Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7xay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A N ILE 39.A O no hydrogen 2.912 N/A SER 6.A OG ILE 39.A O no hydrogen 3.456 N/A ALA 8.A N GLU 37.A O no hydrogen 2.979 N/A ASN 9.A ND2 GLU 37.A OE1 no hydrogen 2.398 N/A GLU 10.A N SER 7.A O no hydrogen 3.210 N/A ALA 11.A N SER 7.A O no hydrogen 2.790 N/A LEU 12.A N ALA 8.A O no hydrogen 3.097 N/A ARG 13.A N ILE 47.A O no hydrogen 2.904 N/A VAL 14.A N PHE 24.A O no hydrogen 2.887 N/A SER 15.A N LEU 49.A O no hydrogen 2.755 N/A ILE 16.A N VAL 22.A O no hydrogen 2.915 N/A VAL 17.A N PHE 51.A O no hydrogen 3.220 N/A GLY 18.A N ASN 20.A O no hydrogen 2.941 N/A VAL 22.A N ILE 16.A O no hydrogen 2.894 N/A PHE 24.A N VAL 14.A O no hydrogen 2.909 N/A LEU 27.A N LEU 152.A O no hydrogen 3.098 N/A PHE 28.A N LEU 152.A O no hydrogen 3.092 N/A THR 29.A N GLU 37.A OE2 no hydrogen 2.872 N/A THR 29.A OG1 ASN 9.A OD1 no hydrogen 2.732 N/A ILE 32.A N THR 29.A O no hydrogen 3.067 N/A TYR 33.A N THR 29.A O no hydrogen 3.060 N/A TYR 33.A OH VAL 76.A O no hydrogen 3.377 N/A GLY 34.A N TYR 30.A O no hydrogen 2.885 N/A GLU 37.A N GLY 34.A O no hydrogen 2.763 N/A LYS 38.A N SER 36.A OG no hydrogen 3.298 N/A ILE 39.A N SER 6.A O no hydrogen 2.873 N/A GLY 41.A N TRP 4.A O no hydrogen 2.704 N/A TYR 42.A OH VAL 74.A O no hydrogen 2.956 N/A LYS 43.A N ALA 66.A O no hydrogen 2.838 N/A ILE 46.A N LYS 63.A O no hydrogen 2.892 N/A ILE 47.A N ALA 11.A O no hydrogen 2.884 N/A HIS 48.A N ASN 61.A O no hydrogen 2.878 N/A LEU 49.A N ARG 13.A O no hydrogen 3.171 N/A ALA 50.A N TYR 59.A O no hydrogen 2.920 N/A PHE 51.A N SER 15.A O no hydrogen 2.801 N/A SER 53.A N VAL 17.A O no hydrogen 3.211 N/A SER 53.A OG VAL 17.A O no hydrogen 2.882 N/A SER 53.A OG GLU 179.A OE2 no hydrogen 3.092 N/A THR 55.A N ASP 52.A OD2 no hydrogen 2.720 N/A THR 55.A OG1 ASP 52.A OD2 no hydrogen 2.552 N/A PHE 56.A N ASP 52.A O no hydrogen 2.610 N/A LYS 57.A NZ ASP 88.A O no hydrogen 3.376 N/A LYS 57.A NZ ASP 88.A OD1 no hydrogen 2.827 N/A TYR 59.A N ALA 50.A O no hydrogen 2.873 N/A VAL 60.A N ILE 90.A O no hydrogen 2.958 N/A ASN 61.A N HIS 48.A O no hydrogen 2.925 N/A LYS 63.A N ILE 46.A O no hydrogen 2.897 N/A SER 65.A N LYS 43.A O no hydrogen 3.119 N/A SER 65.A OG LYS 43.A O no hydrogen 2.835 N/A LYS 67.A NZ TYR 42.A OH no hydrogen 3.040 N/A LEU 68.A N GLY 41.A O no hydrogen 2.975 N/A ILE 73.A N ASP 70.A O no hydrogen 3.268 N/A VAL 76.A N TYR 42.A OH no hydrogen 3.286 N/A LYS 78.A N ASP 75.A OD1 no hydrogen 3.404 N/A LYS 79.A N ASP 75.A O no hydrogen 2.962 N/A LYS 79.A NZ ILE 32.A O no hydrogen 3.272 N/A LEU 80.A N VAL 76.A O no hydrogen 2.935 N/A LEU 81.A N GLU 77.A O no hydrogen 2.872 N/A SER 82.A N LYS 78.A O no hydrogen 2.955 N/A SER 82.A N LYS 79.A O no hydrogen 3.195 N/A SER 82.A OG LYS 79.A O no hydrogen 2.457 N/A PHE 83.A N LEU 80.A O no hydrogen 3.060 N/A ASP 88.A N PRO 85.A O no hydrogen 3.145 N/A ILE 90.A N PRO 58.A O no hydrogen 3.213 N/A ARG 92.A N VAL 60.A O no hydrogen 2.826 N/A ARG 92.A NE ASN 61.A OD1 no hydrogen 3.297 N/A LYS 96.A N ASP 93.A OD1 no hydrogen 3.523 N/A TRP 97.A N ASP 93.A O no hydrogen 3.295 N/A TRP 97.A NE1 LYS 57.A O no hydrogen 2.750 N/A VAL 98.A N GLU 94.A O no hydrogen 2.900 N/A ASP 99.A N ALA 95.A O no hydrogen 2.930 N/A CYS 100.A N LYS 96.A O no hydrogen 2.905 N/A CYS 100.A SG GLU 104.A OE2 no hydrogen 3.819 N/A PHE 101.A N TRP 97.A O no hydrogen 2.971 N/A ALA 102.A N VAL 98.A O no hydrogen 2.881 N/A GLU 103.A N ASP 99.A O no hydrogen 2.960 N/A GLU 104.A N CYS 100.A O no hydrogen 2.918 N/A ARG 105.A N PHE 101.A O no hydrogen 2.920 N/A ARG 105.A NE ASP 52.A OD1 no hydrogen 2.912 N/A ARG 105.A NE ASP 52.A OD2 no hydrogen 3.411 N/A ARG 105.A NH2 ASP 52.A OD1 no hydrogen 2.620 N/A LYS 106.A NZ GLU 103.A OE1 no hydrogen 2.952 N/A THR 107.A N GLU 104.A O no hydrogen 3.135 N/A ASN 109.A ND2 ASN 109.A O no hydrogen 2.404 N/A SER 111.A OG ASP 112.A OD1 no hydrogen 2.866 N/A ASP 112.A N ASN 109.A O no hydrogen 3.298 N/A VAL 113.A N LEU 110.A O no hydrogen 3.144 N/A PHE 114.A N LEU 110.A O no hydrogen 3.474 N/A GLU 115.A N LYS 131.A O no hydrogen 3.222 N/A LYS 116.A NZ GLU 119.A OE2 no hydrogen 2.359 N/A VAL 117.A N VAL 129.A O no hydrogen 2.984 N/A TYR 120.A N PHE 127.A O no hydrogen 2.917 N/A TYR 120.A OH HIS 224.A ND1 no hydrogen 2.798 N/A LEU 122.A N GLU 125.A O no hydrogen 2.768 N/A PHE 127.A N TYR 120.A O no hydrogen 2.905 N/A VAL 128.A N LEU 173.A O no hydrogen 2.916 N/A VAL 129.A N SER 118.A O no hydrogen 2.982 N/A TYR 130.A N TRP 171.A O no hydrogen 2.906 N/A LYS 131.A N GLU 115.A O no hydrogen 3.013 N/A LYS 131.A NZ GLU 115.A OE1 no hydrogen 2.622 N/A SER 132.A N ILE 169.A O no hydrogen 2.889 N/A ALA 139.A N ASP 136.A OD2 no hydrogen 3.053 N/A ARG 140.A N ASP 136.A O no hydrogen 2.987 N/A ARG 140.A NE LEU 134.A O no hydrogen 3.048 N/A ARG 141.A N ASP 137.A O no hydrogen 2.913 N/A ARG 141.A NH1 GLU 104.A OE1 no hydrogen 3.286 N/A MET 142.A N PHE 138.A O no hydrogen 2.959 N/A HIS 143.A N ALA 139.A O no hydrogen 2.874 N/A ARG 144.A N ARG 140.A O no hydrogen 2.888 N/A ARG 144.A NE GLU 162.A OE1 no hydrogen 3.209 N/A ARG 144.A NH2 GLU 162.A OE1 no hydrogen 3.432 N/A ARG 145.A N ARG 141.A O no hydrogen 2.968 N/A ARG 145.A NE ASP 88.A OD2 no hydrogen 2.712 N/A ARG 145.A NH1 THR 55.A O no hydrogen 3.272 N/A ARG 145.A NH1 GLU 104.A OE1 no hydrogen 2.816 N/A ARG 145.A NH1 GLU 104.A OE2 no hydrogen 3.428 N/A ARG 145.A NH2 ASP 88.A OD1 no hydrogen 3.181 N/A ARG 145.A NH2 ASP 88.A OD2 no hydrogen 3.231 N/A ARG 145.A NH2 GLU 104.A OE2 no hydrogen 3.072 N/A VAL 146.A N MET 142.A O no hydrogen 2.956 N/A PHE 149.A N VAL 146.A O no hydrogen 3.454 N/A SER 150.A N GLN 147.A O no hydrogen 3.004 N/A SER 150.A OG GLN 212.A OE1 no hydrogen 3.068 N/A LEU 152.A N ILE 148.A O no hydrogen 2.935 N/A PHE 153.A N PHE 149.A O no hydrogen 2.904 N/A ILE 154.A N SER 150.A O no hydrogen 3.005 N/A ALA 156.A N TYR 30.A OH no hydrogen 3.189 N/A ALA 157.A N ILE 154.A O no hydrogen 3.124 N/A ASN 158.A ND2 TYR 159.A O no hydrogen 2.882 N/A TYR 159.A OH PHE 83.A O no hydrogen 3.169 N/A THR 163.A N ASP 161.A OD1 no hydrogen 2.988 N/A THR 163.A OG1 ASP 161.A OD1 no hydrogen 2.961 N/A THR 163.A OG1 ASP 161.A OD2 no hydrogen 3.220 N/A SER 166.A N ASP 164.A OD1 no hydrogen 2.905 N/A SER 166.A OG ASP 164.A OD1 no hydrogen 3.563 N/A GLN 168.A N THR 186.A O no hydrogen 2.930 N/A ILE 169.A N SER 132.A O no hydrogen 2.999 N/A TYR 170.A N VAL 184.A O no hydrogen 2.883 N/A TRP 171.A N TYR 130.A O no hydrogen 2.908 N/A TRP 171.A NE1 SER 132.A OG no hydrogen 2.846 N/A LEU 172.A N GLY 182.A O no hydrogen 2.885 N/A LEU 173.A N VAL 128.A O no hydrogen 2.925 N/A ASN 174.A N GLU 179.A O no hydrogen 2.981 N/A ASN 174.A ND2 GLU 125.A OE2 no hydrogen 2.877 N/A LYS 175.A N GLU 126.A O no hydrogen 3.121 N/A LYS 175.A NZ GLU 119.A OE1 no hydrogen 2.687 N/A LYS 175.A NZ GLU 119.A OE2 no hydrogen 3.332 N/A LYS 175.A NZ GLU 126.A OE2 no hydrogen 3.562 N/A LYS 176.A N ASN 174.A OD1 no hydrogen 3.081 N/A THR 177.A N ASN 174.A OD1 no hydrogen 3.164 N/A LYS 178.A N ASN 174.A O no hydrogen 2.752 N/A LYS 178.A NZ LYS 175.A O no hydrogen 2.515 N/A GLU 179.A N THR 177.A OG1 no hydrogen 3.177 N/A LEU 180.A N SER 53.A O no hydrogen 3.190 N/A ILE 181.A N LEU 172.A O no hydrogen 2.530 N/A GLY 182.A N LEU 172.A O no hydrogen 3.004 N/A PHE 183.A N LEU 214.A O no hydrogen 2.925 N/A VAL 184.A N TYR 170.A O no hydrogen 2.891 N/A THR 185.A N GLN 212.A O no hydrogen 2.846 N/A THR 185.A OG1 GLN 212.A OE1 no hydrogen 3.197 N/A THR 186.A N GLN 168.A O no hydrogen 2.904 N/A THR 186.A OG1 GLN 168.A O no hydrogen 3.518 N/A TYR 187.A N LYS 209.A O no hydrogen 2.872 N/A TYR 187.A OH ASP 164.A OD2 no hydrogen 2.759 N/A TYR 189.A N ARG 207.A O no hydrogen 2.828 N/A HIS 191.A N LYS 205.A O no hydrogen 3.005 N/A HIS 191.A ND1 THR 243.A OG1 no hydrogen 2.499 N/A SER 197.A OG LEU 193.A O no hydrogen 3.478 N/A PHE 198.A N GLY 194.A O no hydrogen 3.113 N/A ASP 199.A N ALA 195.A O no hydrogen 2.889 N/A ASP 199.A N LYS 196.A O no hydrogen 3.102 N/A GLU 200.A N LYS 196.A O no hydrogen 2.927 N/A GLU 200.A N SER 197.A O no hydrogen 3.306 N/A LYS 205.A NZ ASP 201.A OD2 no hydrogen 2.965 N/A LYS 205.A NZ ASP 203.A O no hydrogen 3.035 N/A PHE 206.A N SER 241.A O no hydrogen 2.772 N/A ARG 207.A N TYR 189.A O no hydrogen 2.675 N/A ARG 207.A NE GLU 244.A OE1 no hydrogen 2.946 N/A ALA 208.A N GLU 244.A O no hydrogen 2.949 N/A LYS 209.A N TYR 187.A O no hydrogen 2.783 N/A LYS 209.A NZ TYR 189.A OH no hydrogen 3.311 N/A LYS 209.A NZ GLU 248.A OE1 no hydrogen 3.416 N/A ILE 210.A N THR 246.A O no hydrogen 2.886 N/A SER 211.A N THR 185.A O no hydrogen 2.942 N/A SER 211.A OG GLU 248.A OE1 no hydrogen 2.923 N/A GLN 212.A N THR 185.A O no hydrogen 2.953 N/A GLN 212.A NE2 ASN 158.A O no hydrogen 3.099 N/A LEU 214.A N PHE 183.A O no hydrogen 2.937 N/A PHE 216.A N ILE 181.A O no hydrogen 3.275 N/A TYR 219.A N PHE 216.A O no hydrogen 2.925 N/A GLN 220.A N PRO 217.A O no hydrogen 3.137 N/A GLN 220.A NE2 ILE 215.A O no hydrogen 2.699 N/A HIS 224.A ND1 TYR 120.A OH no hydrogen 2.798 N/A SER 226.A OG ASN 261.A OD1 no hydrogen 2.965 N/A CYS 227.A N GLY 223.A O no hydrogen 3.304 N/A CYS 227.A SG GLY 223.A O no hydrogen 3.310 N/A LEU 228.A N HIS 224.A O no hydrogen 2.873 N/A TYR 229.A N GLY 225.A O no hydrogen 2.926 N/A TYR 229.A OH ASP 262.A OD1 no hydrogen 3.055 N/A TYR 229.A OH ASP 262.A OD2 no hydrogen 3.378 N/A GLU 230.A N SER 226.A O no hydrogen 2.907 N/A ALA 231.A N CYS 227.A O no hydrogen 2.880 N/A ILE 232.A N LEU 228.A O no hydrogen 2.959 N/A ILE 233.A N TYR 229.A O no hydrogen 2.911 N/A GLN 234.A N GLU 230.A O no hydrogen 2.858 N/A SER 235.A N ALA 231.A O no hydrogen 2.948 N/A SER 235.A OG ILE 232.A O no hydrogen 2.877 N/A TRP 236.A N ILE 232.A O no hydrogen 2.941 N/A LEU 237.A N ILE 233.A O no hydrogen 2.854 N/A GLU 238.A N GLN 234.A O no hydrogen 2.941 N/A ASP 239.A N TRP 236.A O no hydrogen 3.298 N/A SER 241.A N ASP 239.A OD1 no hydrogen 3.198 N/A SER 241.A OG ASP 239.A OD1 no hydrogen 3.309 N/A SER 241.A OG ASP 239.A OD2 no hydrogen 2.963 N/A THR 243.A N PHE 206.A O no hydrogen 2.906 N/A THR 243.A OG1 HIS 191.A ND1 no hydrogen 2.499 N/A THR 243.A OG1 PHE 206.A O no hydrogen 3.284 N/A ILE 245.A N LYS 294.A O no hydrogen 2.844 N/A THR 246.A N ALA 208.A O no hydrogen 2.785 N/A THR 246.A OG1 ALA 208.A O no hydrogen 3.024 N/A GLU 248.A N ILE 210.A O no hydrogen 3.085 N/A PHE 254.A N ASN 251.A OD1 no hydrogen 3.415 N/A ASP 255.A N ASN 251.A O no hydrogen 2.822 N/A ASP 256.A N GLU 252.A O no hydrogen 2.885 N/A LEU 257.A N ALA 253.A O no hydrogen 2.985 N/A ARG 258.A N PHE 254.A O no hydrogen 2.859 N/A ASP 259.A N ASP 255.A O no hydrogen 2.938 N/A ARG 260.A N ASP 256.A O no hydrogen 2.871 N/A ARG 260.A NH1 GLN 264.A OE1 no hydrogen 2.299 N/A ASN 261.A N LEU 257.A O no hydrogen 3.021 N/A ASP 262.A N ARG 258.A O no hydrogen 2.872 N/A ILE 263.A N ASP 259.A O no hydrogen 2.906 N/A GLN 264.A N ARG 260.A O no hydrogen 2.967 N/A ARG 265.A N ASN 261.A O no hydrogen 2.911 N/A ARG 265.A NH2 ASP 262.A OD1 no hydrogen 2.544 N/A LEU 266.A N ASP 262.A O no hydrogen 2.903 N/A ARG 267.A N ILE 263.A O no hydrogen 2.893 N/A LYS 268.A N GLN 264.A O no hydrogen 2.975 N/A LEU 269.A N ARG 265.A O no hydrogen 3.298 N/A LEU 269.A N LEU 266.A O no hydrogen 3.287 N/A GLY 270.A N ARG 267.A O no hydrogen 3.015 N/A TYR 271.A N LEU 266.A O no hydrogen 3.146 N/A VAL 274.A N GLY 270.A O no hydrogen 3.272 N/A PHE 275.A N TYR 271.A O no hydrogen 2.899 N/A GLN 276.A N ASP 272.A O no hydrogen 2.935 N/A GLN 276.A NE2 LEU 307.A O no hydrogen 3.285 N/A GLN 276.A NE2 LEU 310.A O no hydrogen 2.973 N/A LYS 277.A N ALA 273.A O no hydrogen 2.905 N/A HIS 278.A N VAL 274.A O no hydrogen 3.182 N/A HIS 278.A ND1 VAL 274.A O no hydrogen 3.185 N/A LEU 286.A N SER 282.A O no hydrogen 2.985 N/A GLU 287.A N ASP 283.A O no hydrogen 2.882 N/A SER 288.A N GLU 284.A O no hydrogen 2.885 N/A SER 289.A N PHE 285.A O no hydrogen 2.920 N/A SER 289.A OG PHE 285.A O no hydrogen 2.992 N/A ARG 290.A N LEU 286.A O no hydrogen 2.887 N/A ARG 290.A NE GLU 287.A OE1 no hydrogen 2.933 N/A ARG 290.A NH1 GLU 244.A OE2 no hydrogen 3.371 N/A ARG 290.A NH1 LEU 295.A O no hydrogen 3.461 N/A LYS 291.A N GLU 287.A O no hydrogen 2.932 N/A SER 292.A N SER 288.A O no hydrogen 2.876 N/A LEU 293.A N SER 289.A O no hydrogen 2.932 N/A LYS 294.A N LYS 291.A O no hydrogen 3.221 N/A LYS 294.A NZ TRP 236.A O no hydrogen 2.913 N/A LYS 294.A NZ LEU 237.A O no hydrogen 3.232 N/A LYS 294.A NZ ILE 242.A O no hydrogen 2.916 N/A ARG 298.A N GLU 296.A OE2 no hydrogen 3.192 N/A GLN 299.A N GLU 296.A OE1 no hydrogen 3.055 N/A GLN 299.A NE2 ASP 259.A OD1 no hydrogen 3.151 N/A GLN 299.A NE2 ASP 262.A OD2 no hydrogen 3.179 N/A PHE 300.A N GLU 296.A O no hydrogen 2.835 N/A ASN 301.A N GLU 297.A O no hydrogen 2.949 N/A ARG 302.A N ARG 298.A O no hydrogen 2.973 N/A ARG 302.A NH1 ASP 259.A OD1 no hydrogen 3.145 N/A ARG 302.A NH1 ASP 259.A OD2 no hydrogen 2.902 N/A ARG 302.A NH1 GLN 299.A OE1 no hydrogen 3.164 N/A ARG 302.A NH2 ASP 259.A OD2 no hydrogen 2.957 N/A LEU 303.A N GLN 299.A O no hydrogen 2.888 N/A VAL 304.A N PHE 300.A O no hydrogen 2.906 N/A GLU 305.A N ASN 301.A O no hydrogen 3.014 N/A MET 306.A N ARG 302.A O no hydrogen 2.907 N/A MET 306.A N LEU 303.A O no hydrogen 3.238 N/A LEU 307.A N LEU 303.A O no hydrogen 2.864 N/A LEU 308.A N VAL 304.A O no hydrogen 2.996 N/A LEU 309.A N MET 306.A O no hydrogen 2.784 N/A