Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8h3v_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N THR 1.A O no hydrogen 2.597 N/A SER 13.A OG GLU 15.A OE1 no hydrogen 2.548 N/A SER 13.A OG GLU 15.A OE2 no hydrogen 2.101 N/A ILE 17.A N SER 13.A O no hydrogen 2.424 N/A GLN 19.A N ARG 16.A O no hydrogen 2.735 N/A THR 24.A OG1 GLN 29.A O no hydrogen 2.653 N/A LEU 25.A N GLN 29.A O no hydrogen 2.114 N/A GLN 29.A N LEU 25.A O no hydrogen 2.327 N/A VAL 34.A N GLU 33.A OE1 no hydrogen 1.961 N/A THR 35.A N ASP 50.A OD2 no hydrogen 2.029 N/A THR 35.A OG1 ASP 50.A OD2 no hydrogen 2.813 N/A LYS 36.A N ASP 50.A OD2 no hydrogen 1.983 N/A GLY 51.A N ASP 50.A OD1 no hydrogen 2.126 N/A LEU 52.A N GLU 38.A O no hydrogen 2.029 N/A CYS 54.A N GLY 51.A O no hydrogen 2.459 N/A CYS 54.A SG MET 49.A O no hydrogen 3.789 N/A CYS 54.A SG GLY 51.A O no hydrogen 2.873 N/A GLU 55.A N GLU 55.A OE2 no hydrogen 2.676 N/A CYS 68.A SG GLY 69.A O no hydrogen 3.332 N/A GLY 69.A N CYS 66.A O no hydrogen 2.471 N/A GLY 78.A N HIS 76.A ND1 no hydrogen 2.727 N/A CYS 81.A N VAL 86.A O no hydrogen 2.472 N/A CYS 81.A SG TYR 71.A OH no hydrogen 3.516 N/A GLU 82.A N TYR 71.A OH no hydrogen 2.497 N/A CYS 84.A N CYS 81.A O no hydrogen 2.062 N/A THR 89.A OG1 GLU 90.A O no hydrogen 2.043 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.092 N/A ARG 94.A NH1 PRO 60.A O no hydrogen 2.946 N/A ARG 95.A N ARG 92.A O no hydrogen 2.747 N/A HIS 96.A N VAL 93.A O no hydrogen 2.545 N/A ARG 97.A NH1 ILE 57.A O no hydrogen 3.087 N/A TYR 100.A N GLU 33.A OE2 no hydrogen 2.695 N/A ALA 104.A N ASN 278.A OD1 no hydrogen 2.617 N/A VAL 107.A N ALA 105.A O no hydrogen 2.799 N/A ALA 108.A N GLN 302.A OE1 no hydrogen 2.647 N/A TYR 112.A N HIS 109.A O no hydrogen 2.835 N/A LEU 113.A N VAL 110.A O no hydrogen 2.485 N/A SER 118.A OG LEU 113.A O no hydrogen 2.630 N/A SER 118.A OG SER 121.A OG no hydrogen 2.878 N/A SER 121.A OG SER 118.A O no hydrogen 2.752 N/A SER 121.A OG SER 118.A OG no hydrogen 2.878 N/A ILE 122.A N SER 118.A O no hydrogen 3.044 N/A LEU 123.A N TYR 119.A O no hydrogen 3.054 N/A MET 126.A N SER 121.A O no hydrogen 2.890 N/A VAL 131.A N PRO 127.A O no hydrogen 2.678 N/A GLU 132.A N LEU 128.A O no hydrogen 2.456 N/A GLN 133.A N ASP 130.A O no hydrogen 2.825 N/A ILE 134.A N VAL 131.A O no hydrogen 2.760 N/A VAL 135.A N VAL 131.A O no hydrogen 3.160 N/A TYR 136.A OH ASP 305.A OD2 no hydrogen 2.785 N/A ASN 138.A N GLN 133.A O no hydrogen 3.287 N/A SER 144.A OG LEU 143.A O no hydrogen 2.492 N/A THR 150.A N ALA 148.A O no hydrogen 2.629 N/A THR 150.A OG1 GLU 149.A O no hydrogen 2.117 N/A THR 152.A OG1 TYR 153.A O no hydrogen 3.306 N/A THR 152.A OG1 GLN 155.A OE1 no hydrogen 1.908 N/A LYS 154.A NZ LEU 124.A O no hydrogen 3.527 N/A LYS 154.A NZ ASP 125.A OD1 no hydrogen 2.720 N/A LEU 157.A N TYR 140.A O no hydrogen 3.201 N/A SER 158.A OG ASN 138.A O no hydrogen 2.843 N/A TRP 162.A N GLU 159.A O no hydrogen 2.739 N/A LEU 163.A N GLU 159.A O no hydrogen 2.637 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.592 N/A GLU 166.A N TRP 162.A O no hydrogen 2.986 N/A TYR 170.A N ASP 167.A O no hydrogen 3.153 N/A SER 171.A N GLN 168.A O no hydrogen 2.750 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.619 N/A GLN 175.A NE2 GLU 172.A O no hydrogen 2.703 N/A GLN 177.A N GLU 149.A OE1 no hydrogen 3.451 N/A GLN 177.A N GLU 149.A OE2 no hydrogen 3.281 N/A GLN 177.A NE2 GLN 177.A O no hydrogen 3.353 N/A GLY 178.A N GLN 175.A O no hydrogen 3.003 N/A ALA 187.A N GLY 184.A O no hydrogen 3.244 N/A ARG 190.A N GLU 186.A O no hydrogen 2.851 N/A LEU 191.A N ALA 187.A O no hydrogen 2.991 N/A LEU 192.A N LEU 188.A O no hydrogen 2.673 N/A ALA 193.A N LEU 189.A O no hydrogen 3.190 N/A ILE 195.A N ALA 193.A O no hydrogen 2.463 N/A ASN 196.A ND2 GLN 199.A OE1 no hydrogen 3.537 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.743 N/A GLU 200.A N LEU 197.A O no hydrogen 3.224 N/A ALA 201.A N LEU 197.A O no hydrogen 2.894 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.761 N/A SER 203.A OG GLU 200.A O no hydrogen 2.734 N/A LEU 204.A N ALA 201.A O no hydrogen 2.825 N/A ARG 205.A N ALA 201.A O no hydrogen 3.047 N/A GLU 206.A N GLU 202.A O no hydrogen 3.080 N/A ILE 208.A N LEU 204.A O no hydrogen 2.604 N/A GLY 209.A N GLU 206.A O no hydrogen 2.960 N/A SER 210.A N GLU 207.A O no hydrogen 2.738 N/A SER 210.A OG GLU 207.A O no hydrogen 2.677 N/A ALA 217.A N GLY 213.A O no hydrogen 3.278 N/A LYS 218.A N LYS 215.A O no hydrogen 2.662 N/A LEU 219.A N LYS 215.A O no hydrogen 3.297 N/A ILE 220.A N ARG 216.A O no hydrogen 2.531 N/A LYS 221.A N ALA 217.A O no hydrogen 3.133 N/A ARG 222.A N LYS 218.A O no hydrogen 2.735 N/A LEU 223.A N LEU 219.A O no hydrogen 2.804 N/A ARG 224.A N ILE 220.A O no hydrogen 3.194 N/A VAL 225.A N LYS 221.A O no hydrogen 2.614 N/A ILE 226.A N ARG 222.A O no hydrogen 2.691 N/A ASP 227.A N LEU 223.A O no hydrogen 2.442 N/A ASN 228.A N ARG 224.A O no hydrogen 2.342 N/A ILE 230.A N ILE 226.A O no hydrogen 2.535 N/A ALA 231.A N ASP 227.A O no hydrogen 2.801 N/A THR 232.A N PHE 229.A O no hydrogen 2.591 N/A THR 232.A OG1 GLY 233.A O no hydrogen 2.042 N/A THR 232.A OG1 SER 234.A OG no hydrogen 2.049 N/A GLY 233.A N PHE 229.A O no hydrogen 2.564 N/A SER 234.A OG THR 232.A OG1 no hydrogen 2.049 N/A SER 234.A OG GLY 233.A O no hydrogen 2.013 N/A GLU 237.A N GLU 237.A OE1 no hydrogen 2.896 N/A TRP 238.A N LYS 235.A O no hydrogen 3.026 N/A MET 239.A N PRO 236.A O no hydrogen 2.793 N/A MET 241.A N VAL 107.A O no hydrogen 2.207 N/A ILE 247.A N TYR 271.A OH no hydrogen 3.302 N/A ARG 252.A N PRO 249.A O no hydrogen 2.865 N/A ARG 252.A NH1 ILE 247.A O no hydrogen 2.408 N/A ARG 252.A NH2 LEU 52.A O no hydrogen 3.445 N/A ARG 252.A NH2 ILE 247.A O no hydrogen 2.868 N/A THR 264.A OG1 PHE 262.A O no hydrogen 2.866 N/A SER 265.A OG ARG 252.A O no hydrogen 2.772 N/A SER 265.A OG ASP 266.A OD1 no hydrogen 3.526 N/A LEU 270.A N LEU 267.A O no hydrogen 2.891 N/A TYR 271.A N LEU 267.A O no hydrogen 2.763 N/A ARG 273.A N ASP 269.A O no hydrogen 2.924 N/A ARG 273.A NH1 GLU 303.A OE2 no hydrogen 2.631 N/A VAL 274.A N LEU 270.A O no hydrogen 2.688 N/A ILE 275.A N TYR 271.A O no hydrogen 2.729 N/A ASN 276.A N ARG 272.A O no hydrogen 3.351 N/A ARG 277.A N ARG 273.A O no hydrogen 3.035 N/A ARG 277.A NH1 MET 300.A O no hydrogen 2.931 N/A ASN 278.A N VAL 274.A O no hydrogen 2.941 N/A ASN 278.A ND2 ILE 101.A O no hydrogen 2.742 N/A ASN 278.A ND2 LYS 102.A O no hydrogen 2.738 N/A ASN 279.A N ILE 275.A O no hydrogen 2.697 N/A ASN 279.A ND2 THR 35.A O no hydrogen 3.351 N/A ARG 280.A N ASN 276.A O no hydrogen 2.873 N/A ARG 280.A N ASN 279.A OD1 no hydrogen 2.635 N/A ALA 282.A N ASN 278.A O no hydrogen 3.134 N/A ARG 283.A N ASN 279.A O no hydrogen 2.816 N/A LEU 284.A N LEU 281.A O no hydrogen 1.872 N/A GLN 285.A N LEU 281.A O no hydrogen 3.127 N/A GLN 285.A N ALA 282.A O no hydrogen 2.019 N/A GLN 285.A NE2 ALA 282.A O no hydrogen 2.519 N/A LEU 288.A N LEU 284.A O no hydrogen 2.968 N/A LEU 288.A N GLN 285.A O no hydrogen 2.016 N/A ILE 293.A N PRO 290.A O no hydrogen 3.034 N/A VAL 294.A N GLU 291.A O no hydrogen 2.695 N/A ASN 296.A N GLU 291.A O no hydrogen 2.965 N/A ASN 296.A ND2 ILE 292.A O no hydrogen 2.257 N/A GLU 297.A N VAL 294.A O no hydrogen 2.576 N/A LYS 298.A N VAL 294.A O no hydrogen 2.958 N/A LEU 301.A N LYS 298.A O no hydrogen 2.984 N/A GLN 302.A N LYS 298.A O no hydrogen 2.561 N/A GLN 302.A NE2 ALA 108.A O no hydrogen 2.848 N/A GLN 302.A NE2 GLN 302.A O no hydrogen 2.916 N/A GLU 303.A N ARG 299.A O no hydrogen 2.617 N/A VAL 304.A N LEU 301.A O no hydrogen 2.707 N/A ASP 305.A N GLN 302.A O no hydrogen 2.862 N/A ALA 306.A N GLU 303.A O no hydrogen 2.842 N/A ILE 308.A N VAL 304.A O no hydrogen 3.311 N/A ASP 309.A N ASP 305.A O no hydrogen 2.724 N/A ASN 310.A ND2 VAL 317.A O no hydrogen 2.550 N/A THR 316.A OG1 VAL 317.A O no hydrogen 3.120 N/A VAL 317.A N ASN 310.A OD1 no hydrogen 2.173 N/A ASN 322.A N GLY 319.A O no hydrogen 2.694 N/A LEU 325.A N ARG 323.A O no hydrogen 2.596 N/A SER 327.A N ASP 330.A OD2 no hydrogen 3.027 N/A SER 327.A OG ASP 309.A OD1 no hydrogen 3.346 N/A SER 327.A OG ASP 330.A OD2 no hydrogen 2.573 N/A ASP 330.A N SER 327.A O no hydrogen 2.573 N/A ILE 332.A N GLU 333.A OE2 no hydrogen 3.099 N/A GLY 337.A N GLY 334.A O no hydrogen 2.657 N/A ARG 338.A NE ASN 342.A OD1 no hydrogen 3.079 N/A ASN 342.A N ARG 338.A O no hydrogen 2.926 N/A ASN 342.A N PHE 339.A O no hydrogen 2.897 N/A LEU 343.A N ARG 340.A O no hydrogen 2.617 N/A GLY 345.A N ARG 340.A O no hydrogen 2.756 N/A LYS 346.A N LEU 343.A O no hydrogen 3.450 N/A LYS 346.A NZ LEU 343.A O no hydrogen 2.590 N/A SER 351.A OG GLY 352.A O no hydrogen 3.344 N/A GLY 352.A N VAL 469.A O no hydrogen 2.499 N/A ILE 356.A N ASP 465.A O no hydrogen 2.887 N/A CYS 367.A SG GLN 449.A O no hydrogen 3.212 N/A GLY 368.A N GLN 449.A O no hydrogen 2.583 N/A LEU 369.A N ILE 441.A O no hydrogen 2.774 N/A MET 373.A N PRO 370.A O no hydrogen 3.383 N/A ALA 374.A N ARG 371.A O no hydrogen 2.630 N/A PHE 378.A N ILE 375.A O no hydrogen 3.373 N/A GLN 379.A N GLU 376.A O no hydrogen 2.725 N/A VAL 382.A N GLN 379.A O no hydrogen 2.635 N/A ILE 383.A N GLN 379.A O no hydrogen 2.500 N/A ASN 384.A N PRO 380.A O no hydrogen 3.248 N/A LEU 386.A N VAL 382.A O no hydrogen 2.831 N/A ILE 387.A N ILE 383.A O no hydrogen 3.210 N/A ARG 388.A N ASN 384.A O no hydrogen 2.765 N/A SER 389.A N ARG 385.A O no hydrogen 2.876 N/A MET 391.A N LEU 386.A O no hydrogen 2.526 N/A MET 391.A N ILE 387.A O no hydrogen 2.877 N/A ILE 402.A N LYS 399.A O no hydrogen 2.811 N/A SER 403.A OG ILE 402.A O no hydrogen 2.656 N/A SER 408.A N ASP 406.A OD2 no hydrogen 2.197 N/A SER 408.A OG ASP 406.A OD2 no hydrogen 1.979 N/A VAL 409.A N ASP 406.A OD1 no hydrogen 2.843 N/A TRP 410.A N PRO 407.A O no hydrogen 1.897 N/A ASP 411.A N PRO 407.A O no hydrogen 3.303 N/A VAL 412.A N SER 408.A O no hydrogen 3.194 N/A LEU 413.A N VAL 409.A O no hydrogen 2.536 N/A GLU 414.A N TRP 410.A O no hydrogen 3.002 N/A GLU 415.A N ASP 411.A O no hydrogen 2.533 N/A VAL 416.A N VAL 412.A O no hydrogen 2.639 N/A VAL 416.A N LEU 413.A O no hydrogen 2.839 N/A ILE 417.A N GLU 414.A O no hydrogen 2.492 N/A GLU 418.A N GLU 414.A O no hydrogen 3.261 N/A HIS 420.A N ILE 417.A O no hydrogen 3.247 N/A HIS 420.A ND1 GLU 418.A O no hydrogen 2.722 N/A VAL 422.A N PHE 438.A O no hydrogen 3.095 N/A LEU 424.A N GLN 436.A O no hydrogen 3.019 N/A ASN 425.A N ALA 468.A O no hydrogen 2.900 N/A ASN 425.A ND2 PRO 428.A O no hydrogen 3.559 N/A ARG 426.A NH1 PHE 458.A O no hydrogen 2.656 N/A ALA 427.A N GLN 466.A O no hydrogen 3.207 N/A THR 429.A OG1 LEU 430.A O no hydrogen 3.560 N/A GLY 434.A N HIS 431.A O no hydrogen 2.632 N/A ILE 435.A N ARG 432.A O no hydrogen 3.184 N/A PHE 438.A N VAL 422.A O no hydrogen 2.601 N/A GLU 439.A N HIS 365.A O no hydrogen 3.064 N/A VAL 443.A N LEU 369.A O no hydrogen 2.724 N/A ILE 448.A N VAL 355.A O no hydrogen 2.727 N/A LEU 453.A N HIS 451.A ND1 no hydrogen 2.377 N/A CYS 455.A SG PRO 452.A O no hydrogen 3.031 N/A CYS 455.A SG VAL 454.A O no hydrogen 3.107 N/A CYS 455.A SG ALA 460.A O no hydrogen 3.358 N/A ASN 459.A N CYS 455.A O no hydrogen 2.484 N/A ASP 463.A N ASP 465.A OD2 no hydrogen 2.628 N/A GLN 466.A NE2 ARG 353.A O no hydrogen 3.367 N/A HIS 470.A N ALA 468.A O no hydrogen 3.120 N/A LEU 473.A N SER 477.A OG no hydrogen 2.748 N/A SER 474.A OG GLU 476.A OE1 no hydrogen 2.136 N/A SER 474.A OG GLU 476.A OE2 no hydrogen 2.696 N/A SER 474.A OG SER 477.A OG no hydrogen 2.732 N/A SER 477.A N SER 474.A OG no hydrogen 2.206 N/A SER 477.A OG SER 474.A O no hydrogen 2.540 N/A SER 477.A OG SER 474.A OG no hydrogen 2.732 N/A SER 477.A OG LEU 475.A O no hydrogen 3.525 N/A GLN 478.A N LEU 475.A O no hydrogen 2.283 N/A ALA 479.A N GLU 476.A O no hydrogen 2.654 N/A GLU 480.A N GLU 476.A O no hydrogen 3.116 N/A ALA 481.A N SER 477.A O no hydrogen 3.178 N/A ALA 481.A N GLN 478.A O no hydrogen 2.716 N/A ARG 482.A N GLN 478.A O no hydrogen 2.189 N/A ASN 489.A N LEU 486.A O no hydrogen 2.755 N/A SER 493.A N ARG 498.A O no hydrogen 3.003 N/A SER 493.A OG ARG 498.A O no hydrogen 3.536 N/A THR 496.A N SER 493.A O no hydrogen 2.873 N/A THR 496.A N SER 493.A OG no hydrogen 2.911 N/A THR 496.A OG1 SER 493.A OG no hydrogen 3.153 N/A ARG 498.A N THR 496.A OG1 no hydrogen 2.284 N/A THR 502.A OG1 ILE 500.A O no hydrogen 3.337 N/A SER 504.A OG GLN 505.A OE1 no hydrogen 2.667 N/A VAL 508.A N SER 504.A O no hydrogen 2.935 N/A LEU 509.A N GLN 505.A O no hydrogen 3.022 N/A LEU 509.A N ASP 506.A O no hydrogen 3.169 N/A GLY 510.A N ASP 506.A O no hydrogen 3.225 N/A ALA 511.A N MET 507.A O no hydrogen 2.760 N/A TYR 512.A N VAL 508.A O no hydrogen 2.511 N/A TYR 513.A N LEU 509.A O no hydrogen 2.641 N/A LEU 514.A N GLY 510.A O no hydrogen 3.400 N/A THR 515.A N TYR 512.A O no hydrogen 2.657 N/A THR 515.A OG1 ALA 511.A O no hydrogen 3.496 N/A THR 515.A OG1 TYR 512.A O no hydrogen 2.536 N/A ALA 516.A N TYR 513.A O no hydrogen 2.660 N/A ALA 521.A N ASN 518.A OD1 no hydrogen 2.618 N/A THR 522.A OG1 PRO 519.A O no hydrogen 2.874 N/A LYS 523.A NZ GLN 543.A OE1 no hydrogen 3.223 N/A SER 531.A OG ALA 530.A O no hydrogen 2.628 N/A LEU 532.A N ASP 534.A OD2 no hydrogen 3.321 N/A MET 537.A N ASP 533.A O no hydrogen 2.511 N/A ALA 538.A N ASP 534.A O no hydrogen 2.744 N/A PHE 539.A N ILE 536.A O no hydrogen 2.361 N/A GLN 540.A N ILE 536.A O no hydrogen 2.606 N/A GLN 541.A NE2 GLU 542.A O no hydrogen 2.808 N/A GLU 542.A N PHE 539.A O no hydrogen 2.588 N/A HIS 547.A ND1 LEU 514.A O no hydrogen 3.002 N/A ALA 548.A N ASP 545.A O no hydrogen 2.820 N/A VAL 552.A N ILE 600.A O no hydrogen 2.409 N/A ARG 553.A N PHE 529.A O no hydrogen 3.244 N/A SER 560.A OG VAL 558.A O no hydrogen 3.055 N/A SER 560.A OG ASP 564.A OD1 no hydrogen 2.758 N/A THR 571.A OG1 LYS 569.A O no hydrogen 3.263 N/A THR 571.A OG1 THR 579.A O no hydrogen 2.605 N/A ASN 573.A N SER 577.A OG no hydrogen 2.652 N/A ASN 573.A ND2 THR 571.A O no hydrogen 3.573 N/A SER 577.A N GLU 589.A O no hydrogen 2.497 N/A SER 577.A OG THR 579.A OG1 no hydrogen 2.863 N/A ARG 578.A N GLU 589.A OE1 no hydrogen 2.931 N/A THR 579.A OG1 SER 577.A OG no hydrogen 2.863 N/A TYR 584.A N ASP 564.A OD2 no hydrogen 2.882 N/A ARG 585.A N TYR 582.A O no hydrogen 2.891 N/A ARG 586.A NE VAL 587.A O no hydrogen 2.982 N/A ARG 586.A NH2 THR 571.A OG1 no hydrogen 2.730 N/A ARG 588.A N SER 597.A OG no hydrogen 2.697 N/A ARG 588.A NH1 ASP 575.A O no hydrogen 3.115 N/A ARG 588.A NH1 GLU 589.A O no hydrogen 3.291 N/A ARG 588.A NH2 ASP 575.A O no hydrogen 3.442 N/A TYR 601.A N TYR 584.A O no hydrogen 2.563 N/A THR 602.A N ILE 600.A O no hydrogen 3.082 N/A THR 603.A OG1 ASP 545.A O no hydrogen 2.909 N/A THR 603.A OG1 ALA 548.A O no hydrogen 2.951 N/A VAL 607.A N THR 603.A O no hydrogen 3.190 N/A ILE 608.A N PRO 604.A O no hydrogen 2.594 N/A TYR 609.A N GLY 605.A O no hydrogen 2.808 N/A ASN 610.A N VAL 607.A O no hydrogen 2.974 N/A LYS 611.A N ILE 608.A O no hydrogen 3.076 N/A GLN 614.A NE2 ASN 610.A O no hydrogen 3.125 N/A ALA 616.A N ALA 612.A O no hydrogen 3.356 N/A LEU 617.A N ILE 613.A O no hydrogen 2.950 N/A ALA 618.A N GLN 614.A O no hydrogen 2.884 N/A SER 619.A N GLU 615.A O no hydrogen 2.631 N/A