Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xb8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N ASN 31.A O no hydrogen 2.936 N/A VAL 5.A N SER 29.A O no hydrogen 2.859 N/A LEU 7.A N LYS 27.A O no hydrogen 2.946 N/A LYS 8.A NZ GLU 25.A O no hydrogen 3.126 N/A THR 11.A OG1 ARG 13.A O no hydrogen 2.757 N/A ASN 12.A ND2 ASP 95.A OD2 no hydrogen 3.495 N/A ASN 12.A ND2 SER 381.A OG no hydrogen 3.347 N/A ILE 14.A N HIS 97.A O no hydrogen 2.826 N/A SER 17.A N THR 20.A OG1 no hydrogen 2.944 N/A SER 17.A OG THR 20.A OG1 no hydrogen 3.017 N/A ASN 18.A ND2 PHE 66.A O no hydrogen 3.140 N/A SER 19.A OG ASN 18.A OD1 no hydrogen 3.500 N/A THR 20.A N SER 17.A O no hydrogen 2.990 N/A THR 20.A N SER 17.A OG no hydrogen 3.217 N/A THR 20.A OG1 SER 17.A O no hydrogen 2.715 N/A THR 20.A OG1 SER 17.A OG no hydrogen 3.017 N/A THR 20.A OG1 GLY 21.A O no hydrogen 3.446 N/A GLY 21.A N SER 17.A O no hydrogen 2.966 N/A ALA 22.A N PHE 63.A O no hydrogen 3.007 N/A ILE 24.A N LEU 61.A O no hydrogen 2.959 N/A LYS 27.A N LYS 8.A O no hydrogen 2.849 N/A LYS 27.A NZ CYS 26.A O no hydrogen 3.115 N/A SER 29.A N VAL 5.A O no hydrogen 3.038 N/A GLU 35.A N ARG 85.A O no hydrogen 3.174 N/A ILE 37.A N LEU 83.A O no hydrogen 2.689 N/A TRP 38.A NE1 GLY 59.A O no hydrogen 3.236 N/A ILE 39.A N ALA 81.A O no hydrogen 3.496 N/A ARG 40.A N THR 44.A O no hydrogen 2.894 N/A ARG 40.A NH1 THR 44.A OG1 no hydrogen 3.093 N/A ARG 40.A NH1 ALA 45.A O no hydrogen 3.283 N/A ASP 42.A N ASP 42.A OD1 no hydrogen 2.552 N/A GLY 43.A N ARG 40.A O no hydrogen 3.068 N/A VAL 46.A N TRP 38.A O no hydrogen 3.437 N/A VAL 49.A N ARG 53.A O no hydrogen 2.520 N/A LEU 52.A N VAL 49.A O no hydrogen 2.739 N/A ARG 53.A N VAL 49.A O no hydrogen 2.933 N/A ARG 53.A NE GLY 47.A O no hydrogen 3.082 N/A ARG 53.A NH1 TYR 80.A OH no hydrogen 2.527 N/A GLN 54.A N VAL 62.A O no hydrogen 3.178 N/A SER 56.A N LYS 60.A O no hydrogen 2.966 N/A SER 56.A OG LYS 60.A O no hydrogen 3.199 N/A LYS 60.A NZ GLU 23.A O no hydrogen 3.462 N/A VAL 62.A N GLN 54.A O no hydrogen 3.054 N/A PHE 63.A N ALA 22.A O no hydrogen 2.642 N/A PHE 66.A N ASN 18.A O no hydrogen 2.971 N/A ASP 70.A N ARG 67.A O no hydrogen 2.931 N/A TYR 71.A N ALA 68.A O no hydrogen 3.483 N/A ARG 72.A N HIS 76.A ND1 no hydrogen 3.195 N/A ARG 72.A NE GLU 74.A OE1 no hydrogen 3.390 N/A ARG 72.A NE GLU 74.A OE2 no hydrogen 2.954 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.663 N/A HIS 76.A N ARG 72.A O no hydrogen 3.094 N/A HIS 76.A ND1 ARG 72.A O no hydrogen 2.638 N/A GLN 78.A N VAL 98.A O no hydrogen 2.971 N/A GLN 78.A NE2 GLU 74.A O no hydrogen 2.555 N/A VAL 79.A N GLN 78.A OE1 no hydrogen 3.068 N/A TYR 80.A N VAL 96.A O no hydrogen 2.749 N/A TYR 80.A OH VAL 75.A O no hydrogen 2.925 N/A ALA 81.A N ILE 39.A O no hydrogen 2.872 N/A LEU 83.A N ILE 37.A O no hydrogen 2.697 N/A ALA 84.A N ILE 91.A O no hydrogen 3.179 N/A ASN 86.A N GLY 89.A O no hydrogen 3.497 N/A ASN 86.A ND2 PRO 32.A O no hydrogen 2.722 N/A ILE 91.A N ALA 84.A O no hydrogen 3.136 N/A SER 93.A N CYS 82.A O no hydrogen 2.915 N/A SER 93.A OG ARG 94.A O no hydrogen 3.273 N/A ARG 94.A NE PRO 10.A O no hydrogen 2.616 N/A ARG 94.A NH2 GLU 9.A O no hydrogen 3.367 N/A ARG 94.A NH2 PRO 10.A O no hydrogen 2.748 N/A VAL 96.A N TYR 80.A O no hydrogen 2.921 N/A HIS 97.A N ASN 12.A O no hydrogen 2.557 N/A VAL 98.A N GLN 78.A O no hydrogen 3.009 N/A ARG 99.A N ILE 14.A O no hydrogen 3.181 N/A ARG 99.A NE ASP 15.A OD1 no hydrogen 3.322 N/A ARG 99.A NE ASP 15.A OD2 no hydrogen 3.014 N/A ARG 99.A NH2 ASP 15.A OD2 no hydrogen 3.245 N/A VAL 101.A N PHE 16.A O no hydrogen 2.919 N/A TYR 106.A OH THR 186.A OG1 no hydrogen 3.151 N/A GLU 109.A N GLU 126.A O no hydrogen 3.218 N/A VAL 115.A N VAL 204.A O no hydrogen 3.094 N/A ILE 116.A N GLN 240.A OE1 no hydrogen 2.526 N/A ARG 117.A N THR 206.A O no hydrogen 3.356 N/A GLY 118.A N VAL 173.A O no hydrogen 2.796 N/A ASN 119.A N ILE 116.A O no hydrogen 3.118 N/A ASN 119.A ND2 ILE 116.A O no hydrogen 2.950 N/A ASN 119.A ND2 ALA 241.A O no hydrogen 2.589 N/A VAL 121.A N ILE 170.A O no hydrogen 2.890 N/A MET 123.A N LEU 168.A O no hydrogen 3.334 N/A GLU 126.A N GLU 109.A O no hydrogen 2.980 N/A PHE 134.A N VAL 131.A O no hydrogen 2.700 N/A PHE 136.A N LYS 187.A O no hydrogen 3.373 N/A ASP 138.A N ARG 185.A O no hydrogen 2.760 N/A LEU 139.A N ARG 185.A O no hydrogen 3.461 N/A TRP 140.A N TYR 148.A O no hydrogen 2.976 N/A TRP 140.A NE1 GLY 166.A O no hydrogen 3.327 N/A LEU 141.A N GLN 183.A O no hydrogen 2.639 N/A SER 143.A OG GLU 144.A OE2 no hydrogen 3.431 N/A SER 143.A OG SER 181.A O no hydrogen 3.342 N/A SER 143.A OG SER 181.A OG no hydrogen 3.219 N/A GLY 145.A N ASP 142.A O no hydrogen 3.370 N/A ARG 146.A N ASP 142.A OD1 no hydrogen 2.569 N/A TYR 148.A N TRP 140.A O no hydrogen 2.826 N/A TYR 148.A OH ASP 142.A OD2 no hydrogen 2.650 N/A ASP 157.A N GLU 155.A OE1 no hydrogen 3.239 N/A LYS 159.A NZ ASP 177.A OD2 no hydrogen 2.748 N/A TYR 160.A OH TYR 182.A OH no hydrogen 3.006 N/A LEU 161.A N HIS 169.A O no hydrogen 2.985 N/A LEU 163.A N GLU 167.A O no hydrogen 3.287 N/A SER 165.A OG GLU 167.A OE1 no hydrogen 2.524 N/A GLY 166.A N LEU 163.A O no hydrogen 2.951 N/A LEU 168.A N MET 123.A O no hydrogen 3.362 N/A HIS 169.A N LEU 161.A O no hydrogen 2.751 N/A ILE 170.A N VAL 121.A O no hydrogen 2.868 N/A ARG 171.A N LYS 159.A O no hydrogen 3.153 N/A GLU 172.A N SER 120.A OG no hydrogen 2.829 N/A VAL 173.A N ASN 119.A O no hydrogen 2.902 N/A GLY 174.A N ASP 177.A OD2 no hydrogen 3.313 N/A ASP 177.A N GLY 174.A O no hydrogen 3.064 N/A GLY 178.A N PRO 175.A O no hydrogen 2.797 N/A LYS 180.A NZ ASP 142.A OD2 no hydrogen 3.225 N/A SER 181.A N SER 143.A OG no hydrogen 2.940 N/A TYR 182.A N GLY 201.A O no hydrogen 2.887 N/A TYR 182.A OH TYR 160.A OH no hydrogen 3.006 N/A GLN 183.A N LEU 141.A O no hydrogen 2.444 N/A ARG 185.A N LEU 139.A O no hydrogen 3.250 N/A THR 186.A N ARG 195.A O no hydrogen 2.976 N/A THR 186.A OG1 TYR 106.A OH no hydrogen 3.151 N/A LYS 187.A N PHE 136.A O no hydrogen 2.932 N/A ARG 189.A N PHE 134.A O no hydrogen 2.846 N/A ARG 189.A NH2 ASP 15.A OD2 no hydrogen 3.405 N/A GLY 192.A N HIS 188.A O no hydrogen 2.496 N/A ARG 195.A N THR 186.A O no hydrogen 3.031 N/A SER 197.A OG THR 199.A O no hydrogen 3.444 N/A ALA 198.A N SER 108.A O no hydrogen 3.230 N/A GLY 201.A N TYR 182.A O no hydrogen 3.257 N/A ARG 202.A N ASN 112.A OD1 no hydrogen 2.743 N/A THR 206.A N VAL 115.A O no hydrogen 2.839 N/A VAL 209.A N GLU 207.A O no hydrogen 2.429 N/A LYS 212.A N PHE 242.A O no hydrogen 2.892 N/A THR 215.A N GLN 240.A O no hydrogen 2.724 N/A THR 215.A OG1 GLN 240.A O no hydrogen 3.207 N/A SER 220.A OG ILE 222.A O no hydrogen 2.508 N/A LYS 221.A NZ SER 300.A O no hydrogen 3.039 N/A SER 223.A N GLU 302.A O no hydrogen 3.120 N/A SER 223.A OG GLU 302.A O no hydrogen 3.465 N/A LEU 225.A N VAL 304.A O no hydrogen 2.967 N/A GLY 227.A N THR 306.A O no hydrogen 3.303 N/A SER 228.A OG SER 231.A OG no hydrogen 2.752 N/A SER 229.A OG THR 308.A O no hydrogen 2.692 N/A SER 231.A N SER 228.A OG no hydrogen 3.215 N/A SER 231.A OG SER 228.A O no hydrogen 2.956 N/A SER 231.A OG SER 228.A OG no hydrogen 2.752 N/A LEU 235.A N LEU 275.A O no hydrogen 3.061 N/A GLN 240.A N THR 215.A O no hydrogen 3.041 N/A ARG 248.A N VAL 291.A O no hydrogen 3.159 N/A ARG 248.A NE TYR 250.A OH no hydrogen 2.916 N/A ARG 248.A NH2 TYR 250.A OH no hydrogen 3.160 N/A TRP 249.A NE1 GLY 273.A O no hydrogen 2.659 N/A TYR 250.A N LEU 289.A O no hydrogen 2.894 N/A LYS 251.A N GLN 260.A O no hydrogen 2.625 N/A LYS 251.A NZ GLU 283.A O no hydrogen 3.155 N/A LYS 251.A NZ SER 285.A O no hydrogen 3.329 N/A PHE 252.A N LYS 287.A O no hydrogen 2.723 N/A ILE 253.A N ARG 258.A O no hydrogen 3.228 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.594 N/A THR 256.A N ILE 253.A O no hydrogen 3.366 N/A THR 256.A OG1 ILE 253.A O no hydrogen 3.010 N/A VAL 262.A N TRP 249.A O no hydrogen 3.054 N/A ASN 265.A N VAL 268.A O no hydrogen 2.762 N/A ARG 267.A NH1 ASP 279.A O no hydrogen 2.530 N/A ARG 267.A NH1 ASP 284.A OD2 no hydrogen 3.357 N/A ARG 267.A NH2 ASP 284.A OD1 no hydrogen 2.780 N/A ARG 267.A NH2 ASP 284.A OD2 no hydrogen 3.203 N/A LYS 269.A N ILE 276.A O no hydrogen 2.896 N/A GLN 270.A NE2 THR 247.A O no hydrogen 3.288 N/A GLN 270.A NE2 SER 272.A O no hydrogen 3.267 N/A VAL 271.A N THR 274.A O no hydrogen 2.779 N/A THR 274.A N VAL 271.A O no hydrogen 2.532 N/A LEU 275.A N LEU 235.A O no hydrogen 3.371 N/A ILE 276.A N LYS 269.A O no hydrogen 2.825 N/A ILE 277.A N ILE 233.A O no hydrogen 3.000 N/A LYS 278.A NZ ASP 279.A OD2 no hydrogen 3.056 N/A ASP 279.A N ASP 232.A OD1 no hydrogen 3.465 N/A VAL 281.A N ASP 284.A OD2 no hydrogen 2.881 N/A ASP 284.A N VAL 281.A O no hydrogen 3.057 N/A SER 285.A N VAL 282.A O no hydrogen 3.052 N/A SER 285.A OG VAL 282.A O no hydrogen 2.670 N/A GLY 286.A N LEU 305.A O no hydrogen 3.343 N/A LYS 287.A NZ GLU 302.A OE2 no hydrogen 3.180 N/A TYR 288.A N THR 303.A O no hydrogen 2.697 N/A TYR 288.A OH ASP 284.A O no hydrogen 2.515 N/A LEU 289.A N TYR 250.A O no hydrogen 2.804 N/A CYS 290.A N VAL 301.A O no hydrogen 2.880 N/A VAL 291.A N ARG 248.A O no hydrogen 3.065 N/A VAL 292.A N GLU 299.A O no hydrogen 3.078 N/A ASN 294.A N GLY 297.A O no hydrogen 2.565 N/A ASN 294.A ND2 LYS 212.A O no hydrogen 2.749 N/A ASN 294.A ND2 PHE 242.A O no hydrogen 3.537 N/A VAL 296.A N ASN 294.A OD1 no hydrogen 3.161 N/A GLY 297.A N ASN 294.A O no hydrogen 3.125 N/A GLU 299.A N VAL 292.A O no hydrogen 3.042 N/A VAL 301.A N CYS 290.A O no hydrogen 2.871 N/A GLU 302.A N LYS 221.A O no hydrogen 2.911 N/A THR 303.A N TYR 288.A O no hydrogen 2.844 N/A THR 303.A OG1 SER 223.A OG no hydrogen 3.216 N/A VAL 304.A N SER 223.A O no hydrogen 2.952 N/A LEU 305.A N GLY 286.A O no hydrogen 3.183 N/A THR 306.A N LEU 225.A O no hydrogen 3.331 N/A VAL 307.A N SER 285.A OG no hydrogen 2.906 N/A THR 308.A N GLY 227.A O no hydrogen 2.925 N/A THR 308.A OG1 GLY 227.A O no hydrogen 3.372 N/A ALA 309.A N ASN 337.A O no hydrogen 2.979 N/A LEU 311.A N GLU 380.A OE1 no hydrogen 3.244 N/A SER 312.A OG THR 335.A OG1 no hydrogen 2.360 N/A LYS 314.A N GLN 333.A O no hydrogen 2.851 N/A ASP 316.A N THR 331.A O no hydrogen 3.095 N/A GLN 320.A N GLU 387.A O no hydrogen 3.447 N/A GLN 320.A NE2 VAL 329.A O no hydrogen 2.724 N/A VAL 322.A N LYS 389.A O no hydrogen 3.284 N/A ARG 326.A N ASP 323.A O no hydrogen 3.045 N/A ALA 328.A N ILE 360.A O no hydrogen 3.033 N/A PHE 330.A N LEU 358.A O no hydrogen 2.730 N/A CYS 332.A N PRO 356.A O no hydrogen 2.814 N/A GLN 333.A N LYS 314.A O no hydrogen 3.154 N/A THR 335.A N SER 312.A O no hydrogen 2.949 N/A THR 335.A OG1 SER 312.A OG no hydrogen 2.360 N/A ASN 337.A N ALA 309.A O no hydrogen 3.104 N/A ASN 337.A ND2 VAL 307.A O no hydrogen 3.444 N/A LYS 340.A N ARG 376.A O no hydrogen 3.158 N/A THR 341.A N ARG 376.A O no hydrogen 3.291 N/A SER 343.A N PHE 374.A O no hydrogen 2.859 N/A SER 343.A OG PHE 374.A O no hydrogen 3.540 N/A TRP 344.A NE1 GLU 355.A O no hydrogen 2.692 N/A MET 345.A N GLN 372.A O no hydrogen 2.724 N/A LYS 346.A N LYS 349.A O no hydrogen 2.585 N/A LYS 346.A NZ ASP 347.A OD2 no hydrogen 2.516 N/A LYS 346.A NZ LYS 368.A O no hydrogen 3.177 N/A ASP 347.A N MET 370.A O no hydrogen 2.943 N/A LYS 349.A N LYS 346.A O no hydrogen 2.843 N/A ILE 351.A N TRP 344.A O no hydrogen 3.041 N/A LEU 358.A N PHE 330.A O no hydrogen 2.700 N/A ILE 360.A N ALA 328.A O no hydrogen 3.114 N/A SER 362.A OG VAL 363.A O no hydrogen 3.453 N/A LYS 364.A N ASP 367.A OD2 no hydrogen 3.108 N/A ASP 367.A N LYS 364.A O no hydrogen 3.164 N/A MET 370.A N ASP 347.A OD1 no hydrogen 2.742 N/A TYR 371.A N ALA 386.A O no hydrogen 2.779 N/A TYR 371.A OH ASP 367.A O no hydrogen 2.839 N/A GLN 372.A N MET 345.A O no hydrogen 2.922 N/A GLN 372.A NE2 ILE 92.A O no hydrogen 2.806 N/A PHE 374.A N SER 343.A O no hydrogen 2.537 N/A ARG 376.A N THR 341.A O no hydrogen 2.877 N/A ARG 376.A NH1 ASP 95.A OD2 no hydrogen 2.538 N/A ASN 377.A N GLU 380.A O no hydrogen 2.964 N/A GLU 380.A N ASN 377.A O no hydrogen 2.972 N/A SER 381.A N ASN 12.A OD1 no hydrogen 2.887 N/A SER 381.A OG ASN 12.A OD1 no hydrogen 3.041 N/A SER 381.A OG ASP 95.A OD2 no hydrogen 2.604 N/A ALA 382.A N VAL 375.A O no hydrogen 3.119 N/A GLU 387.A N PRO 318.A O no hydrogen 3.035 N/A LEU 388.A N GLY 369.A O no hydrogen 2.869 N/A LYS 389.A N GLN 320.A O no hydrogen 3.079 N/A LYS 389.A NZ GLN 1.A O no hydrogen 2.687 N/A