Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pd8_A.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 512.A N ILE 519.A O no hydrogen 2.865 N/A HIS 513.A N LEU 537.A O no hydrogen 2.714 N/A HIS 513.A ND1 GLU 518.A OE2 no hydrogen 2.743 N/A ILE 514.A N TYR 517.A O no hydrogen 2.881 N/A TYR 517.A N ILE 514.A O no hydrogen 2.902 N/A ILE 519.A N ILE 512.A O no hydrogen 2.817 N/A ALA 521.A N ASP 510.A O no hydrogen 3.027 N/A TRP 522.A N LEU 599.A O no hydrogen 2.884 N/A TYR 523.A N LEU 599.A O no hydrogen 2.943 N/A SER 525.A OG LEU 595.A O no hydrogen 2.666 N/A PHE 527.A N SER 525.A O no hydrogen 2.792 N/A ASP 530.A N ASP 530.A OD1 no hydrogen 2.159 N/A TYR 531.A N PRO 528.A O no hydrogen 2.865 N/A GLY 532.A N PRO 528.A O no hydrogen 3.072 N/A LYS 533.A N GLU 529.A O no hydrogen 3.293 N/A GLN 534.A N TYR 531.A O no hydrogen 3.061 N/A GLN 534.A NE2 ASP 530.A O no hydrogen 3.427 N/A LYS 536.A NZ GLU 518.A OE2 no hydrogen 3.182 N/A LEU 537.A N LYS 511.A O no hydrogen 2.982 N/A TRP 538.A N MET 547.A O no hydrogen 3.010 N/A LEU 539.A N HIS 513.A O no hydrogen 2.800 N/A CYS 540.A N LYS 545.A O no hydrogen 2.879 N/A CYS 540.A SG HIS 556.A NE2 no hydrogen 3.539 N/A CYS 543.A SG HIS 556.A NE2 no hydrogen 3.467 N/A SER 552.A OG TYR 549.A O no hydrogen 2.877 N/A TYR 553.A N TYR 549.A O no hydrogen 3.086 N/A ARG 554.A N GLU 550.A O no hydrogen 2.595 N/A PHE 555.A N LYS 551.A O no hydrogen 2.845 N/A HIS 556.A N SER 552.A O no hydrogen 2.850 N/A LEU 557.A N TYR 553.A O no hydrogen 2.964 N/A GLY 558.A N ARG 554.A O no hydrogen 3.420 N/A GLN 559.A N HIS 556.A O no hydrogen 2.869 N/A CYS 560.A N HIS 556.A O no hydrogen 2.589 N/A CYS 560.A SG HIS 556.A NE2 no hydrogen 3.552 N/A GLN 561.A NE2 GLN 559.A O no hydrogen 3.204 N/A GLN 561.A NE2 CYS 560.A O no hydrogen 3.671 N/A ARG 563.A NH1 CYS 560.A O no hydrogen 3.097 N/A ARG 563.A NH1 TRP 562.A O no hydrogen 2.279 N/A ARG 563.A NH2 CYS 560.A O no hydrogen 3.377 N/A LYS 568.A N GLU 580.A O no hydrogen 3.062 N/A ILE 570.A N VAL 578.A O no hydrogen 3.016 N/A ARG 572.A NE SER 574.A O no hydrogen 2.710 N/A ARG 572.A NH2 SER 574.A O no hydrogen 3.408 N/A LYS 573.A N ILE 576.A O no hydrogen 3.215 N/A LYS 573.A NZ ASP 769.A OD2 no hydrogen 3.159 N/A ASN 575.A ND2 VAL 621.A O no hydrogen 3.212 N/A ILE 576.A N LYS 573.A O no hydrogen 3.113 N/A SER 577.A N THR 619.A O no hydrogen 3.029 N/A SER 577.A OG TYR 571.A O no hydrogen 3.319 N/A VAL 578.A N TYR 571.A O no hydrogen 2.988 N/A HIS 579.A N ILE 617.A O no hydrogen 2.891 N/A GLU 580.A N LYS 568.A O no hydrogen 2.673 N/A VAL 581.A N PHE 615.A O no hydrogen 2.945 N/A GLY 583.A N PHE 613.A O no hydrogen 2.998 N/A LYS 584.A N ASP 582.A OD1 no hydrogen 2.731 N/A ASP 585.A N ASP 582.A O no hydrogen 3.126 N/A HIS 586.A N ASP 582.A O no hydrogen 2.992 N/A LYS 587.A NZ GLU 611.A OE1 no hydrogen 2.223 N/A CYS 590.A N HIS 586.A O no hydrogen 2.948 N/A CYS 590.A SG HIS 586.A O no hydrogen 3.450 N/A GLN 591.A N LYS 587.A O no hydrogen 2.991 N/A GLN 591.A NE2 PHE 608.A O no hydrogen 2.684 N/A ASN 592.A N ILE 588.A O no hydrogen 3.034 N/A LEU 593.A N TYR 589.A O no hydrogen 3.054 N/A CYS 594.A N CYS 590.A O no hydrogen 3.161 N/A CYS 594.A SG CYS 590.A O no hydrogen 3.093 N/A CYS 594.A SG LEU 606.A O no hydrogen 4.001 N/A LEU 595.A N GLN 591.A O no hydrogen 3.015 N/A LEU 596.A N ASN 592.A O no hydrogen 2.836 N/A ALA 597.A N LEU 593.A O no hydrogen 2.757 N/A LYS 598.A N CYS 594.A O no hydrogen 2.871 N/A LYS 598.A NZ PHE 524.A O no hydrogen 2.580 N/A LYS 598.A NZ LYS 598.A O no hydrogen 2.877 N/A LYS 598.A NZ LEU 601.A O no hydrogen 3.078 N/A LEU 599.A N LEU 596.A O no hydrogen 3.409 N/A PHE 600.A N ALA 597.A O no hydrogen 3.093 N/A GLU 611.A N GLU 611.A OE2 no hydrogen 2.672 N/A PHE 613.A N VAL 610.A O no hydrogen 3.149 N/A VAL 614.A N LYS 634.A O no hydrogen 2.949 N/A PHE 615.A N VAL 581.A O no hydrogen 2.848 N/A TYR 616.A N PHE 632.A O no hydrogen 2.842 N/A TYR 616.A OH GLU 580.A OE2 no hydrogen 2.794 N/A ILE 617.A N HIS 579.A O no hydrogen 2.850 N/A LEU 618.A N GLY 630.A O no hydrogen 2.880 N/A THR 619.A N SER 577.A O no hydrogen 2.834 N/A THR 619.A OG1 SER 577.A O no hydrogen 3.553 N/A GLU 620.A N HIS 627.A O no hydrogen 2.802 N/A VAL 621.A N ASN 575.A O no hydrogen 2.893 N/A ASP 622.A N GLY 625.A O no hydrogen 3.121 N/A GLN 624.A N ASP 622.A OD1 no hydrogen 2.701 N/A GLY 625.A N ASP 622.A O no hydrogen 3.301 N/A GLY 625.A N ASP 622.A OD1 no hydrogen 3.222 N/A ALA 626.A N ARG 563.A O no hydrogen 2.927 N/A HIS 627.A N GLU 620.A O no hydrogen 2.710 N/A HIS 627.A ND1 GLU 541.A OE1 no hydrogen 2.672 N/A HIS 627.A NE2 ASP 622.A OD1 no hydrogen 2.760 N/A VAL 629.A N LEU 618.A O no hydrogen 2.764 N/A TYR 631.A N MET 648.A O no hydrogen 2.947 N/A PHE 632.A N TYR 616.A O no hydrogen 3.252 N/A SER 633.A N CYS 646.A O no hydrogen 2.727 N/A SER 633.A OG CYS 646.A O no hydrogen 3.409 N/A LYS 634.A NZ GLU 673.A OE1 no hydrogen 3.426 N/A LYS 636.A N PRO 612.A O no hydrogen 2.969 N/A LYS 636.A NZ ASP 582.A OD1 no hydrogen 2.697 N/A LYS 636.A NZ GLU 611.A O no hydrogen 2.368 N/A LYS 636.A NZ PHE 613.A O no hydrogen 3.556 N/A SER 638.A OG ASN 642.A O no hydrogen 3.294 N/A GLY 641.A N SER 638.A O no hydrogen 3.124 N/A ASN 642.A N SER 638.A OG no hydrogen 2.777 N/A ASN 643.A ND2 SER 666.A O no hydrogen 3.394 N/A ASN 643.A ND2 SER 670.A OG no hydrogen 2.788 N/A SER 645.A N SER 633.A O no hydrogen 2.812 N/A SER 645.A OG GLU 680.A OE1 no hydrogen 3.475 N/A CYS 646.A N SER 633.A OG no hydrogen 3.066 N/A CYS 646.A SG SER 645.A O no hydrogen 3.610 N/A MET 648.A N TYR 631.A O no hydrogen 2.936 N/A LEU 650.A N VAL 629.A O no hydrogen 2.972 N/A TYR 653.A N LEU 650.A O no hydrogen 2.750 N/A GLN 654.A N PRO 651.A O no hydrogen 3.026 N/A GLN 654.A NE2 ILE 649.A O no hydrogen 2.698 N/A TYR 658.A OH GLU 620.A OE2 no hydrogen 2.309 N/A ARG 660.A NH1 SER 697.A OG no hydrogen 3.214 N/A PHE 661.A N GLY 657.A O no hydrogen 2.835 N/A LEU 662.A N TYR 658.A O no hydrogen 2.803 N/A ILE 663.A N GLY 659.A O no hydrogen 2.915 N/A ALA 664.A N ARG 660.A O no hydrogen 2.931 N/A PHE 665.A N PHE 661.A O no hydrogen 2.802 N/A SER 666.A N LEU 662.A O no hydrogen 2.840 N/A SER 666.A OG ILE 663.A O no hydrogen 2.604 N/A TYR 667.A N ILE 663.A O no hydrogen 3.233 N/A TYR 667.A N ALA 664.A O no hydrogen 3.136 N/A GLU 668.A N ALA 664.A O no hydrogen 2.950 N/A LEU 669.A N PHE 665.A O no hydrogen 3.231 N/A SER 670.A N SER 666.A O no hydrogen 3.231 N/A SER 670.A OG SER 666.A O no hydrogen 3.352 N/A LYS 671.A N TYR 667.A O no hydrogen 2.919 N/A LYS 671.A NZ GLU 668.A OE2 no hydrogen 3.359 N/A LEU 672.A N GLU 668.A O no hydrogen 3.007 N/A GLU 673.A N LEU 669.A O no hydrogen 3.105 N/A SER 674.A N LYS 671.A O no hydrogen 3.226 N/A THR 675.A N SER 670.A O no hydrogen 3.171 N/A THR 675.A OG1 VAL 676.A O no hydrogen 2.956 N/A GLY 677.A N SER 720.A O no hydrogen 3.026 N/A SER 678.A OG ASP 725.A OD1 no hydrogen 3.506 N/A SER 678.A OG ASP 725.A OD2 no hydrogen 2.499 N/A GLU 680.A N VAL 644.A O no hydrogen 2.915 N/A GLY 687.A N SER 684.A OG no hydrogen 3.136 N/A LYS 688.A N SER 684.A O no hydrogen 2.818 N/A LYS 688.A NZ LEU 683.A O no hydrogen 3.564 N/A LEU 689.A N ASP 685.A O no hydrogen 3.279 N/A SER 690.A N LEU 686.A O no hydrogen 2.934 N/A SER 690.A OG LEU 686.A O no hydrogen 2.508 N/A TYR 691.A N GLY 687.A O no hydrogen 3.042 N/A ARG 692.A N LYS 688.A O no hydrogen 3.146 N/A SER 693.A N LEU 689.A O no hydrogen 3.089 N/A TYR 694.A N SER 690.A O no hydrogen 3.002 N/A TRP 695.A N TYR 691.A O no hydrogen 2.797 N/A TRP 695.A NE1 TYR 667.A OH no hydrogen 2.982 N/A SER 696.A N ARG 692.A O no hydrogen 2.980 N/A SER 696.A OG ARG 692.A O no hydrogen 2.635 N/A SER 697.A N SER 693.A O no hydrogen 3.023 N/A SER 697.A OG SER 693.A O no hydrogen 2.408 N/A VAL 698.A N TYR 694.A O no hydrogen 2.961 N/A LEU 699.A N TRP 695.A O no hydrogen 2.929 N/A LEU 700.A N SER 696.A O no hydrogen 2.784 N/A GLU 701.A N SER 697.A O no hydrogen 2.809 N/A ASN 702.A N VAL 698.A O no hydrogen 2.958 N/A ASN 702.A ND2 VAL 698.A O no hydrogen 3.053 N/A LEU 703.A N LEU 699.A O no hydrogen 2.937 N/A LEU 703.A N LEU 700.A O no hydrogen 3.037 N/A ARG 704.A N LEU 700.A O no hydrogen 3.170 N/A ASP 705.A N GLU 701.A O no hydrogen 3.319 N/A SER 711.A OG ASP 714.A OD1 no hydrogen 2.448 N/A ASP 714.A N SER 711.A OG no hydrogen 2.929 N/A LEU 715.A N SER 711.A O no hydrogen 3.235 N/A SER 716.A N ILE 712.A O no hydrogen 3.116 N/A SER 716.A OG ILE 721.A O no hydrogen 2.936 N/A GLN 717.A N LYS 713.A O no hydrogen 3.201 N/A MET 718.A N ASP 714.A O no hydrogen 2.991 N/A THR 719.A N SER 716.A O no hydrogen 3.400 N/A THR 719.A OG1 LEU 715.A O no hydrogen 2.498 N/A SER 720.A N SER 716.A O no hydrogen 2.879 N/A SER 720.A OG THR 675.A O no hydrogen 2.694 N/A ILE 721.A N THR 719.A OG1 no hydrogen 3.299 N/A ASP 725.A N THR 722.A OG1 no hydrogen 3.082 N/A ILE 726.A N THR 722.A O no hydrogen 3.030 N/A ILE 727.A N GLN 723.A O no hydrogen 2.865 N/A SER 728.A N ASN 724.A O no hydrogen 2.982 N/A SER 728.A OG ASP 725.A O no hydrogen 3.283 N/A THR 729.A N ASP 725.A O no hydrogen 3.114 N/A THR 729.A OG1 ASP 725.A O no hydrogen 2.666 N/A LEU 730.A N ILE 726.A O no hydrogen 2.887 N/A GLN 731.A N ILE 727.A O no hydrogen 2.866 N/A SER 732.A N SER 728.A O no hydrogen 3.128 N/A SER 732.A OG THR 729.A O no hydrogen 2.370 N/A LEU 733.A N THR 729.A O no hydrogen 2.941 N/A ASN 734.A N GLN 731.A O no hydrogen 3.151 N/A MET 735.A N LEU 730.A O no hydrogen 2.779 N/A LYS 737.A N VAL 744.A O no hydrogen 2.604 N/A TRP 739.A N GLN 742.A O no hydrogen 2.776 N/A GLN 742.A N TRP 739.A O no hydrogen 2.990 N/A VAL 744.A N LYS 737.A O no hydrogen 2.627 N/A CYS 746.A N MET 735.A O no hydrogen 2.822 N/A LEU 751.A N THR 748.A OG1 no hydrogen 2.883 N/A VAL 752.A N THR 748.A O no hydrogen 3.152 N/A GLU 753.A N LYS 750.A O no hydrogen 3.256 N/A GLU 754.A N LYS 750.A O no hydrogen 3.049 N/A HIS 755.A N LEU 751.A O no hydrogen 3.325 N/A LEU 756.A N VAL 752.A O no hydrogen 3.047 N/A LEU 756.A N GLU 753.A O no hydrogen 3.116 N/A LYS 757.A N GLU 753.A O no hydrogen 3.226 N/A SER 758.A N HIS 755.A O no hydrogen 3.438 N/A SER 758.A OG HIS 755.A O no hydrogen 2.219 N/A ASP 769.A N TYR 571.A OH no hydrogen 3.132 N/A VAL 771.A N ASP 769.A OD1 no hydrogen 3.096 N/A CYS 772.A N ASP 769.A O no hydrogen 2.782 N/A CYS 772.A SG ASP 769.A OD2 no hydrogen 3.865 N/A LEU 773.A N SER 770.A O no hydrogen 3.114 N/A LYS 774.A N ILE 570.A O no hydrogen 2.888 N/A TRP 775.A NE1 GLU 580.A OE2 no hydrogen 3.152 N/A