Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1boh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N TYR 260.A OH no hydrogen 3.433 N/A VAL 10.A N VAL 125.A O no hydrogen 2.946 N/A THR 12.A OG1 GLU 136.A OE1 no hydrogen 2.929 N/A THR 12.A OG1 GLU 136.A OE2 no hydrogen 3.478 N/A LYS 13.A NZ GLU 17.A OE2 no hydrogen 2.913 N/A TRP 14.A N SER 11.A OG no hydrogen 3.157 N/A LEU 15.A N SER 11.A O no hydrogen 3.190 N/A ALA 16.A N THR 12.A O no hydrogen 2.894 N/A GLU 17.A N LYS 13.A O no hydrogen 2.932 N/A SER 18.A N TRP 14.A O no hydrogen 3.044 N/A SER 18.A OG TRP 14.A O no hydrogen 3.061 N/A VAL 19.A N LEU 15.A O no hydrogen 2.888 N/A ARG 20.A N ALA 16.A O no hydrogen 2.856 N/A ALA 21.A N GLU 17.A O no hydrogen 2.803 N/A GLY 22.A N VAL 19.A O no hydrogen 3.200 N/A LYS 23.A N SER 18.A O no hydrogen 2.937 N/A GLY 25.A N LEU 28.A O no hydrogen 3.009 N/A LEU 28.A N GLY 25.A O no hydrogen 2.858 N/A ARG 29.A N HIS 94.A O no hydrogen 2.941 N/A ARG 29.A NE GLY 88.A O no hydrogen 2.903 N/A ARG 29.A NH2 GLU 148.A OE2 no hydrogen 2.881 N/A LEU 31.A N VAL 96.A O no hydrogen 2.883 N/A ASP 32.A N SER 56.A O no hydrogen 2.844 N/A ALA 33.A N TYR 98.A O no hydrogen 2.785 N/A SER 34.A N ASP 32.A OD1 no hydrogen 3.290 N/A SER 34.A OG ASP 32.A OD1 no hydrogen 2.701 N/A SER 34.A OG TYR 36.A OH no hydrogen 3.350 N/A TYR 36.A OH SER 34.A OG no hydrogen 3.350 N/A THR 40.A N SER 37.A O no hydrogen 3.023 N/A THR 40.A OG1 SER 37.A O no hydrogen 2.950 N/A ARG 41.A NE GLU 46.A OE1 no hydrogen 3.048 N/A ARG 41.A NE GLU 46.A OE2 no hydrogen 3.308 N/A ARG 41.A NH1 GLY 100.A O no hydrogen 2.870 N/A ARG 41.A NH2 GLU 46.A OE1 no hydrogen 2.950 N/A ARG 41.A NH2 GLY 100.A O no hydrogen 3.057 N/A GLU 46.A N GLU 42.A O no hydrogen 2.905 N/A TYR 47.A N ALA 43.A O no hydrogen 3.033 N/A TYR 47.A OH ALA 55.A O no hydrogen 2.727 N/A LEU 48.A N ARG 44.A O no hydrogen 3.159 N/A GLU 49.A N LYS 45.A O no hydrogen 3.238 N/A ARG 50.A N GLU 46.A O no hydrogen 3.331 N/A HIS 51.A N THR 141.A O no hydrogen 2.979 N/A HIS 51.A ND1 VAL 52.A O no hydrogen 3.109 N/A VAL 52.A N TYR 98.A OH no hydrogen 3.165 N/A ALA 55.A N VAL 52.A O no hydrogen 3.068 N/A SER 56.A N VAL 30.A O no hydrogen 2.990 N/A PHE 58.A N ASP 32.A O no hydrogen 2.873 N/A ASP 59.A N TYR 83.A OH no hydrogen 2.854 N/A GLU 62.A N ASP 59.A O no hydrogen 3.001 N/A CYS 63.A N ASP 59.A O no hydrogen 2.934 N/A ARG 64.A NE GLU 61.A O no hydrogen 2.882 N/A ASP 65.A N MET 73.A O no hydrogen 2.899 N/A LYS 66.A NZ GLU 62.A OE1 no hydrogen 3.352 N/A LYS 66.A NZ GLU 62.A OE2 no hydrogen 3.161 N/A ALA 67.A N ASP 65.A OD1 no hydrogen 3.001 N/A SER 68.A N ASP 65.A OD1 no hydrogen 3.202 N/A TYR 70.A N SER 68.A OG no hydrogen 3.075 N/A LEU 74.A N ASP 271.A OD2 no hydrogen 2.943 N/A GLY 79.A N SER 76.A OG no hydrogen 2.893 N/A PHE 80.A N SER 76.A O no hydrogen 2.982 N/A ALA 81.A N GLU 77.A O no hydrogen 2.902 N/A ASP 82.A N ALA 78.A O no hydrogen 3.014 N/A TYR 83.A N GLY 79.A O no hydrogen 3.324 N/A VAL 84.A N PHE 80.A O no hydrogen 2.995 N/A GLY 85.A N ALA 81.A O no hydrogen 2.968 N/A SER 86.A N ASP 82.A O no hydrogen 3.188 N/A SER 86.A OG TYR 83.A O no hydrogen 2.564 N/A LEU 87.A N VAL 84.A O no hydrogen 3.180 N/A GLY 88.A N GLY 85.A O no hydrogen 3.013 N/A ILE 89.A N VAL 84.A O no hydrogen 3.291 N/A SER 90.A N THR 93.A OG1 no hydrogen 2.876 N/A ASN 91.A ND2 ILE 151.A O no hydrogen 3.640 N/A ASP 92.A N SER 90.A OG no hydrogen 3.058 N/A THR 93.A N SER 90.A O no hydrogen 3.170 N/A THR 93.A OG1 PRO 26.A O no hydrogen 2.733 N/A THR 93.A OG1 SER 90.A O no hydrogen 3.363 N/A HIS 94.A N GLY 27.A O no hydrogen 2.818 N/A HIS 94.A NE2 SER 124.A OG no hydrogen 3.025 N/A VAL 95.A N THR 122.A O no hydrogen 2.851 N/A VAL 96.A N ARG 29.A O no hydrogen 2.856 N/A VAL 97.A N SER 124.A O no hydrogen 2.813 N/A TYR 98.A N LEU 31.A O no hydrogen 2.962 N/A GLY 100.A N SER 34.A OG no hydrogen 2.894 N/A ASP 101.A N ASP 99.A OD1 no hydrogen 3.245 N/A LEU 103.A N ASP 101.A OD1 no hydrogen 3.401 N/A GLY 104.A N ASP 101.A O no hydrogen 2.950 N/A PHE 106.A N ASP 99.A OD1 no hydrogen 3.015 N/A PHE 106.A N ASP 99.A OD2 no hydrogen 3.137 N/A ALA 108.A N ASP 99.A OD2 no hydrogen 2.814 N/A ARG 110.A N TYR 107.A O no hydrogen 2.992 N/A ARG 110.A NH1 GLY 249.A O no hydrogen 2.988 N/A ARG 110.A NH1 ASP 271.A OD1 no hydrogen 2.824 N/A ARG 110.A NH2 ASP 271.A OD1 no hydrogen 3.104 N/A VAL 111.A N TYR 107.A O no hydrogen 3.398 N/A TRP 112.A N ALA 108.A O no hydrogen 3.014 N/A TRP 113.A N PRO 109.A O no hydrogen 2.906 N/A TRP 113.A NE1 LEU 160.A O no hydrogen 3.007 N/A MET 114.A N ARG 110.A O no hydrogen 2.748 N/A PHE 115.A N VAL 111.A O no hydrogen 3.000 N/A ARG 116.A N TRP 112.A O no hydrogen 3.252 N/A ARG 116.A NH2 PRO 265.A O no hydrogen 2.605 N/A VAL 117.A N TRP 113.A O no hydrogen 2.776 N/A PHE 118.A N MET 114.A O no hydrogen 3.061 N/A GLY 119.A N ARG 116.A O no hydrogen 2.879 N/A HIS 120.A N PHE 115.A O no hydrogen 2.824 N/A THR 122.A OG1 THR 93.A O no hydrogen 2.828 N/A VAL 123.A N ARG 121.A O no hydrogen 2.946 N/A SER 124.A N VAL 95.A O no hydrogen 2.905 N/A SER 124.A OG ARG 7.A O no hydrogen 2.677 N/A SER 124.A OG HIS 94.A NE2 no hydrogen 3.025 N/A VAL 125.A N ALA 8.A O no hydrogen 2.799 N/A LEU 126.A N VAL 97.A O no hydrogen 2.922 N/A ASN 127.A N VAL 10.A O no hydrogen 2.860 N/A GLY 129.A N LEU 126.A O no hydrogen 3.080 N/A PHE 130.A N ASP 99.A O no hydrogen 3.194 N/A ARG 131.A NH1 GLU 218.A O no hydrogen 3.190 N/A ARG 131.A NH2 GLU 218.A O no hydrogen 3.192 N/A ASN 132.A N GLY 128.A O no hydrogen 3.281 N/A ASN 132.A N GLY 129.A O no hydrogen 3.197 N/A TRP 133.A N GLY 129.A O no hydrogen 3.228 N/A TRP 133.A NE1 PRO 139.A O no hydrogen 2.896 N/A LEU 134.A N PHE 130.A O no hydrogen 3.092 N/A LYS 135.A N ARG 131.A O no hydrogen 3.096 N/A GLU 136.A N ASN 132.A O no hydrogen 2.942 N/A GLY 137.A N LEU 134.A O no hydrogen 3.215 N/A HIS 138.A N TRP 133.A O no hydrogen 3.287 N/A THR 141.A N HIS 51.A O no hydrogen 2.993 N/A SER 142.A OG GLU 143.A OE2 no hydrogen 3.371 N/A SER 145.A OG ALA 55.A O no hydrogen 2.769 N/A ALA 150.A N GLY 85.A O no hydrogen 2.911 N/A LYS 153.A NZ LYS 153.A O no hydrogen 2.956 N/A LYS 153.A NZ THR 155.A OG1 no hydrogen 2.849 N/A THR 155.A N PHE 118.A O no hydrogen 3.057 N/A LEU 156.A N GLU 77.A OE2 no hydrogen 3.040 N/A ASN 157.A N VAL 117.A O no hydrogen 2.730 N/A ARG 158.A NE ARG 158.A O no hydrogen 2.920 N/A ARG 158.A NH2 LEU 161.A O no hydrogen 2.776 N/A LEU 160.A N ASN 157.A O no hydrogen 3.069 N/A LEU 161.A N ARG 158.A O no hydrogen 3.371 N/A LYS 162.A N ILE 269.A O no hydrogen 3.057 N/A THR 163.A OG1 GLU 165.A OE1 no hydrogen 3.320 N/A GLN 166.A N THR 163.A O no hydrogen 3.151 N/A GLN 166.A NE2 THR 163.A OG1 no hydrogen 3.231 N/A VAL 167.A N THR 163.A O no hydrogen 3.129 N/A LEU 168.A N TYR 164.A O no hydrogen 2.853 N/A GLU 169.A N GLU 165.A O no hydrogen 2.947 N/A ASN 170.A N GLN 166.A O no hydrogen 2.960 N/A LEU 171.A N VAL 167.A O no hydrogen 3.317 N/A LEU 171.A N LEU 168.A O no hydrogen 3.368 N/A GLU 172.A N GLU 169.A O no hydrogen 3.093 N/A SER 173.A N ASN 170.A O no hydrogen 3.138 N/A SER 173.A OG GLU 169.A O no hydrogen 3.204 N/A LYS 174.A N ASN 170.A O no hydrogen 2.882 N/A LYS 174.A NZ LEU 171.A O no hydrogen 2.853 N/A ARG 175.A NH1 SER 173.A OG no hydrogen 3.190 N/A GLN 177.A N PRO 242.A O no hydrogen 2.934 N/A GLN 177.A NE2 ASP 238.A O no hydrogen 2.836 N/A GLN 177.A NE2 PRO 242.A O no hydrogen 2.872 N/A VAL 179.A N ILE 244.A O no hydrogen 2.902 N/A ASP 180.A N VAL 208.A O no hydrogen 2.865 N/A SER 181.A N THR 246.A O no hydrogen 3.061 N/A SER 181.A OG THR 251.A OG1 no hydrogen 2.896 N/A ARG 182.A N ASP 180.A OD1 no hydrogen 3.197 N/A ARG 182.A NE ASP 180.A OD1 no hydrogen 2.975 N/A ARG 182.A NE ASP 180.A OD2 no hydrogen 3.460 N/A ARG 182.A NH1 GLU 193.A OE2 no hydrogen 2.840 N/A ARG 182.A NH1 GLY 202.A O no hydrogen 3.086 N/A ARG 182.A NH2 ASP 180.A OD1 no hydrogen 3.517 N/A ARG 182.A NH2 ASP 180.A OD2 no hydrogen 2.827 N/A ARG 182.A NH2 GLY 202.A O no hydrogen 2.660 N/A ARG 186.A N ALA 183.A O no hydrogen 2.878 N/A ARG 186.A NE GLU 193.A OE1 no hydrogen 3.267 N/A ARG 186.A NE GLU 193.A OE2 no hydrogen 3.103 N/A ARG 186.A NH2 GLU 193.A OE1 no hydrogen 2.827 N/A TYR 187.A N ALA 183.A O no hydrogen 3.138 N/A TYR 187.A OH SER 207.A O no hydrogen 2.689 N/A LEU 188.A N GLN 184.A O no hydrogen 2.876 N/A GLY 189.A N ARG 186.A O no hydrogen 3.324 N/A THR 190.A N GLY 185.A O no hydrogen 3.074 N/A THR 190.A OG1 GLY 185.A O no hydrogen 3.230 N/A GLN 191.A N GLY 185.A O no hydrogen 3.057 N/A SER 201.A OG GLN 191.A O no hydrogen 2.627 N/A GLY 202.A N ARG 186.A O no hydrogen 3.096 N/A HIS 203.A N VAL 287.A O no hydrogen 2.901 N/A HIS 203.A ND1 TYR 187.A O no hydrogen 2.681 N/A ARG 205.A N THR 285.A O no hydrogen 2.817 N/A ARG 205.A NH1 GLU 284.A O no hydrogen 2.901 N/A SER 207.A N ILE 204.A O no hydrogen 3.043 N/A SER 207.A OG ILE 204.A O no hydrogen 2.646 N/A VAL 208.A N LEU 178.A O no hydrogen 2.870 N/A MET 210.A N ASP 180.A O no hydrogen 2.928 N/A PHE 212.A N SER 181.A O no hydrogen 2.880 N/A ASN 214.A N PRO 211.A O no hydrogen 3.276 N/A PHE 215.A N PHE 212.A O no hydrogen 3.061 N/A LEU 216.A N MET 213.A O no hydrogen 3.095 N/A THR 217.A N PHE 221.A O no hydrogen 2.809 N/A THR 217.A OG1 PHE 221.A O no hydrogen 3.335 N/A GLY 220.A N THR 217.A O no hydrogen 2.965 N/A PHE 221.A N THR 217.A OG1 no hydrogen 3.165 N/A GLU 222.A N ASN 127.A OD1 no hydrogen 2.925 N/A LYS 223.A N PHE 215.A O no hydrogen 2.876 N/A LYS 223.A NZ ASN 214.A O no hydrogen 2.789 N/A GLU 227.A N SER 224.A OG no hydrogen 3.204 N/A LEU 228.A N SER 224.A O no hydrogen 3.053 N/A ARG 229.A N PRO 225.A O no hydrogen 3.004 N/A ALA 230.A N GLU 226.A O no hydrogen 3.388 N/A MET 231.A N GLU 227.A O no hydrogen 2.990 N/A PHE 232.A N LEU 228.A O no hydrogen 3.145 N/A GLU 233.A N ARG 229.A O no hydrogen 3.000 N/A ALA 234.A N ALA 230.A O no hydrogen 2.839 N/A LYS 235.A N MET 231.A O no hydrogen 3.177 N/A LYS 235.A NZ ASN 209.A O no hydrogen 2.858 N/A LYS 236.A N GLU 233.A O no hydrogen 3.173 N/A VAL 237.A N PHE 232.A O no hydrogen 2.853 N/A ASP 238.A N GLN 177.A OE1 no hydrogen 2.841 N/A THR 240.A N ASP 238.A OD1 no hydrogen 3.161 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.798 N/A LYS 241.A N ASP 238.A O no hydrogen 3.274 N/A ILE 244.A N GLN 177.A O no hydrogen 2.788 N/A ALA 245.A N ALA 268.A O no hydrogen 2.861 N/A THR 246.A N VAL 179.A O no hydrogen 2.824 N/A THR 246.A OG1 SER 273.A OG no hydrogen 3.199 N/A ARG 247.A NE GLU 71.A OE1 no hydrogen 2.825 N/A ARG 247.A NH1 GLU 193.A OE1 no hydrogen 2.874 N/A ARG 247.A NH1 PRO 194.A O no hydrogen 2.814 N/A ARG 247.A NH2 GLU 71.A OE1 no hydrogen 3.544 N/A ARG 247.A NH2 GLU 71.A OE2 no hydrogen 3.132 N/A ARG 247.A NH2 PRO 194.A O no hydrogen 3.042 N/A ARG 247.A NH2 ASP 195.A O no hydrogen 3.479 N/A THR 251.A OG1 SER 181.A OG no hydrogen 2.896 N/A CYS 253.A N VAL 250.A O no hydrogen 3.095 N/A CYS 253.A SG GLY 249.A O no hydrogen 3.398 N/A HIS 254.A N THR 251.A O no hydrogen 3.059 N/A ILE 255.A N ALA 252.A O no hydrogen 3.050 N/A ALA 256.A N ALA 252.A O no hydrogen 3.357 N/A LEU 257.A N CYS 253.A O no hydrogen 2.854 N/A ALA 258.A N HIS 254.A O no hydrogen 2.873 N/A ALA 259.A N ILE 255.A O no hydrogen 2.956 N/A TYR 260.A N ALA 256.A O no hydrogen 2.948 N/A TYR 260.A OH TYR 6.A O no hydrogen 2.858 N/A LEU 261.A N LEU 257.A O no hydrogen 2.949 N/A CYS 262.A N ALA 258.A O no hydrogen 3.119 N/A CYS 262.A SG PRO 225.A O no hydrogen 3.899 N/A CYS 262.A SG ALA 258.A O no hydrogen 3.447 N/A GLY 263.A N TYR 260.A O no hydrogen 3.067 N/A LYS 264.A N ALA 259.A O no hydrogen 2.814 N/A LYS 264.A NZ LYS 241.A O no hydrogen 2.879 N/A LYS 264.A NZ ASP 266.A OD1 no hydrogen 3.212 N/A ALA 268.A N LEU 243.A O no hydrogen 3.082 N/A ILE 269.A N LEU 160.A O no hydrogen 3.042 N/A TYR 270.A N ALA 245.A O no hydrogen 2.880 N/A TYR 270.A OH GLU 276.A OE1 no hydrogen 2.948 N/A SER 273.A OG THR 246.A OG1 no hydrogen 3.199 N/A SER 273.A OG TYR 270.A O no hydrogen 2.799 N/A TRP 274.A NE1 ASP 200.A O no hydrogen 2.775 N/A PHE 275.A N ARG 247.A O no hydrogen 3.061 N/A GLU 276.A N GLY 272.A O no hydrogen 3.204 N/A TRP 277.A N SER 273.A O no hydrogen 2.942 N/A TRP 277.A NE1 THR 285.A OG1 no hydrogen 3.041 N/A PHE 278.A N TRP 274.A O no hydrogen 2.870 N/A HIS 279.A N PHE 275.A O no hydrogen 3.432 N/A HIS 279.A ND1 PHE 275.A O no hydrogen 2.881 N/A ARG 280.A N GLU 276.A O no hydrogen 3.015 N/A ARG 280.A N TRP 277.A O no hydrogen 3.209 N/A ARG 280.A NH1 GLU 276.A OE2 no hydrogen 2.956 N/A ARG 280.A NH2 GLU 165.A OE2 no hydrogen 3.030 N/A ALA 281.A N TRP 277.A O no hydrogen 2.818 N/A THR 285.A N PRO 282.A O no hydrogen 3.002 N/A THR 285.A OG1 PRO 282.A O no hydrogen 2.721 N/A VAL 287.A N HIS 203.A O no hydrogen 2.981 N/A SER 288.A OG GLY 189.A O no hydrogen 3.436 N/A SER 288.A OG SER 201.A O no hydrogen 3.149 N/A GLN 289.A N LEU 188.A O no hydrogen 2.823 N/A GLY 290.A N SER 288.A OG no hydrogen 3.332 N/A LYS 291.A N SER 288.A O no hydrogen 3.026 N/A