Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7dkf_A2.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N VAL 13.A O no hydrogen 3.157 N/A PHE 7.A N TRP 72.A O no hydrogen 2.962 N/A VAL 8.A N VAL 6.A O no hydrogen 2.938 N/A ASP 9.A N ILE 74.A O no hydrogen 3.241 N/A GLY 10.A N PHE 7.A O no hydrogen 3.040 N/A GLY 10.A N ASN 73.A OD1 no hydrogen 3.023 N/A THR 19.A N GLU 16.A O no hydrogen 3.437 N/A THR 19.A OG1 GLU 16.A O no hydrogen 3.282 N/A GLN 23.A N THR 20.A OG1 no hydrogen 3.003 N/A ALA 24.A N THR 20.A O no hydrogen 3.069 N/A CYS 25.A N VAL 21.A O no hydrogen 2.959 N/A GLU 26.A N LEU 22.A O no hydrogen 2.832 N/A LYS 27.A N GLN 23.A O no hydrogen 3.113 N/A LYS 27.A N ALA 24.A O no hydrogen 3.252 N/A GLY 29.A N GLU 26.A O no hydrogen 3.407 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.784 N/A LEU 41.A N HIS 38.A O no hydrogen 3.455 N/A ASN 46.A ND2 THR 152.A OG1 no hydrogen 2.639 N/A VAL 52.A N VAL 61.A O no hydrogen 3.264 N/A GLU 53.A N THR 81.A OG1 no hydrogen 3.184 N/A GLU 55.A N ASN 73.A O no hydrogen 3.222 N/A SER 78.A OG THR 81.A OG1 no hydrogen 3.054 N/A LYS 80.A N SER 78.A OG no hydrogen 2.801 N/A LYS 80.A NZ PRO 58.A O no hydrogen 3.435 N/A THR 81.A N SER 78.A OG no hydrogen 2.539 N/A THR 81.A OG1 THR 76.A O no hydrogen 3.417 N/A THR 81.A OG1 SER 78.A OG no hydrogen 3.054 N/A ALA 84.A N THR 81.A O no hydrogen 2.790 N/A ARG 85.A N THR 81.A O no hydrogen 2.878 N/A VAL 88.A N ALA 84.A O no hydrogen 2.986 N/A PHE 91.A N VAL 88.A O no hydrogen 3.265 N/A ALA 94.A N PHE 91.A O no hydrogen 2.891 N/A HIS 96.A N ALA 94.A O no hydrogen 2.715 N/A ASP 99.A N PRO 97.A O no hydrogen 2.963 N/A CYS 100.A SG GLN 112.A OE1 no hydrogen 3.888 N/A CYS 103.A SG GLY 201.A O no hydrogen 3.323 N/A GLN 105.A NE2 ILE 195.A O no hydrogen 3.378 N/A GLU 108.A N GLN 105.A O no hydrogen 3.090 N/A CYS 109.A SG PRO 199.A O no hydrogen 3.753 N/A GLN 112.A N CYS 109.A O no hydrogen 3.009 N/A GLN 112.A NE2 GLY 106.A O no hydrogen 2.962 N/A ASP 113.A N CYS 109.A O no hydrogen 3.198 N/A PHE 118.A N GLN 114.A O no hydrogen 2.869 N/A SER 120.A OG ARG 122.A O no hydrogen 3.482 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.697 N/A LYS 142.A N THR 204.A O no hydrogen 3.110 N/A THR 143.A OG1 VAL 141.A O no hydrogen 2.494 N/A ILE 144.A N ALA 202.A O no hydrogen 3.332 N/A THR 146.A OG1 VAL 132.A O no hydrogen 3.225 N/A ARG 147.A NE GLY 201.A O no hydrogen 2.965 N/A ARG 147.A NH2 GLY 201.A O no hydrogen 2.760 N/A THR 152.A OG1 GLN 150.A O no hydrogen 3.223 N/A ARG 153.A NH1 ILE 197.A O no hydrogen 3.456 N/A ARG 153.A NH2 PHE 35.A O no hydrogen 2.509 N/A ARG 156.A NE THR 152.A O no hydrogen 2.754 N/A ARG 156.A NH1 SER 42.A OG no hydrogen 3.353 N/A ARG 156.A NH2 THR 152.A O no hydrogen 3.043 N/A PHE 157.A N CYS 154.A O no hydrogen 3.294 N/A ALA 158.A N ILE 155.A O no hydrogen 3.368 N/A GLU 160.A N ARG 156.A O no hydrogen 2.629 N/A THR 170.A N GLN 177.A O no hydrogen 2.908 N/A THR 170.A OG1 THR 170.A O no hydrogen 2.542 N/A THR 170.A OG1 GLN 177.A O no hydrogen 3.407 N/A ARG 172.A N ASP 175.A O no hydrogen 2.746 N/A MET 176.A N ASN 174.A O no hydrogen 3.211 N/A GLN 177.A N THR 170.A O no hydrogen 2.683 N/A THR 180.A OG1 ASP 166.A OD2 no hydrogen 3.098 N/A LYS 184.A NZ ASP 166.A OD1 no hydrogen 2.869 N/A LYS 184.A NZ MET 185.A O no hydrogen 3.362 N/A SER 188.A N SER 191.A OG no hydrogen 2.515 N/A SER 188.A OG MET 187.A O no hydrogen 2.766 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.702 N/A SER 191.A OG GLU 189.A O no hydrogen 3.432 N/A GLY 192.A N ASP 260.A OD1 no hydrogen 3.152 N/A GLY 192.A N ASP 260.A OD2 no hydrogen 2.841 N/A ASN 193.A N LEU 190.A O no hydrogen 3.002 N/A ILE 197.A N ILE 194.A O no hydrogen 2.610 N/A CYS 198.A N ILE 194.A O no hydrogen 3.238 N/A CYS 198.A SG VAL 200.A O no hydrogen 3.307 N/A THR 204.A N LYS 142.A O no hydrogen 3.422 N/A LYS 206.A N LEU 140.A O no hydrogen 2.974 N/A THR 211.A OG1 TYR 208.A O no hydrogen 3.028 N/A ARG 213.A NH1 PRO 101.A O no hydrogen 2.852 N/A GLU 216.A N ARG 213.A O no hydrogen 3.478 N/A SER 222.A OG ILE 223.A O no hydrogen 3.329 N/A ILE 223.A N SER 222.A OG no hydrogen 2.513 N/A ILE 233.A N SER 222.A O no hydrogen 3.395 N/A VAL 234.A N LEU 246.A O no hydrogen 2.986 N/A VAL 235.A N THR 220.A O no hydrogen 3.366 N/A THR 237.A OG1 GLU 241.A O no hydrogen 3.422 N/A ARG 238.A N GLU 241.A O no hydrogen 3.212 N/A GLY 240.A N THR 237.A OG1 no hydrogen 3.070 N/A MET 243.A N SER 236.A O no hydrogen 3.027 N/A ARG 244.A NE TYR 208.A OH no hydrogen 3.319 N/A LEU 246.A N VAL 234.A O no hydrogen 3.357 N/A ARG 248.A N ASN 232.A O no hydrogen 2.639 N/A ASP 252.A N HIS 250.A ND1 no hydrogen 3.054 N/A ASN 254.A ND2 ASN 232.A OD1 no hydrogen 2.465 N/A LYS 261.A N SER 259.A OG no hydrogen 3.337 N/A LYS 261.A NZ THR 669.A OG1 no hydrogen 3.392 N/A THR 262.A OG1 SER 259.A O no hydrogen 3.006 N/A ARG 263.A N SER 259.A O no hydrogen 3.292 N/A ARG 263.A NH2 ASP 196.A OD2 no hydrogen 2.789 N/A LYS 270.A N ASP 267.A O no hydrogen 3.438 N/A ARG 271.A N GLY 268.A O no hydrogen 3.240 N/A LEU 274.A N HIS 543.A O no hydrogen 3.378 N/A VAL 279.A N THR 287.A O no hydrogen 2.523 N/A ARG 280.A NH1 ARG 280.A O no hydrogen 2.626 N/A ARG 280.A NH1 LYS 283.A O no hydrogen 3.261 N/A GLU 282.A N GLU 282.A OE1 no hydrogen 2.699 N/A LYS 283.A NZ GLU 282.A OE2 no hydrogen 3.284 N/A THR 289.A N PRO 277.A O no hydrogen 3.106 N/A THR 290.A N THR 289.A OG1 no hydrogen 2.562 N/A ALA 299.A N LEU 295.A O no hydrogen 3.063 N/A LEU 302.A N VAL 298.A O no hydrogen 3.132 N/A SER 304.A N GLY 300.A O no hydrogen 3.217 N/A PHE 305.A N MET 301.A O no hydrogen 3.124 N/A GLN 306.A N ASP 309.A OD2 no hydrogen 3.015 N/A GLN 306.A NE2 VAL 333.A O no hydrogen 3.172 N/A ALA 311.A N MET 516.A O no hydrogen 2.996 N/A ILE 313.A N PHE 518.A O no hydrogen 3.009 N/A ALA 314.A N CYS 339.A O no hydrogen 3.335 N/A GLY 315.A N LEU 520.A O no hydrogen 3.175 N/A ALA 320.A N THR 567.A O no hydrogen 3.212 N/A ALA 322.A N ASP 319.A OD1 no hydrogen 3.320 N/A ASP 328.A N ILE 324.A O no hydrogen 2.473 N/A LEU 329.A N LEU 326.A O no hydrogen 3.241 N/A LEU 330.A N LEU 326.A O no hydrogen 3.010 N/A ASN 331.A N LYS 327.A O no hydrogen 3.143 N/A VAL 333.A N LEU 329.A O no hydrogen 3.190 N/A SER 335.A N LEU 330.A O no hydrogen 3.021 N/A THR 337.A N ASP 336.A OD1 no hydrogen 2.784 N/A THR 337.A OG1 THR 337.A O no hydrogen 2.528 N/A CYS 339.A N ALA 312.A O no hydrogen 3.398 N/A CYS 339.A SG THR 340.A O no hydrogen 3.359 N/A CYS 339.A SG LYS 503.A O no hydrogen 3.214 N/A THR 340.A OG1 GLU 342.A O no hydrogen 3.321 N/A THR 346.A OG1 ALA 349.A O no hydrogen 3.515 N/A GLY 350.A N ASP 352.A OD1 no hydrogen 3.120 N/A ARG 354.A NE ASP 499.A OD1 no hydrogen 2.874 N/A SER 355.A N LEU 353.A O no hydrogen 2.748 N/A ASN 356.A N ARG 354.A O no hydrogen 2.471 N/A LEU 359.A N THR 571.A O no hydrogen 2.652 N/A ASN 360.A ND2 MET 485.A O no hydrogen 2.356 N/A GLY 365.A N THR 362.A O no hydrogen 3.222 N/A VAL 366.A N ILE 363.A O no hydrogen 3.301 N/A ALA 369.A N VAL 366.A O no hydrogen 3.075 N/A ASP 370.A N LYS 443.A O no hydrogen 3.152 N/A VAL 371.A N ASP 370.A OD1 no hydrogen 2.634 N/A VAL 372.A N LYS 400.A O no hydrogen 2.636 N/A LEU 373.A N MET 445.A O no hydrogen 3.025 N/A VAL 375.A N ILE 447.A O no hydrogen 3.430 N/A THR 377.A OG1 GLU 382.A OE2 no hydrogen 2.484 N/A ARG 380.A N ASN 378.A OD1 no hydrogen 3.441 N/A ARG 380.A NE GLU 189.A OE1 no hydrogen 2.659 N/A ARG 380.A NH1 ASP 409.A O no hydrogen 2.655 N/A ARG 380.A NH2 GLU 189.A OE1 no hydrogen 3.209 N/A PHE 386.A N ALA 383.A O no hydrogen 3.197 N/A ARG 389.A N LEU 385.A O no hydrogen 3.196 N/A ARG 389.A NH2 ASP 252.A O no hydrogen 2.562 N/A ILE 390.A N PHE 386.A O no hydrogen 3.189 N/A ARG 391.A N ASN 387.A O no hydrogen 2.671 N/A LYS 392.A N ALA 388.A O no hydrogen 3.071 N/A SER 393.A N ARG 389.A O no hydrogen 3.007 N/A TRP 394.A N ILE 390.A O no hydrogen 2.571 N/A LEU 395.A N ARG 391.A O no hydrogen 3.189 N/A LYS 400.A N ASP 370.A O no hydrogen 3.027 N/A ALA 402.A N VAL 372.A O no hydrogen 3.335 N/A LEU 403.A N ASP 415.A O no hydrogen 3.347 N/A GLY 405.A N HIS 416.A NE2 no hydrogen 3.134 N/A GLY 405.A N GLY 418.A O no hydrogen 2.605 N/A SER 406.A OG GLY 405.A O no hydrogen 2.711 N/A SER 406.A OG SER 406.A O no hydrogen 2.503 N/A SER 406.A OG LEU 656.A O no hydrogen 3.038 N/A LEU 410.A N VAL 408.A O no hydrogen 3.122 N/A TYR 414.A N TYR 412.A O no hydrogen 2.842 N/A LEU 417.A N LEU 403.A O no hydrogen 2.813 N/A ILE 423.A N SER 420.A O no hydrogen 3.311 N/A LEU 424.A N PRO 421.A O no hydrogen 3.219 N/A ASP 426.A N LYS 422.A O no hydrogen 3.076 N/A ILE 427.A N ILE 423.A O no hydrogen 3.201 N/A SER 429.A OG ASP 426.A O no hydrogen 2.377 N/A SER 431.A OG ASP 426.A O no hydrogen 3.104 N/A SER 431.A OG HIS 432.A ND1 no hydrogen 3.027 N/A HIS 432.A ND1 SER 431.A OG no hydrogen 3.027 N/A GLN 436.A N PHE 434.A O no hydrogen 2.385 N/A VAL 437.A N PHE 434.A O no hydrogen 2.515 N/A GLU 440.A N GLN 436.A O no hydrogen 2.581 N/A LYS 442.A N ASP 370.A OD2 no hydrogen 2.611 N/A LYS 443.A N ASP 370.A OD2 no hydrogen 3.182 N/A ILE 447.A N LEU 373.A O no hydrogen 3.222 N/A LEU 448.A N ASN 486.A O no hydrogen 3.174 N/A SER 451.A OG GLY 376.A O no hydrogen 2.939 N/A ARG 455.A N ALA 452.A O no hydrogen 3.189 N/A ILE 461.A N ASP 457.A O no hydrogen 3.027 N/A LEU 462.A N GLY 458.A O no hydrogen 2.969 N/A ALA 464.A N ALA 460.A O no hydrogen 3.082 N/A VAL 465.A N ILE 461.A O no hydrogen 3.103 N/A ASN 467.A N ALA 463.A O no hydrogen 3.023 N/A ALA 469.A N VAL 465.A O no hydrogen 3.034 N/A GLN 470.A N SER 466.A O no hydrogen 3.124 N/A GLN 470.A NE2 GLN 638.A OE1 no hydrogen 3.220 N/A LYS 471.A N ASN 467.A O no hydrogen 3.176 N/A ILE 472.A N ILE 468.A O no hydrogen 3.159 N/A ARG 473.A N ALA 469.A O no hydrogen 3.131 N/A THR 474.A N GLN 470.A O no hydrogen 2.496 N/A SER 475.A N ILE 472.A O no hydrogen 3.177 N/A SER 475.A OG LYS 471.A O no hydrogen 2.364 N/A TRP 482.A NE1 PRO 444.A O no hydrogen 2.581 N/A LYS 483.A NZ ASN 360.A O no hydrogen 3.235 N/A ASN 486.A N VAL 446.A O no hydrogen 3.301 N/A LEU 488.A N LEU 448.A O no hydrogen 3.128 N/A HIS 489.A NE2 TYR 357.A O no hydrogen 2.869 N/A SER 493.A OG GLY 316.A O no hydrogen 2.715 N/A LEU 498.A N GLN 494.A O no hydrogen 2.653 N/A ASP 499.A N VAL 495.A O no hydrogen 3.246 N/A GLY 501.A N LEU 498.A O no hydrogen 2.682 N/A TYR 502.A N LEU 498.A O no hydrogen 3.247 N/A TYR 502.A OH LEU 323.A O no hydrogen 2.338 N/A LYS 515.A N ASP 309.A O no hydrogen 2.422 N/A MET 516.A N ASP 309.A O no hydrogen 3.180 N/A PHE 518.A N ALA 311.A O no hydrogen 3.142 N/A LEU 519.A N VAL 539.A O no hydrogen 3.039 N/A LEU 520.A N ILE 313.A O no hydrogen 2.824 N/A CYS 526.A N GLY 524.A O no hydrogen 2.949 N/A CYS 526.A SG GLU 341.A OE2 no hydrogen 3.250 N/A ARG 529.A NH1 CYS 536.A O no hydrogen 3.563 N/A GLN 530.A N THR 528.A OG1 no hydrogen 3.104 N/A VAL 539.A N LEU 517.A O no hydrogen 2.878 N/A TYR 540.A N VAL 554.A O no hydrogen 2.946 N/A GLN 541.A N LEU 519.A O no hydrogen 3.278 N/A GLY 542.A N LEU 556.A O no hydrogen 3.245 N/A HIS 543.A N TYR 540.A OH no hydrogen 3.182 N/A VAL 547.A N ASP 523.A OD1 no hydrogen 2.669 N/A ASP 553.A N ILE 538.A O no hydrogen 2.841 N/A TYR 561.A OH ASP 224.A OD1 no hydrogen 2.810 N/A THR 562.A OG1 GLU 563.A OE2 no hydrogen 2.793 N/A LYS 564.A NZ ALA 559.A O no hydrogen 3.231 N/A ALA 566.A N THR 578.A OG1 no hydrogen 3.187 N/A TYR 568.A OH LEU 317.A O no hydrogen 2.649 N/A ASN 570.A N ARG 574.A O no hydrogen 3.440 N/A GLU 572.A N ASN 570.A OD1 no hydrogen 3.043 N/A ARG 574.A N ASN 570.A OD1 no hydrogen 2.487 N/A THR 578.A OG1 LYS 564.A O no hydrogen 3.182 N/A LEU 587.A N THR 275.A O no hydrogen 2.843 N/A ARG 589.A NH1 ALA 588.A O no hydrogen 3.069 N/A TRP 592.A NE1 GLU 590.A OE2 no hydrogen 2.906 N/A ILE 594.A N GLU 590.A O no hydrogen 3.368 N/A ILE 595.A N TRP 592.A O no hydrogen 3.200 N/A ARG 596.A N TRP 592.A O no hydrogen 3.472 N/A ARG 596.A NH1 LEU 606.A O no hydrogen 2.367 N/A ALA 597.A N LYS 593.A O no hydrogen 2.872 N/A LEU 598.A N ILE 594.A O no hydrogen 2.658 N/A SER 599.A N ILE 595.A O no hydrogen 2.632 N/A SER 599.A OG MET 604.A O no hydrogen 2.307 N/A GLU 600.A N ARG 596.A O no hydrogen 2.887 N/A ALA 602.A N LEU 598.A O no hydrogen 3.222 N/A ASP 609.A N GLN 613.A OE1 no hydrogen 2.505 N/A THR 610.A N GLN 613.A OE1 no hydrogen 3.404 N/A VAL 614.A N THR 610.A O no hydrogen 2.854 N/A ARG 615.A N LEU 611.A O no hydrogen 3.104 N/A ARG 615.A NE GLU 321.A OE2 no hydrogen 3.501 N/A ARG 615.A NH2 GLN 577.A OE1 no hydrogen 3.358 N/A ASN 616.A N ASP 612.A O no hydrogen 2.884 N/A ARG 617.A N GLN 613.A O no hydrogen 3.315 N/A ARG 617.A NE ASP 328.A OD2 no hydrogen 2.510 N/A ARG 617.A NH2 ASP 328.A OD1 no hydrogen 2.695 N/A LEU 618.A N VAL 614.A O no hydrogen 2.785 N/A GLU 619.A N ARG 615.A O no hydrogen 2.762 N/A GLU 620.A N ARG 617.A O no hydrogen 3.082 N/A SER 622.A OG ASN 624.A OD1 no hydrogen 2.299 N/A ARG 627.A NH2 ASP 630.A OD2 no hydrogen 3.187 N/A TYR 628.A OH GLN 577.A OE1 no hydrogen 2.414 N/A TYR 636.A N ASN 635.A OD1 no hydrogen 2.674 N/A SER 641.A N PHE 637.A O no hydrogen 3.037 N/A SER 641.A OG GLN 470.A OE1 no hydrogen 2.722 N/A LEU 643.A N GLN 639.A O no hydrogen 2.962 N/A LYS 645.A N GLU 642.A O no hydrogen 3.184 N/A LYS 645.A NZ GLU 642.A OE1 no hydrogen 3.005 N/A LEU 646.A N LEU 643.A O no hydrogen 3.299 N/A VAL 647.A N SER 644.A O no hydrogen 3.256 N/A LEU 656.A N ASP 419.A OD1 no hydrogen 2.961 N/A GLN 660.A N GLN 660.A OE1 no hydrogen 2.832 N/A ILE 663.A N THR 662.A OG1 no hydrogen 2.583 N/A PHE 666.A N ILE 663.A O no hydrogen 2.869 N/A TYR 667.A N LYS 664.A O no hydrogen 3.427 N/A THR 669.A OG1 ASP 665.A O no hydrogen 3.512 N/A THR 669.A OG1 PHE 666.A O no hydrogen 3.009 N/A THR 669.A OG1 TYR 667.A O no hydrogen 3.533 N/A SER 671.A OG ASP 523.A OD2 no hydrogen 2.825 N/A ALA 675.A N SER 671.A O no hydrogen 3.293 N/A SER 676.A N ILE 672.A O no hydrogen 2.602 N/A SER 676.A OG ILE 672.A O no hydrogen 3.408 N/A SER 676.A OG SER 673.A O no hydrogen 3.056 N/A GLN 677.A NE2 ASP 267.A OD2 no hydrogen 3.420 N/A THR 678.A OG1 ASP 267.A OD2 no hydrogen 2.702 N/A ALA 680.A N SER 676.A O no hydrogen 3.369 N/A LYS 681.A N GLN 677.A O no hydrogen 2.844 N/A CYS 682.A N THR 678.A O no hydrogen 3.142 N/A CYS 682.A SG THR 678.A O no hydrogen 3.724 N/A CYS 682.A SG MET 679.A O no hydrogen 3.270 N/A VAL 683.A N MET 679.A O no hydrogen 3.066 N/A ALA 685.A N CYS 682.A O no hydrogen 3.101 N/A VAL 686.A N VAL 683.A O no hydrogen 3.458 N/A THR 687.A N VAL 683.A O no hydrogen 3.467 N/A