Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8iuy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N PHE 453.A O no hydrogen 3.009 N/A HIS 8.A N TRP 336.A O no hydrogen 2.801 N/A HIS 8.A ND1 ALA 9.A O no hydrogen 3.087 N/A ALA 9.A N HIS 8.A ND1 no hydrogen 3.045 N/A VAL 10.A N ASN 313.A OD1 no hydrogen 3.293 N/A THR 14.A N VAL 26.A O no hydrogen 2.391 N/A LYS 15.A N THR 14.A OG1 no hydrogen 2.747 N/A THR 18.A N GLU 21.A O no hydrogen 3.410 N/A ARG 22.A NE GLU 21.A O no hydrogen 2.451 N/A ARG 22.A NH1 LEU 19.A O no hydrogen 2.957 N/A GLY 23.A N VAL 16.A O no hydrogen 2.844 N/A VAL 26.A N THR 14.A O no hydrogen 2.757 N/A THR 32.A OG1 LEU 305.A O no hydrogen 2.965 N/A THR 32.A OG1 LEU 306.A O no hydrogen 3.556 N/A GLU 34.A N PHE 285.A O no hydrogen 3.079 N/A THR 36.A OG1 GLU 34.A OE2 no hydrogen 2.280 N/A THR 36.A OG1 THR 36.A O no hydrogen 2.530 N/A ASN 37.A ND2 HIS 274.A NE2 no hydrogen 3.623 N/A ASN 37.A ND2 GLY 276.A O no hydrogen 2.317 N/A THR 38.A N THR 278.A O no hydrogen 2.955 N/A ARG 40.A N THR 38.A O no hydrogen 2.592 N/A ARG 40.A NE ASP 265.A OD2 no hydrogen 2.474 N/A ILE 41.A N GLN 263.A O no hydrogen 2.818 N/A CYS 42.A N THR 278.A OG1 no hydrogen 3.299 N/A CYS 42.A SG ARG 40.A O no hydrogen 3.468 N/A SER 43.A N ASP 265.A O no hydrogen 3.340 N/A SER 43.A OG THR 48.A OG1 no hydrogen 3.222 N/A LYS 44.A N CYS 268.A O no hydrogen 3.357 N/A LYS 44.A NZ ALA 266.A O no hydrogen 3.296 N/A LYS 44.A NZ ASN 267.A O no hydrogen 2.435 N/A LYS 46.A NZ TYR 273.A OH no hydrogen 3.492 N/A ARG 47.A NE SER 73.A O no hydrogen 2.927 N/A ARG 47.A NE SER 73.A OG no hydrogen 2.962 N/A ARG 47.A NH2 SER 73.A OG no hydrogen 2.389 N/A THR 48.A OG1 LYS 46.A O no hydrogen 2.691 N/A VAL 49.A N LEU 76.A O no hydrogen 2.941 N/A LEU 51.A N ILE 78.A O no hydrogen 2.687 N/A GLY 52.A N ASP 50.A OD1 no hydrogen 3.089 N/A CYS 54.A N LEU 51.A O no hydrogen 2.645 N/A CYS 54.A SG GLY 55.A O no hydrogen 3.566 N/A LEU 56.A N GLU 79.A OE2 no hydrogen 2.842 N/A GLY 58.A N GLY 55.A O no hydrogen 2.440 N/A THR 59.A OG1 LEU 56.A O no hydrogen 3.286 N/A THR 61.A N GLY 58.A O no hydrogen 2.819 N/A THR 61.A OG1 GLY 58.A O no hydrogen 2.995 N/A GLY 62.A N GLY 58.A O no hydrogen 2.359 N/A GLN 65.A NE2 GLN 53.A O no hydrogen 3.019 N/A GLN 65.A NE2 SER 84.A O no hydrogen 2.603 N/A CYS 66.A N PRO 63.A O no hydrogen 2.783 N/A CYS 66.A SG GLY 55.A O no hydrogen 3.964 N/A GLN 68.A N GLN 68.A OE1 no hydrogen 2.721 N/A PHE 69.A N CYS 66.A O no hydrogen 3.009 N/A ASP 75.A N ARG 47.A O no hydrogen 2.795 N/A ILE 77.A N MET 256.A O no hydrogen 3.344 N/A ILE 78.A N VAL 49.A O no hydrogen 2.741 N/A ARG 80.A NE ASP 50.A OD1 no hydrogen 2.979 N/A ARG 80.A NH1 VAL 262.A O no hydrogen 2.453 N/A ARG 80.A NH2 ASP 50.A OD1 no hydrogen 3.324 N/A ARG 80.A NH2 ASP 50.A OD2 no hydrogen 2.716 N/A ARG 80.A NH2 VAL 262.A O no hydrogen 2.811 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.686 N/A GLY 83.A N ARG 80.A O no hydrogen 2.761 N/A SER 84.A OG VAL 86.A O no hydrogen 3.270 N/A TYR 88.A OH HIS 174.A NE2 no hydrogen 3.127 N/A LYS 91.A N ILE 221.A O no hydrogen 3.354 N/A LYS 91.A NZ ASP 222.A OD1 no hydrogen 3.211 N/A PHE 92.A N GLU 95.A OE1 no hydrogen 3.243 N/A VAL 93.A N PHE 223.A O no hydrogen 3.301 N/A ARG 99.A N GLU 95.A O no hydrogen 2.886 N/A ARG 99.A NH2 ASP 85.A OD2 no hydrogen 2.455 N/A GLN 100.A N ALA 97.A O no hydrogen 3.175 N/A GLN 100.A NE2 LEU 380.A O no hydrogen 2.820 N/A GLN 100.A NE2 ILE 381.A O no hydrogen 3.030 N/A ILE 101.A N ALA 97.A O no hydrogen 3.143 N/A ILE 101.A N LEU 98.A O no hydrogen 3.214 N/A LEU 102.A N LEU 98.A O no hydrogen 3.431 N/A SER 105.A OG LEU 102.A O no hydrogen 2.984 N/A SER 105.A OG GLY 107.A O no hydrogen 3.015 N/A GLY 106.A N SER 255.A OG no hydrogen 2.811 N/A ASP 109.A N PHE 250.A O no hydrogen 2.757 N/A LYS 110.A NZ THR 59.A O no hydrogen 3.151 N/A LYS 110.A NZ LEU 70.A O no hydrogen 2.540 N/A LYS 110.A NZ GLU 139.A OE2 no hydrogen 2.367 N/A GLU 111.A N ALA 248.A O no hydrogen 3.188 N/A MET 113.A N ASP 246.A O no hydrogen 3.467 N/A GLY 114.A N SER 112.A OG no hydrogen 3.259 N/A ARG 121.A NE SER 145.A O no hydrogen 2.550 N/A ARG 121.A NH2 SER 145.A O no hydrogen 3.543 N/A THR 126.A N SER 135.A O no hydrogen 3.145 N/A CYS 129.A N THR 126.A O no hydrogen 3.361 N/A ARG 131.A NE ASP 67.A OD2 no hydrogen 2.352 N/A ARG 131.A NH1 PHE 136.A O no hydrogen 2.525 N/A ARG 131.A NH2 GLY 62.A O no hydrogen 3.359 N/A ARG 131.A NH2 ASP 67.A OD1 no hydrogen 2.603 N/A ARG 131.A NH2 PHE 136.A O no hydrogen 3.384 N/A SER 135.A N CYS 129.A O no hydrogen 2.961 N/A SER 135.A OG GLY 133.A O no hydrogen 3.334 N/A ALA 138.A N THR 61.A O no hydrogen 3.245 N/A ALA 138.A N GLY 62.A O no hydrogen 2.898 N/A GLU 139.A N THR 61.A O no hydrogen 3.237 N/A LYS 141.A N ALA 244.A O no hydrogen 2.973 N/A LEU 144.A N ARG 121.A O no hydrogen 3.385 N/A SER 145.A N LEU 185.A O no hydrogen 3.145 N/A SER 145.A OG ALA 151.A O no hydrogen 2.886 N/A SER 145.A OG LEU 185.A O no hydrogen 3.009 N/A ASP 148.A N THR 147.A OG1 no hydrogen 2.870 N/A THR 156.A OG1 MET 155.A O no hydrogen 2.778 N/A THR 156.A OG1 SER 237.A OG no hydrogen 2.901 N/A LYS 157.A N PHE 236.A O no hydrogen 2.922 N/A LYS 157.A NZ THR 156.A O no hydrogen 3.336 N/A TYR 159.A N VAL 234.A O no hydrogen 3.312 N/A LYS 160.A NZ ASN 231.A OD1 no hydrogen 2.359 N/A ASN 161.A ND2 SER 165.A O no hydrogen 3.116 N/A ASN 161.A ND2 ASN 229.A O no hydrogen 3.251 N/A ARG 163.A N ASN 161.A OD1 no hydrogen 3.037 N/A ALA 167.A N LEU 228.A O no hydrogen 3.205 N/A ILE 168.A N SER 249.A O no hydrogen 2.895 N/A TRP 171.A N HIS 224.A O no hydrogen 3.209 N/A GLY 172.A N ILE 243.A O no hydrogen 2.860 N/A ILE 173.A N ASP 222.A O no hydrogen 2.925 N/A HIS 174.A N ALA 241.A O no hydrogen 3.047 N/A HIS 174.A NE2 TYR 88.A OH no hydrogen 3.127 N/A HIS 175.A N ARG 220.A O no hydrogen 2.839 N/A SER 176.A OG GLU 181.A OE1 no hydrogen 3.534 N/A VAL 177.A N SER 176.A OG no hydrogen 2.620 N/A ALA 180.A N SER 178.A OG no hydrogen 2.807 N/A GLU 181.A N SER 178.A OG no hydrogen 2.909 N/A GLN 182.A NE2 HIS 174.A O no hydrogen 3.146 N/A THR 183.A OG1 THR 179.A O no hydrogen 2.846 N/A LYS 184.A N GLU 181.A O no hydrogen 3.165 N/A LEU 185.A N GLU 181.A O no hydrogen 2.681 N/A TYR 186.A N GLN 182.A O no hydrogen 3.247 N/A TYR 186.A OH HIS 174.A ND1 no hydrogen 3.093 N/A GLY 187.A N GLN 182.A O no hydrogen 2.627 N/A LYS 191.A NZ GLY 187.A O no hydrogen 3.212 N/A LYS 191.A NZ GLY 189.A O no hydrogen 3.333 N/A LYS 191.A NZ ASN 190.A O no hydrogen 3.489 N/A VAL 193.A N PHE 204.A O no hydrogen 3.173 N/A THR 194.A N SER 237.A O no hydrogen 3.109 N/A GLY 196.A N THR 235.A O no hydrogen 3.335 N/A SER 197.A N TYR 200.A O no hydrogen 2.847 N/A SER 198.A OG ASP 232.A OD1 no hydrogen 3.444 N/A ASN 199.A N SER 197.A OG no hydrogen 3.337 N/A PHE 204.A N VAL 193.A O no hydrogen 3.055 N/A SER 207.A N HIS 175.A ND1 no hydrogen 3.049 N/A SER 207.A OG HIS 175.A ND1 no hydrogen 3.401 N/A SER 207.A OG SER 207.A O no hydrogen 2.513 N/A ARG 211.A NH1 HIS 175.A O no hydrogen 3.476 N/A VAL 214.A N LEU 217.A O no hydrogen 3.392 N/A SER 218.A OG ARG 211.A O no hydrogen 3.153 N/A ARG 220.A N HIS 175.A O no hydrogen 2.778 N/A ARG 220.A NE GLY 219.A O no hydrogen 2.628 N/A ARG 220.A NH2 PRO 212.A O no hydrogen 3.410 N/A ASP 222.A N ILE 173.A O no hydrogen 2.935 N/A PHE 223.A N LYS 91.A O no hydrogen 3.244 N/A HIS 224.A N TRP 171.A O no hydrogen 3.135 N/A ASN 229.A N ASP 232.A OD2 no hydrogen 3.365 N/A ASP 232.A N ASN 229.A O no hydrogen 3.288 N/A VAL 234.A N TYR 159.A O no hydrogen 3.360 N/A THR 235.A N GLY 196.A O no hydrogen 3.154 N/A PHE 236.A N LYS 157.A O no hydrogen 2.870 N/A SER 237.A N THR 194.A O no hydrogen 3.413 N/A SER 237.A OG THR 156.A OG1 no hydrogen 2.901 N/A PHE 238.A N MET 155.A O no hydrogen 3.506 N/A ASN 239.A N LEU 192.A O no hydrogen 3.410 N/A ILE 243.A N GLY 172.A O no hydrogen 2.538 N/A ALA 244.A N LYS 141.A O no hydrogen 3.278 N/A ARG 247.A NH2 GLU 71.A OE1 no hydrogen 3.202 N/A SER 249.A N ILE 168.A O no hydrogen 3.464 N/A ARG 252.A NE ILE 108.A O no hydrogen 3.090 N/A GLY 253.A N SER 105.A O no hydrogen 2.816 N/A SER 255.A OG ARG 103.A O no hydrogen 2.384 N/A ILE 258.A N ILE 77.A O no hydrogen 3.346 N/A GLN 259.A NE2 ASN 383.A OD1 no hydrogen 2.391 N/A SER 260.A N GLU 79.A O no hydrogen 3.498 N/A SER 260.A OG SER 275.A O no hydrogen 2.681 N/A GLY 261.A N SER 275.A O no hydrogen 3.031 N/A VAL 262.A N SER 260.A OG no hydrogen 3.243 N/A ASP 265.A N ILE 41.A O no hydrogen 2.998 N/A ASN 267.A N ASP 265.A OD1 no hydrogen 3.431 N/A TYR 273.A N VAL 293.A O no hydrogen 3.332 N/A TYR 273.A OH CYS 42.A O no hydrogen 2.722 N/A TYR 273.A OH GLY 270.A O no hydrogen 2.462 N/A GLY 276.A N HIS 274.A ND1 no hydrogen 2.987 N/A GLY 277.A N HIS 274.A O no hydrogen 3.297 N/A THR 278.A OG1 ARG 40.A O no hydrogen 2.945 N/A THR 278.A OG1 GLY 277.A O no hydrogen 2.855 N/A ILE 279.A N CYS 272.A O no hydrogen 2.486 N/A GLN 286.A N ARG 298.A O no hydrogen 2.941 N/A GLN 286.A NE2 ASP 289.A O no hydrogen 2.633 N/A ASN 287.A N GLU 34.A O no hydrogen 3.353 N/A ASN 287.A ND2 ASN 287.A O no hydrogen 2.660 N/A ILE 288.A N GLN 286.A OE1 no hydrogen 3.061 N/A ASP 289.A N GLN 286.A OE1 no hydrogen 2.973 N/A ARG 291.A NE ASP 382.A OD2 no hydrogen 3.411 N/A GLY 294.A N PHE 378.A O no hydrogen 3.303 N/A LYS 295.A NZ GLN 377.A OE1 no hydrogen 2.400 N/A CYS 296.A SG VAL 293.A O no hydrogen 3.162 N/A ARG 298.A N PRO 284.A O no hydrogen 2.733 N/A THR 309.A OG1 ALA 308.A O no hydrogen 3.179 N/A ASN 313.A N GLU 25.A O no hydrogen 2.990 N/A ASN 313.A ND2 VAL 10.A O no hydrogen 2.633 N/A GLY 323.A N ILE 325.A O no hydrogen 2.639 N/A PHE 339.A N ALA 350.A O no hydrogen 2.841 N/A ASN 343.A N GLY 346.A O no hydrogen 3.323 N/A ASN 343.A ND2 ASP 461.A OD1 no hydrogen 3.128 N/A GLN 345.A N ASN 343.A OD1 no hydrogen 2.905 N/A GLY 346.A N ASN 343.A OD1 no hydrogen 2.612 N/A THR 349.A OG1 GLY 331.A O no hydrogen 2.614 N/A THR 349.A OG1 THR 349.A O no hydrogen 2.388 N/A ALA 350.A N PHE 339.A O no hydrogen 2.612 N/A LYS 354.A NZ ASN 470.A OD1 no hydrogen 2.601 N/A THR 356.A N TYR 353.A O no hydrogen 3.323 N/A SER 358.A N SER 355.A O no hydrogen 2.832 N/A ILE 360.A N GLN 357.A O no hydrogen 2.886 N/A ASP 361.A N SER 358.A O no hydrogen 2.963 N/A THR 364.A N ILE 360.A O no hydrogen 2.430 N/A GLY 365.A N GLN 362.A O no hydrogen 3.093 N/A LEU 370.A N LYS 366.A O no hydrogen 3.226 N/A ILE 371.A N LEU 367.A O no hydrogen 2.562 N/A PHE 378.A N GLY 294.A O no hydrogen 3.042 N/A LYS 379.A NZ GLN 100.A O no hydrogen 3.202 N/A ASN 383.A ND2 ASN 386.A O no hydrogen 3.489 N/A GLU 384.A N GLN 259.A OE1 no hydrogen 3.226 N/A PHE 385.A N ASN 383.A OD1 no hydrogen 3.082 N/A GLN 391.A N GLU 389.A OE1 no hydrogen 3.180 N/A GLN 391.A N GLU 389.A OE2 no hydrogen 3.116 N/A ILE 392.A N GLU 389.A OE1 no hydrogen 3.409 N/A GLY 393.A N GLU 389.A O no hydrogen 2.681 N/A ASN 394.A N LYS 390.A O no hydrogen 2.605 N/A VAL 395.A N GLN 391.A O no hydrogen 2.843 N/A ILE 396.A N ILE 392.A O no hydrogen 2.496 N/A ASN 397.A N GLY 393.A O no hydrogen 2.876 N/A TRP 398.A N ASN 394.A O no hydrogen 2.671 N/A THR 399.A N VAL 395.A O no hydrogen 2.641 N/A THR 399.A OG1 VAL 395.A O no hydrogen 2.458 N/A ARG 400.A N ILE 396.A O no hydrogen 2.620 N/A ARG 400.A NH2 ASP 382.A OD2 no hydrogen 2.412 N/A ASP 401.A N ASN 397.A O no hydrogen 2.865 N/A SER 402.A N TRP 398.A O no hydrogen 2.849 N/A SER 402.A OG TRP 398.A O no hydrogen 2.340 N/A ILE 403.A N THR 399.A O no hydrogen 2.738 N/A THR 404.A N ARG 400.A O no hydrogen 2.509 N/A THR 404.A OG1 ARG 400.A O no hydrogen 2.425 N/A GLU 405.A N ASP 401.A O no hydrogen 2.719 N/A VAL 406.A N SER 402.A O no hydrogen 3.016 N/A TRP 407.A N ILE 403.A O no hydrogen 2.953 N/A SER 408.A N THR 404.A O no hydrogen 2.937 N/A SER 408.A OG THR 404.A O no hydrogen 2.561 N/A SER 408.A OG GLU 405.A O no hydrogen 2.911 N/A TYR 409.A N GLU 405.A O no hydrogen 3.058 N/A ASN 410.A N VAL 406.A O no hydrogen 2.899 N/A ASN 410.A ND2 VAL 406.A O no hydrogen 3.041 N/A ALA 411.A N TRP 407.A O no hydrogen 2.840 N/A GLU 418.A N VAL 415.A O no hydrogen 3.015 N/A HIS 421.A N MET 417.A O no hydrogen 2.576 N/A THR 422.A N ASN 419.A O no hydrogen 3.347 N/A THR 422.A OG1 GLU 418.A O no hydrogen 3.162 N/A THR 422.A OG1 ASN 419.A O no hydrogen 2.370 N/A ILE 423.A N GLN 420.A O no hydrogen 3.187 N/A ASP 427.A N ILE 423.A O no hydrogen 2.985 N/A SER 428.A N ASP 424.A O no hydrogen 2.369 N/A SER 428.A OG ASP 424.A O no hydrogen 3.148 N/A SER 428.A OG LEU 425.A O no hydrogen 3.548 N/A GLU 429.A N LEU 425.A O no hydrogen 3.083 N/A MET 430.A N ALA 426.A O no hydrogen 2.868 N/A ASP 431.A N ASP 427.A O no hydrogen 3.113 N/A LYS 432.A N ASP 431.A OD1 no hydrogen 2.625 N/A LYS 432.A NZ SER 355.A OG no hydrogen 2.631 N/A LEU 433.A N GLU 429.A O no hydrogen 2.825 N/A TYR 434.A N MET 430.A O no hydrogen 2.934 N/A TYR 434.A OH GLU 447.A OE1 no hydrogen 2.750 N/A GLU 435.A N ASP 431.A O no hydrogen 2.428 N/A ARG 436.A N LYS 432.A O no hydrogen 2.907 N/A ARG 436.A NH1 ILE 467.A O no hydrogen 2.403 N/A VAL 437.A N LEU 433.A O no hydrogen 3.038 N/A ARG 439.A N ARG 436.A O no hydrogen 3.154 N/A GLN 440.A NE2 SER 466.A O no hydrogen 3.292 N/A THR 450.A OG1 ASP 448.A OD2 no hydrogen 2.420 N/A ILE 455.A N ASP 1.A O no hydrogen 2.786 N/A CYS 459.A SG ASP 460.A O no hydrogen 3.856 N/A CYS 463.A SG HIS 457.A NE2 no hydrogen 4.047 N/A CYS 463.A SG LYS 458.A O no hydrogen 3.885 N/A MET 464.A N ASP 460.A O no hydrogen 2.836 N/A ALA 465.A N ASP 461.A O no hydrogen 3.222 N/A SER 466.A OG CYS 463.A O no hydrogen 2.786 N/A ARG 468.A NE MET 464.A O no hydrogen 2.478 N/A THR 471.A N SER 466.A O no hydrogen 2.683 N/A THR 471.A OG1 ALA 465.A O no hydrogen 2.978 N/A THR 471.A OG1 SER 466.A O no hydrogen 3.294 N/A THR 471.A OG1 ASN 469.A OD1 no hydrogen 2.750 N/A ARG 475.A N ASP 473.A OD1 no hydrogen 3.465 N/A ARG 475.A NE ARG 475.A O no hydrogen 3.101 N/A ARG 478.A NE ASN 444.A OD1 no hydrogen 2.604 N/A ARG 478.A NH1 TYR 472.A OH no hydrogen 2.686 N/A ARG 478.A NH2 ASN 444.A OD1 no hydrogen 2.854 N/A ARG 478.A NH2 TYR 472.A OH no hydrogen 2.690 N/A ASN 484.A N ALA 481.A O no hydrogen 3.387 N/A ASN 484.A ND2 PHE 456.A O no hydrogen 3.532 N/A