Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fux_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLN 7.A O no hydrogen 2.795 N/A GLN 7.A N VAL 4.A O no hydrogen 2.869 N/A PHE 9.A N GLU 2.A O no hydrogen 2.792 N/A ASP 10.A N TYR 92.A OH no hydrogen 3.247 N/A ARG 14.A NE ASP 34.A OD1 no hydrogen 2.863 N/A ARG 14.A NH2 ASP 34.A OD1 no hydrogen 3.331 N/A ARG 14.A NH2 ASP 34.A OD2 no hydrogen 3.033 N/A TYR 15.A OH ASP 78.A OD2 no hydrogen 2.531 N/A THR 16.A N TYR 33.A O no hydrogen 3.114 N/A THR 16.A OG1 ASN 35.A OD1 no hydrogen 2.988 N/A SER 19.A N SER 31.A O no hydrogen 3.085 N/A ILE 21.A N VAL 29.A O no hydrogen 2.875 N/A GLY 22.A N VAL 29.A O no hydrogen 3.296 N/A GLY 24.A N GLY 27.A O no hydrogen 2.619 N/A VAL 29.A N GLY 22.A O no hydrogen 2.865 N/A CYS 30.A N ILE 43.A O no hydrogen 2.870 N/A SER 31.A N SER 19.A O no hydrogen 2.964 N/A ALA 32.A N VAL 41.A O no hydrogen 2.863 N/A TYR 33.A N THR 16.A O no hydrogen 2.756 N/A ASP 34.A N VAL 39.A O no hydrogen 2.788 N/A ASN 35.A N ARG 14.A O no hydrogen 2.984 N/A VAL 36.A N ASP 34.A OD1 no hydrogen 2.995 N/A ASN 37.A N ASP 34.A OD1 no hydrogen 3.289 N/A LYS 38.A NZ ASN 35.A O no hydrogen 2.826 N/A ARG 40.A NH1 ASN 17.A O no hydrogen 2.796 N/A ARG 40.A NH2 ASN 17.A O no hydrogen 2.971 N/A ARG 40.A NH2 SER 31.A OG no hydrogen 2.630 N/A VAL 41.A N ALA 32.A O no hydrogen 2.691 N/A ALA 42.A N GLN 95.A O no hydrogen 2.826 N/A ILE 43.A N CYS 30.A O no hydrogen 2.760 N/A LYS 44.A N ILE 93.A O no hydrogen 2.975 N/A LYS 45.A N MET 28.A O no hydrogen 2.829 N/A LYS 45.A NZ VAL 8.A O no hydrogen 2.693 N/A ILE 46.A N VAL 91.A O no hydrogen 2.710 N/A SER 47.A N TYR 26.A O no hydrogen 3.039 N/A SER 47.A OG ASP 90.A OD2 no hydrogen 2.696 N/A HIS 51.A N PRO 48.A O no hydrogen 3.382 N/A CYS 55.A N HIS 51.A O no hydrogen 3.245 N/A CYS 55.A SG PRO 48.A O no hydrogen 3.265 N/A CYS 55.A SG HIS 51.A O no hydrogen 3.315 N/A GLN 56.A N GLN 52.A O no hydrogen 2.940 N/A ARG 57.A N THR 53.A O no hydrogen 3.037 N/A THR 58.A N TYR 54.A O no hydrogen 3.148 N/A THR 58.A OG1 TYR 54.A O no hydrogen 2.685 N/A LEU 59.A N CYS 55.A O no hydrogen 2.829 N/A ARG 60.A N GLN 56.A O no hydrogen 2.920 N/A ARG 60.A NE ALA 160.A O no hydrogen 2.792 N/A ARG 60.A NH2 GLY 158.A O no hydrogen 3.224 N/A GLU 61.A N ARG 57.A O no hydrogen 3.231 N/A ILE 62.A N THR 58.A O no hydrogen 2.945 N/A LYS 63.A N LEU 59.A O no hydrogen 2.808 N/A ILE 64.A N ARG 60.A O no hydrogen 2.960 N/A LEU 65.A N GLU 61.A O no hydrogen 2.807 N/A LEU 66.A N ILE 62.A O no hydrogen 2.850 N/A ARG 67.A N LYS 63.A O no hydrogen 3.188 N/A PHE 68.A N ILE 64.A O no hydrogen 2.965 N/A ARG 69.A N TYR 129.A OH no hydrogen 3.341 N/A ASN 72.A N HIS 70.A ND1 no hydrogen 3.147 N/A ASN 72.A ND2 LEU 152.A O no hydrogen 2.992 N/A ILE 73.A N HIS 70.A O no hydrogen 3.019 N/A ILE 74.A N ILE 154.A O no hydrogen 3.027 N/A ASN 77.A N VAL 94.A O no hydrogen 2.750 N/A ASN 77.A ND2 ASP 96.A OD1 no hydrogen 2.921 N/A ILE 80.A N TYR 92.A O no hydrogen 2.782 N/A ARG 81.A NE THR 336.A OG1 no hydrogen 2.813 N/A ARG 81.A NH1 ALA 82.A O no hydrogen 3.031 N/A ARG 81.A NH2 PHE 333.A O no hydrogen 2.855 N/A THR 84.A OG1 GLN 87.A OE1 no hydrogen 2.855 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.784 N/A GLN 87.A N THR 84.A OG1 no hydrogen 3.232 N/A MET 88.A N ILE 85.A O no hydrogen 3.358 N/A LYS 89.A NZ GLU 86.A O no hydrogen 3.353 N/A VAL 91.A N ILE 46.A O no hydrogen 2.796 N/A TYR 92.A N ILE 80.A O no hydrogen 2.843 N/A TYR 92.A OH ASP 10.A OD1 no hydrogen 3.366 N/A ILE 93.A N LYS 44.A O no hydrogen 2.923 N/A VAL 94.A N ASP 78.A O no hydrogen 2.841 N/A GLN 95.A N ALA 42.A O no hydrogen 2.855 N/A THR 100.A N LEU 147.A O no hydrogen 3.071 N/A THR 100.A OG1 ASP 101.A O no hydrogen 3.180 N/A LEU 102.A N LEU 145.A O no hydrogen 2.809 N/A TYR 103.A N PRO 142.A O no hydrogen 3.282 N/A LYS 104.A N ASP 101.A OD1 no hydrogen 2.730 N/A LEU 105.A N ASP 101.A O no hydrogen 3.242 N/A LEU 106.A N LEU 102.A O no hydrogen 2.925 N/A THR 108.A N LEU 105.A O no hydrogen 3.454 N/A GLN 109.A N LEU 105.A O no hydrogen 2.934 N/A SER 112.A OG HIS 115.A ND1 no hydrogen 2.814 N/A HIS 115.A N SER 112.A OG no hydrogen 3.138 N/A HIS 115.A ND1 SER 112.A OG no hydrogen 2.814 N/A ILE 116.A N SER 112.A O no hydrogen 2.973 N/A CYS 117.A N ASN 113.A O no hydrogen 2.790 N/A CYS 117.A SG TYR 301.A O no hydrogen 3.266 N/A TYR 118.A N ASP 114.A O no hydrogen 2.962 N/A PHE 119.A N HIS 115.A O no hydrogen 2.882 N/A LEU 120.A N ILE 116.A O no hydrogen 3.058 N/A TYR 121.A N CYS 117.A O no hydrogen 3.000 N/A TYR 121.A OH GLU 311.A OE2 no hydrogen 2.546 N/A GLN 122.A N TYR 118.A O no hydrogen 3.161 N/A GLN 122.A NE2 TYR 118.A O no hydrogen 3.457 N/A ILE 123.A N PHE 119.A O no hydrogen 2.980 N/A LEU 124.A N LEU 120.A O no hydrogen 2.996 N/A ARG 125.A N TYR 121.A O no hydrogen 2.881 N/A ARG 125.A NE ASP 310.A O no hydrogen 2.799 N/A ARG 125.A NH1 GLU 71.A OE2 no hydrogen 3.235 N/A ARG 125.A NH1 ASN 72.A OD1 no hydrogen 3.001 N/A ARG 125.A NH2 GLU 71.A OE2 no hydrogen 3.517 N/A ARG 125.A NH2 ASP 310.A O no hydrogen 2.869 N/A GLY 126.A N GLN 122.A O no hydrogen 2.945 N/A LEU 127.A N ILE 123.A O no hydrogen 2.843 N/A LYS 128.A N LEU 124.A O no hydrogen 2.802 N/A LYS 128.A NZ GLU 311.A O no hydrogen 2.699 N/A ILE 130.A N GLY 126.A O no hydrogen 3.123 N/A HIS 131.A N LEU 127.A O no hydrogen 2.884 N/A HIS 131.A NE2 ASP 199.A OD2 no hydrogen 2.802 N/A SER 132.A N LYS 128.A O no hydrogen 2.966 N/A SER 132.A OG LYS 128.A O no hydrogen 3.484 N/A SER 132.A OG TYR 129.A O no hydrogen 2.680 N/A ALA 133.A N ILE 130.A O no hydrogen 3.093 N/A ASN 134.A N HIS 131.A O no hydrogen 2.916 N/A VAL 135.A N ILE 130.A O no hydrogen 3.283 N/A LEU 136.A N ARG 161.A O no hydrogen 2.868 N/A HIS 137.A N ASP 199.A OD2 no hydrogen 2.896 N/A HIS 137.A NE2 CYS 155.A O no hydrogen 2.849 N/A ARG 138.A N ASP 199.A OD1 no hydrogen 2.933 N/A ARG 138.A NE GLY 193.A O no hydrogen 2.969 N/A ARG 138.A NH1 LEU 159.A O no hydrogen 2.853 N/A ARG 138.A NH2 LYS 192.A O no hydrogen 3.184 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 2.970 N/A LYS 141.A NZ THR 179.A OG1 no hydrogen 2.981 N/A ASN 144.A N LYS 141.A O no hydrogen 3.017 N/A ASN 144.A ND2 ASP 139.A O no hydrogen 2.586 N/A LEU 145.A N PRO 142.A O no hydrogen 3.216 N/A LEU 146.A N LYS 153.A O no hydrogen 2.931 N/A LEU 147.A N THR 100.A O no hydrogen 2.839 N/A ASN 148.A N ASP 151.A O no hydrogen 3.137 N/A ASN 148.A ND2 ASP 151.A OD2 no hydrogen 2.813 N/A THR 150.A N ASN 148.A OD1 no hydrogen 3.168 N/A THR 150.A OG1 ASN 148.A OD1 no hydrogen 3.075 N/A THR 150.A OG1 ASP 151.A OD2 no hydrogen 3.207 N/A LEU 152.A N GLN 122.A OE1 no hydrogen 2.807 N/A LYS 153.A N LEU 146.A O no hydrogen 2.884 N/A LYS 153.A NZ GLU 71.A O no hydrogen 2.655 N/A ILE 154.A N ASN 72.A O no hydrogen 2.834 N/A CYS 155.A N ASN 144.A O no hydrogen 2.904 N/A PHE 157.A N GLU 61.A OE2 no hydrogen 3.157 N/A GLY 158.A N ASP 156.A OD2 no hydrogen 3.141 N/A ALA 160.A N PHE 157.A O no hydrogen 3.196 N/A ARG 161.A N LEU 136.A O no hydrogen 3.217 N/A ALA 163.A N ASN 134.A O no hydrogen 2.794 N/A ASP 164.A N TYR 194.A O no hydrogen 2.868 N/A HIS 167.A N ASP 164.A O no hydrogen 3.214 N/A HIS 167.A ND1 ASP 164.A OD1 no hydrogen 3.264 N/A THR 170.A N ASN 190.A O no hydrogen 2.984 N/A THR 170.A OG1 THR 174.A OG1 no hydrogen 2.916 N/A LEU 173.A N MET 188.A O no hydrogen 3.460 N/A THR 174.A OG1 THR 170.A OG1 no hydrogen 2.916 N/A THR 174.A OG1 GLY 171.A O no hydrogen 2.669 N/A THR 179.A N ASP 139.A OD2 no hydrogen 3.299 N/A THR 179.A OG1 ASP 139.A OD2 no hydrogen 2.783 N/A ARG 180.A NH1 GLY 219.A O no hydrogen 3.397 N/A TRP 181.A NE1 GLY 219.A O no hydrogen 2.892 N/A TYR 182.A N THR 179.A O no hydrogen 3.306 N/A TYR 182.A OH GLU 209.A OE1 no hydrogen 2.556 N/A TYR 182.A OH GLU 209.A OE2 no hydrogen 3.240 N/A ARG 183.A N ARG 180.A O no hydrogen 3.238 N/A ARG 183.A NE ALA 178.A O no hydrogen 2.806 N/A ARG 183.A NH2 ALA 178.A O no hydrogen 3.066 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.877 N/A ILE 187.A N ALA 184.A O no hydrogen 3.178 N/A MET 188.A N PRO 185.A O no hydrogen 3.120 N/A LEU 189.A N GLU 186.A O no hydrogen 3.031 N/A ASN 190.A N GLU 186.A O no hydrogen 2.763 N/A SER 191.A N GLU 186.A O no hydrogen 2.902 N/A SER 191.A OG ASP 168.A OD1 no hydrogen 3.148 N/A SER 191.A OG ASP 168.A OD2 no hydrogen 3.062 N/A LYS 192.A N ASP 168.A O no hydrogen 2.857 N/A LYS 192.A NZ HIS 167.A O no hydrogen 2.984 N/A GLY 193.A N SER 191.A OG no hydrogen 3.028 N/A TYR 194.A N ASP 168.A OD1 no hydrogen 2.767 N/A LYS 196.A NZ HIS 131.A O no hydrogen 3.101 N/A ILE 198.A N THR 195.A O no hydrogen 3.050 N/A ASP 199.A N LYS 196.A O no hydrogen 3.147 N/A TRP 201.A N SER 197.A O no hydrogen 3.421 N/A SER 202.A N ILE 198.A O no hydrogen 3.495 N/A SER 202.A OG TYR 182.A O no hydrogen 2.730 N/A SER 202.A OG ILE 198.A O no hydrogen 3.420 N/A VAL 203.A N ASP 199.A O no hydrogen 3.028 N/A GLY 204.A N ILE 200.A O no hydrogen 2.953 N/A CYS 205.A N TRP 201.A O no hydrogen 2.989 N/A CYS 205.A SG TRP 181.A O no hydrogen 3.911 N/A CYS 205.A SG TRP 201.A O no hydrogen 3.575 N/A ILE 206.A N SER 202.A O no hydrogen 3.014 N/A LEU 207.A N VAL 203.A O no hydrogen 2.830 N/A ALA 208.A N GLY 204.A O no hydrogen 2.927 N/A GLU 209.A N CYS 205.A O no hydrogen 2.974 N/A MET 210.A N ILE 206.A O no hydrogen 2.877 N/A LEU 211.A N LEU 207.A O no hydrogen 3.189 N/A SER 212.A N ALA 208.A O no hydrogen 3.322 N/A SER 212.A OG ALA 208.A O no hydrogen 3.460 N/A SER 212.A OG ARG 214.A O no hydrogen 3.423 N/A ASN 213.A N GLU 209.A O no hydrogen 2.654 N/A ASN 213.A ND2 LEU 106.A O no hydrogen 2.734 N/A ASN 213.A ND2 GLN 109.A O no hydrogen 2.795 N/A GLY 219.A N PHE 217.A O no hydrogen 2.909 N/A LYS 220.A N ASP 224.A OD2 no hydrogen 2.785 N/A TYR 222.A OH THR 174.A O no hydrogen 2.613 N/A GLN 225.A N HIS 221.A O no hydrogen 3.287 N/A GLN 225.A NE2 PHE 217.A O no hydrogen 2.862 N/A LEU 226.A N LEU 223.A O no hydrogen 3.280 N/A ASN 227.A N LEU 223.A O no hydrogen 3.505 N/A ASN 227.A ND2 TYR 252.A OH no hydrogen 3.140 N/A HIS 228.A N ASP 224.A O no hydrogen 2.936 N/A ILE 229.A N GLN 225.A O no hydrogen 3.172 N/A LEU 230.A N LEU 226.A O no hydrogen 2.883 N/A GLY 231.A N ASN 227.A O no hydrogen 3.106 N/A ILE 232.A N ILE 229.A O no hydrogen 3.171 N/A LEU 233.A N ILE 229.A O no hydrogen 2.980 N/A GLY 234.A N LEU 230.A O no hydrogen 2.884 N/A SER 235.A N LYS 259.A O no hydrogen 2.790 N/A SER 235.A OG LYS 259.A O no hydrogen 3.391 N/A GLN 238.A NE2 GLN 238.A O no hydrogen 3.039 N/A GLN 238.A NE2 ASN 242.A OD1 no hydrogen 2.732 N/A ASP 240.A N SER 237.A OG no hydrogen 3.114 N/A LEU 241.A N SER 237.A O no hydrogen 2.986 N/A ASN 242.A N GLN 238.A O no hydrogen 2.854 N/A CYS 243.A N GLU 239.A O no hydrogen 3.267 N/A CYS 243.A SG GLU 239.A O no hydrogen 3.356 N/A ILE 244.A N LEU 241.A O no hydrogen 2.804 N/A ALA 249.A N ASN 246.A OD1 no hydrogen 3.163 N/A ARG 250.A N ASN 246.A O no hydrogen 2.980 N/A ARG 250.A NE LEU 241.A O no hydrogen 3.234 N/A ARG 250.A NE ILE 244.A O no hydrogen 2.898 N/A ARG 250.A NH2 ILE 244.A O no hydrogen 2.991 N/A ASN 251.A N LEU 247.A O no hydrogen 2.782 N/A TYR 252.A N LYS 248.A O no hydrogen 3.015 N/A LEU 253.A N ALA 249.A O no hydrogen 3.325 N/A LEU 254.A N ARG 250.A O no hydrogen 3.031 N/A SER 255.A N ASN 251.A O no hydrogen 3.051 N/A SER 255.A N TYR 252.A O no hydrogen 3.300 N/A SER 255.A OG TYR 252.A O no hydrogen 2.646 N/A LEU 256.A N LEU 253.A O no hydrogen 3.428 N/A LYS 259.A N SER 235.A OG no hydrogen 2.793 N/A VAL 262.A N ILE 232.A O no hydrogen 2.783 N/A TRP 264.A NE1 ASP 280.A OD1 no hydrogen 2.808 N/A ARG 266.A N PRO 263.A O no hydrogen 3.049 N/A LEU 267.A N PRO 263.A O no hydrogen 3.273 N/A PHE 268.A N TRP 264.A O no hydrogen 2.903 N/A ALA 271.A N PHE 268.A O no hydrogen 3.399 N/A ALA 275.A N ASP 272.A OD2 no hydrogen 3.090 N/A LEU 276.A N ASP 272.A O no hydrogen 3.223 N/A ASP 277.A N SER 273.A O no hydrogen 3.048 N/A LEU 278.A N LYS 274.A O no hydrogen 3.104 N/A LEU 279.A N ALA 275.A O no hydrogen 2.885 N/A ASP 280.A N LEU 276.A O no hydrogen 3.033 N/A LYS 281.A N ASP 277.A O no hydrogen 3.361 N/A LYS 281.A NZ ASP 277.A OD2 no hydrogen 3.295 N/A MET 282.A N LEU 278.A O no hydrogen 3.060 N/A LEU 283.A N LEU 279.A O no hydrogen 2.789 N/A THR 284.A OG1 ASP 280.A O no hydrogen 2.872 N/A THR 284.A OG1 LYS 281.A O no hydrogen 3.225 N/A ASN 286.A ND2 ASP 240.A OD1 no hydrogen 3.086 N/A HIS 288.A N ASN 286.A OD1 no hydrogen 3.013 N/A HIS 288.A ND1 ASN 286.A OD1 no hydrogen 2.692 N/A LYS 289.A N ASN 286.A O no hydrogen 3.305 N/A LYS 289.A NZ GLU 239.A OE1 no hydrogen 3.007 N/A LYS 289.A NZ ASP 240.A OD1 no hydrogen 3.075 N/A ARG 290.A N ASN 286.A O no hydrogen 3.222 N/A ARG 290.A NE THR 284.A O no hydrogen 2.935 N/A ARG 290.A NH1 GLU 186.A OE2 no hydrogen 2.742 N/A ARG 290.A NH1 SER 197.A O no hydrogen 2.790 N/A ARG 290.A NH2 GLU 186.A OE1 no hydrogen 2.832 N/A ARG 290.A NH2 GLU 186.A OE2 no hydrogen 3.384 N/A ARG 290.A NH2 THR 284.A O no hydrogen 3.002 N/A ARG 290.A NH2 PHE 285.A O no hydrogen 3.203 N/A ILE 291.A N LYS 281.A O no hydrogen 3.211 N/A ALA 296.A N GLU 292.A O no hydrogen 3.016 N/A LEU 297.A N VAL 293.A O no hydrogen 3.190 N/A ALA 298.A N GLU 294.A O no hydrogen 3.191 N/A HIS 299.A N ALA 296.A O no hydrogen 3.244 N/A HIS 299.A NE2 ASP 277.A OD2 no hydrogen 2.666 N/A TYR 301.A N HIS 299.A ND1 no hydrogen 3.029 N/A TYR 301.A OH ASN 113.A OD1 no hydrogen 2.949 N/A LEU 302.A N HIS 299.A O no hydrogen 2.892 N/A GLU 303.A N PRO 300.A O no hydrogen 3.159 N/A TYR 305.A N LEU 302.A O no hydrogen 3.166 N/A TYR 306.A N LEU 302.A O no hydrogen 2.975 N/A ASP 307.A N GLU 311.A OE2 no hydrogen 2.851 N/A SER 309.A OG ASP 307.A OD1 no hydrogen 2.816 N/A ASP 310.A N ASP 307.A O no hydrogen 2.763 N/A GLU 311.A N PRO 308.A O no hydrogen 3.176 N/A ALA 314.A N SER 132.A OG no hydrogen 2.773 N/A PHE 318.A N ALA 133.A O no hydrogen 2.680 N/A LEU 328.A N PRO 324.A O no hydrogen 3.140 N/A LYS 329.A N LYS 325.A O no hydrogen 2.860 N/A LYS 329.A NZ ILE 85.A O no hydrogen 2.823 N/A LYS 329.A NZ MET 88.A O no hydrogen 2.950 N/A GLU 330.A N GLU 326.A O no hydrogen 3.423 N/A LEU 331.A N LYS 327.A O no hydrogen 3.078 N/A ILE 332.A N LEU 328.A O no hydrogen 2.784 N/A PHE 333.A N LYS 329.A O no hydrogen 2.816 N/A GLU 334.A N GLU 330.A O no hydrogen 2.936 N/A GLU 335.A N LEU 331.A O no hydrogen 2.828 N/A THR 336.A N ILE 332.A O no hydrogen 3.053 N/A THR 336.A N PHE 333.A O no hydrogen 3.371 N/A THR 336.A OG1 ILE 332.A O no hydrogen 3.042 N/A THR 336.A OG1 PHE 333.A O no hydrogen 3.032 N/A ALA 337.A N GLU 334.A O no hydrogen 3.313 N/A PHE 339.A N THR 336.A O no hydrogen 3.359 N/A GLN 340.A N ALA 337.A O no hydrogen 3.154 N/A GLN 340.A NE2 ARG 81.A O no hydrogen 3.397 N/A