Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bob_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N LYS 2.A O no hydrogen 3.335 N/A THR 5.A OG1 LYS 2.A O no hydrogen 2.680 N/A TRP 6.A N PRO 3.A O no hydrogen 3.265 N/A THR 7.A N GLU 4.A O no hydrogen 3.340 N/A THR 7.A OG1 PRO 3.A O no hydrogen 2.913 N/A SER 8.A N ILE 41.A O no hydrogen 2.903 N/A SER 8.A OG ILE 41.A O no hydrogen 3.552 N/A ALA 10.A N GLU 39.A O no hydrogen 2.929 N/A ASN 11.A ND2 GLU 39.A OE1 no hydrogen 3.100 N/A GLU 12.A N SER 9.A O no hydrogen 3.122 N/A ALA 13.A N SER 9.A O no hydrogen 2.942 N/A LEU 14.A N ALA 10.A O no hydrogen 3.069 N/A ARG 15.A N ILE 49.A O no hydrogen 2.816 N/A VAL 16.A N PHE 26.A O no hydrogen 2.923 N/A SER 17.A N LEU 51.A O no hydrogen 2.901 N/A ILE 18.A N VAL 24.A O no hydrogen 3.165 N/A VAL 19.A N PHE 53.A O no hydrogen 2.753 N/A GLY 20.A N ASN 22.A O no hydrogen 3.516 N/A VAL 24.A N ILE 18.A O no hydrogen 3.181 N/A PHE 26.A N VAL 16.A O no hydrogen 2.737 N/A LEU 29.A N LEU 154.A O no hydrogen 2.846 N/A PHE 30.A N LEU 154.A O no hydrogen 2.786 N/A THR 31.A N GLU 39.A OE2 no hydrogen 2.891 N/A THR 31.A OG1 ASN 11.A OD1 no hydrogen 3.320 N/A TYR 32.A N GLU 39.A OE2 no hydrogen 3.137 N/A ILE 34.A N THR 31.A O no hydrogen 2.923 N/A TYR 35.A N THR 31.A O no hydrogen 2.856 N/A TYR 35.A OH VAL 78.A O no hydrogen 2.813 N/A GLU 39.A N GLY 36.A O no hydrogen 2.846 N/A ILE 41.A N SER 8.A O no hydrogen 2.780 N/A GLY 43.A N TRP 6.A O no hydrogen 2.699 N/A TYR 44.A N TRP 6.A O no hydrogen 3.419 N/A TYR 44.A OH VAL 76.A O no hydrogen 2.684 N/A LYS 45.A N ALA 68.A O no hydrogen 3.030 N/A LYS 45.A NZ ASP 46.A OD1 no hydrogen 3.368 N/A LYS 45.A NZ ASP 46.A OD2 no hydrogen 3.182 N/A ILE 48.A N LYS 65.A O no hydrogen 2.914 N/A ILE 49.A N ALA 13.A O no hydrogen 2.907 N/A HIS 50.A N ASN 63.A O no hydrogen 2.907 N/A LEU 51.A N ARG 15.A O no hydrogen 2.892 N/A ALA 52.A N TYR 61.A O no hydrogen 2.949 N/A PHE 53.A N SER 17.A O no hydrogen 2.938 N/A ASP 54.A N LYS 59.A O no hydrogen 3.377 N/A SER 55.A N VAL 19.A O no hydrogen 2.824 N/A SER 55.A OG VAL 19.A O no hydrogen 3.365 N/A SER 55.A OG GLU 181.A OE2 no hydrogen 2.929 N/A THR 57.A N ASP 54.A OD2 no hydrogen 2.937 N/A THR 57.A OG1 ASP 54.A OD2 no hydrogen 2.762 N/A PHE 58.A N ASP 54.A O no hydrogen 2.844 N/A LYS 59.A NZ ASP 90.A O no hydrogen 2.773 N/A LYS 59.A NZ ASP 90.A OD1 no hydrogen 2.958 N/A TYR 61.A N ALA 52.A O no hydrogen 2.883 N/A TYR 61.A OH ARG 94.A O no hydrogen 3.152 N/A VAL 62.A N ILE 92.A O no hydrogen 3.032 N/A ASN 63.A N HIS 50.A O no hydrogen 3.064 N/A LYS 65.A N ILE 48.A O no hydrogen 2.872 N/A SER 67.A N LYS 45.A O no hydrogen 2.864 N/A SER 67.A OG LYS 45.A O no hydrogen 3.009 N/A LYS 69.A NZ TYR 44.A OH no hydrogen 3.395 N/A LEU 70.A N GLY 43.A O no hydrogen 2.917 N/A VAL 78.A N TYR 44.A OH no hydrogen 3.218 N/A LYS 80.A N ASP 77.A OD1 no hydrogen 3.276 N/A LYS 81.A N ASP 77.A O no hydrogen 3.006 N/A LEU 82.A N VAL 78.A O no hydrogen 3.290 N/A LEU 83.A N GLU 79.A O no hydrogen 3.000 N/A SER 84.A N LYS 80.A O no hydrogen 3.018 N/A SER 84.A N LYS 81.A O no hydrogen 3.197 N/A SER 84.A OG LYS 81.A O no hydrogen 2.566 N/A PHE 85.A N LEU 82.A O no hydrogen 3.111 N/A LEU 86.A N LEU 83.A O no hydrogen 2.985 N/A ASP 90.A N PRO 87.A O no hydrogen 3.235 N/A ILE 92.A N PRO 60.A O no hydrogen 3.226 N/A ARG 94.A N VAL 62.A O no hydrogen 2.951 N/A ASP 95.A N VAL 93.A O no hydrogen 2.609 N/A TRP 99.A N ASP 95.A O no hydrogen 3.201 N/A TRP 99.A NE1 LYS 59.A O no hydrogen 2.904 N/A VAL 100.A N GLU 96.A O no hydrogen 3.183 N/A ASP 101.A N ALA 97.A O no hydrogen 3.183 N/A CYS 102.A N LYS 98.A O no hydrogen 2.938 N/A PHE 103.A N TRP 99.A O no hydrogen 3.050 N/A ALA 104.A N VAL 100.A O no hydrogen 2.921 N/A GLU 105.A N ASP 101.A O no hydrogen 3.076 N/A GLU 106.A N CYS 102.A O no hydrogen 2.921 N/A ARG 107.A N PHE 103.A O no hydrogen 2.865 N/A ARG 107.A NE ASP 54.A OD2 no hydrogen 3.223 N/A LYS 108.A N GLU 105.A O no hydrogen 3.153 N/A HIS 110.A N GLU 106.A O no hydrogen 3.144 N/A SER 113.A OG TYR 132.A OH no hydrogen 3.081 N/A PHE 116.A N LEU 112.A O no hydrogen 2.989 N/A GLU 117.A N LYS 133.A O no hydrogen 3.256 N/A LYS 118.A NZ GLU 121.A OE2 no hydrogen 2.961 N/A VAL 119.A N VAL 131.A O no hydrogen 2.673 N/A SER 120.A N VAL 131.A O no hydrogen 3.411 N/A SER 120.A OG GLU 121.A O no hydrogen 3.557 N/A TYR 122.A N PHE 129.A O no hydrogen 3.087 N/A TYR 122.A OH HIS 217.A ND1 no hydrogen 2.817 N/A LEU 124.A N GLU 127.A O no hydrogen 3.216 N/A PHE 129.A N TYR 122.A O no hydrogen 2.776 N/A VAL 130.A N LEU 175.A O no hydrogen 2.868 N/A VAL 131.A N SER 120.A O no hydrogen 2.963 N/A TYR 132.A N TRP 173.A O no hydrogen 2.920 N/A LYS 133.A N GLU 117.A O no hydrogen 2.959 N/A SER 134.A N ILE 171.A O no hydrogen 2.924 N/A SER 134.A OG SER 135.A O no hydrogen 3.074 N/A VAL 137.A N SER 135.A OG no hydrogen 3.154 N/A ARG 142.A N ASP 138.A O no hydrogen 3.170 N/A ARG 142.A NE LEU 136.A O no hydrogen 2.625 N/A ARG 142.A NH2 GLU 164.A O no hydrogen 3.422 N/A ARG 143.A N ASP 139.A O no hydrogen 2.980 N/A MET 144.A N PHE 140.A O no hydrogen 3.061 N/A HIS 145.A N ALA 141.A O no hydrogen 2.859 N/A ARG 146.A N ARG 142.A O no hydrogen 3.119 N/A ARG 146.A NE ARG 142.A O no hydrogen 3.272 N/A ARG 147.A N MET 144.A O no hydrogen 3.055 N/A ARG 147.A NE ASP 90.A OD2 no hydrogen 2.859 N/A ARG 147.A NH1 THR 57.A O no hydrogen 2.962 N/A ARG 147.A NH1 GLU 106.A OE1 no hydrogen 3.474 N/A ARG 147.A NH2 ASP 90.A OD1 no hydrogen 3.160 N/A ARG 147.A NH2 GLU 106.A OE1 no hydrogen 3.231 N/A VAL 148.A N MET 144.A O no hydrogen 3.078 N/A GLN 149.A N HIS 145.A O no hydrogen 2.842 N/A PHE 151.A N VAL 148.A O no hydrogen 2.888 N/A SER 152.A N GLN 149.A O no hydrogen 3.105 N/A LEU 154.A N ILE 150.A O no hydrogen 3.075 N/A PHE 155.A N PHE 151.A O no hydrogen 2.882 N/A ILE 156.A N SER 152.A O no hydrogen 2.736 N/A ALA 158.A N TYR 32.A OH no hydrogen 3.088 N/A ALA 159.A N ILE 156.A O no hydrogen 3.335 N/A TYR 161.A OH PHE 85.A O no hydrogen 2.830 N/A THR 165.A N ASP 163.A OD1 no hydrogen 2.853 N/A THR 165.A OG1 ASP 163.A OD1 no hydrogen 2.516 N/A ASP 166.A N ASP 163.A O no hydrogen 3.230 N/A SER 168.A N ASP 166.A OD1 no hydrogen 3.126 N/A SER 168.A OG ASP 166.A OD1 no hydrogen 3.566 N/A SER 168.A OG LYS 190.A O no hydrogen 3.267 N/A TRP 169.A N ASP 166.A O no hydrogen 3.326 N/A GLN 170.A N THR 188.A O no hydrogen 3.123 N/A ILE 171.A N SER 134.A O no hydrogen 2.824 N/A TYR 172.A N VAL 186.A O no hydrogen 2.839 N/A TYR 172.A OH GLN 170.A OE1 no hydrogen 3.131 N/A TRP 173.A N TYR 132.A O no hydrogen 2.710 N/A TRP 173.A NE1 SER 134.A OG no hydrogen 2.968 N/A LEU 174.A N GLY 184.A O no hydrogen 3.085 N/A LEU 175.A N VAL 130.A O no hydrogen 2.946 N/A ASN 176.A N GLU 181.A O no hydrogen 2.997 N/A ASN 176.A ND2 GLU 127.A OE2 no hydrogen 3.113 N/A LYS 177.A N GLU 128.A O no hydrogen 3.000 N/A LYS 177.A NZ GLU 121.A OE1 no hydrogen 3.136 N/A LYS 177.A NZ GLU 121.A OE2 no hydrogen 3.372 N/A LYS 177.A NZ GLU 128.A OE2 no hydrogen 3.514 N/A THR 179.A N ASN 176.A OD1 no hydrogen 2.956 N/A THR 179.A OG1 GLU 181.A OE1 no hydrogen 3.004 N/A LYS 180.A N ASN 176.A O no hydrogen 2.797 N/A LEU 182.A N SER 55.A O no hydrogen 3.069 N/A ILE 183.A N LEU 174.A O no hydrogen 2.704 N/A GLY 184.A N LEU 174.A O no hydrogen 3.365 N/A PHE 185.A N LEU 207.A O no hydrogen 2.852 N/A VAL 186.A N TYR 172.A O no hydrogen 2.904 N/A THR 187.A N GLN 205.A O no hydrogen 2.870 N/A THR 188.A N GLN 170.A O no hydrogen 2.844 N/A THR 188.A OG1 GLN 170.A O no hydrogen 2.833 N/A TYR 189.A N LYS 202.A O no hydrogen 2.863 N/A TYR 189.A OH ASP 166.A OD1 no hydrogen 3.390 N/A TYR 189.A OH ASP 166.A OD2 no hydrogen 2.864 N/A LYS 190.A N SER 168.A O no hydrogen 3.198 N/A TYR 191.A N ARG 200.A O no hydrogen 3.093 N/A LYS 198.A NZ LYS 233.A O no hydrogen 2.799 N/A PHE 199.A N SER 234.A O no hydrogen 2.884 N/A ARG 200.A N TYR 191.A O no hydrogen 2.808 N/A ALA 201.A N GLU 237.A O no hydrogen 2.880 N/A LYS 202.A N TYR 189.A O no hydrogen 3.072 N/A LYS 202.A NZ GLU 241.A OE2 no hydrogen 3.249 N/A ILE 203.A N THR 239.A O no hydrogen 3.087 N/A SER 204.A N THR 187.A O no hydrogen 3.012 N/A GLN 205.A N THR 187.A O no hydrogen 3.347 N/A GLN 205.A NE2 THR 187.A OG1 no hydrogen 2.939 N/A LEU 207.A N PHE 185.A O no hydrogen 2.979 N/A PHE 209.A N ILE 183.A O no hydrogen 3.056 N/A TYR 212.A N PHE 209.A O no hydrogen 2.921 N/A GLN 213.A NE2 ILE 208.A O no hydrogen 2.811 N/A HIS 217.A ND1 TYR 122.A OH no hydrogen 2.817 N/A CYS 220.A N GLY 216.A O no hydrogen 3.120 N/A CYS 220.A SG GLY 216.A O no hydrogen 3.416 N/A LEU 221.A N HIS 217.A O no hydrogen 2.656 N/A TYR 222.A N GLY 218.A O no hydrogen 2.946 N/A TYR 222.A OH ASP 255.A OD1 no hydrogen 2.895 N/A GLU 223.A N SER 219.A O no hydrogen 2.905 N/A ALA 224.A N CYS 220.A O no hydrogen 2.911 N/A ILE 225.A N LEU 221.A O no hydrogen 3.168 N/A ILE 226.A N TYR 222.A O no hydrogen 2.949 N/A GLN 227.A N GLU 223.A O no hydrogen 2.915 N/A GLN 227.A NE2 GLU 231.A OE2 no hydrogen 3.490 N/A SER 228.A N ALA 224.A O no hydrogen 3.049 N/A TRP 229.A N ILE 225.A O no hydrogen 2.893 N/A TRP 229.A NE1 TYR 172.A OH no hydrogen 2.967 N/A LEU 230.A N ILE 226.A O no hydrogen 2.799 N/A GLU 231.A N GLN 227.A O no hydrogen 3.199 N/A ASP 232.A N SER 228.A O no hydrogen 3.211 N/A ASP 232.A N TRP 229.A O no hydrogen 3.279 N/A SER 234.A N ASP 232.A OD1 no hydrogen 3.268 N/A SER 234.A OG ASP 232.A OD1 no hydrogen 2.789 N/A SER 234.A OG ASP 232.A OD2 no hydrogen 3.050 N/A ILE 235.A N ASP 232.A O no hydrogen 3.048 N/A THR 236.A N PHE 199.A O no hydrogen 2.727 N/A ILE 238.A N LYS 287.A O no hydrogen 2.729 N/A THR 239.A N ALA 201.A O no hydrogen 2.962 N/A THR 239.A OG1 GLU 289.A OE1 no hydrogen 2.860 N/A GLU 241.A N ILE 203.A O no hydrogen 2.943 N/A PHE 247.A N ASN 244.A OD1 no hydrogen 2.835 N/A ASP 248.A N ASN 244.A O no hydrogen 2.812 N/A ASP 249.A N GLU 245.A O no hydrogen 3.101 N/A LEU 250.A N ALA 246.A O no hydrogen 3.250 N/A ARG 251.A N PHE 247.A O no hydrogen 2.762 N/A ARG 251.A NH2 GLU 289.A OE2 no hydrogen 2.986 N/A ASP 252.A N ASP 248.A O no hydrogen 2.932 N/A ARG 253.A N ASP 249.A O no hydrogen 3.110 N/A ARG 253.A NH2 SER 219.A OG no hydrogen 2.847 N/A ASN 254.A N LEU 250.A O no hydrogen 3.138 N/A ASN 254.A ND2 GLU 223.A OE1 no hydrogen 3.526 N/A ASP 255.A N ARG 251.A O no hydrogen 2.952 N/A ILE 256.A N ASP 252.A O no hydrogen 2.935 N/A GLN 257.A N ARG 253.A O no hydrogen 3.293 N/A ARG 258.A N ASN 254.A O no hydrogen 3.096 N/A ARG 258.A N ASP 255.A O no hydrogen 3.123 N/A ARG 258.A NE GLU 223.A OE2 no hydrogen 3.021 N/A ARG 258.A NH1 ASP 255.A OD1 no hydrogen 2.887 N/A ARG 258.A NH2 GLU 223.A OE1 no hydrogen 3.207 N/A ARG 258.A NH2 ASP 255.A OD1 no hydrogen 2.870 N/A LEU 259.A N ASP 255.A O no hydrogen 3.023 N/A ARG 260.A N ILE 256.A O no hydrogen 2.979 N/A LYS 261.A N GLN 257.A O no hydrogen 3.307 N/A LEU 262.A N LEU 259.A O no hydrogen 3.175 N/A GLY 263.A N ARG 260.A O no hydrogen 2.851 N/A TYR 264.A N LEU 259.A O no hydrogen 3.062 N/A ALA 266.A N GLY 263.A O no hydrogen 3.072 N/A PHE 268.A N TYR 264.A O no hydrogen 3.120 N/A GLN 269.A N ALA 266.A O no hydrogen 2.958 N/A GLN 269.A NE2 ASN 304.A O no hydrogen 3.160 N/A SER 272.A N LYS 270.A O no hydrogen 2.770 N/A PHE 278.A N SER 275.A O no hydrogen 3.216 N/A LEU 279.A N SER 275.A O no hydrogen 2.988 N/A GLU 280.A N ASP 276.A O no hydrogen 2.904 N/A SER 281.A N GLU 277.A O no hydrogen 3.132 N/A SER 281.A OG GLU 277.A O no hydrogen 3.194 N/A SER 281.A OG PHE 278.A O no hydrogen 2.831 N/A SER 282.A N PHE 278.A O no hydrogen 3.032 N/A SER 282.A OG PHE 278.A O no hydrogen 3.101 N/A SER 282.A OG LEU 279.A O no hydrogen 3.218 N/A ARG 283.A N LEU 279.A O no hydrogen 3.041 N/A ARG 283.A NE GLU 280.A OE1 no hydrogen 3.466 N/A ARG 283.A NH2 GLU 280.A OE1 no hydrogen 3.093 N/A ARG 283.A NH2 GLU 280.A OE2 no hydrogen 3.361 N/A LYS 284.A N GLU 280.A O no hydrogen 2.937 N/A SER 285.A N SER 281.A O no hydrogen 3.083 N/A SER 285.A OG SER 281.A O no hydrogen 2.757 N/A LEU 286.A N SER 282.A O no hydrogen 2.991 N/A LYS 287.A N LYS 284.A O no hydrogen 3.220 N/A LYS 287.A NZ TRP 229.A O no hydrogen 3.056 N/A LYS 287.A NZ LEU 230.A O no hydrogen 2.994 N/A LYS 287.A NZ ILE 235.A O no hydrogen 2.812 N/A GLN 292.A NE2 ASP 252.A OD1 no hydrogen 3.112 N/A GLN 292.A NE2 ASP 255.A OD2 no hydrogen 2.894 N/A PHE 293.A N GLU 289.A O no hydrogen 2.828 N/A ASN 294.A N GLU 290.A O no hydrogen 2.905 N/A ARG 295.A N ARG 291.A O no hydrogen 3.207 N/A ARG 295.A NH1 ASP 252.A OD1 no hydrogen 2.975 N/A ARG 295.A NH1 ASP 252.A OD2 no hydrogen 3.388 N/A ARG 295.A NH1 GLN 292.A OE1 no hydrogen 3.078 N/A ARG 295.A NH2 ASP 252.A OD2 no hydrogen 3.045 N/A LEU 296.A N GLN 292.A O no hydrogen 2.869 N/A VAL 297.A N PHE 293.A O no hydrogen 2.806 N/A GLU 298.A N ASN 294.A O no hydrogen 3.171 N/A MET 299.A N ARG 295.A O no hydrogen 3.003 N/A LEU 300.A N LEU 296.A O no hydrogen 2.935 N/A LEU 301.A N GLU 298.A O no hydrogen 3.114 N/A LEU 302.A N GLU 298.A O no hydrogen 3.403 N/A ASN 304.A ND2 PHE 268.A O no hydrogen 3.146 N/A ASN 304.A ND2 ASN 304.A O no hydrogen 3.020 N/A