A O no hydrogen 3.100 N/A THR 227.A N LEU 224.A O no hydrogen 3.041 N/A THR 228.A N PHE 225.A O no hydrogen 2.894 N/A THR 228.A OG1 PHE 225.A O no hydrogen 2.776 N/A ALA 231.A N THR 228.A OG1 no hydrogen 3.302 N/A LYS 232.A N THR 228.A O no hydrogen 3.218 N/A LYS 232.A NZ TYR 226.A O no hydrogen 3.215 N/A LYS 232.A NZ THR 227.A O no hydrogen 2.842 N/A GLU 233.A N GLU 229.A O no hydrogen 2.869 N/A ARG 236.A N LYS 232.A O no hydrogen 2.859 N/A ALA 237.A N GLU 233.A O no hydrogen 2.816 N/A PHE 238.A N GLY 234.A O no hydrogen 3.171 N/A LYS 239.A N MET 235.A O no hydrogen 3.060 N/A GLU 240.A N ARG 236.A O no hydrogen 2.843 N/A LYS 241.A N PHE 238.A O no hydrogen 3.251 N/A ARG 242.A N ALA 237.A O no hydrogen 3.015 N/A ARG 242.A NE GLU 240.A OE1 no hydrogen 2.613 N/A ARG 242.A NH1 GLU 233.A OE2 no hydrogen 3.510 N/A ARG 242.A NH1 LYS 243.A O no hydrogen 3.263 N/A ARG 242.A NH2 GLU 233.A OE1 no hydrogen 2.641 N/A ASP 245.A N GLU 233.A OE2 no hydrogen 3.071 N/A PHE 249.A N PHE 246.A O no hydrogen 2.679 N/A