Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xcm_A.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 29.A N VAL 62.A O no hydrogen 3.049 N/A SER 31.A N SER 60.A O no hydrogen 3.511 N/A SER 31.A OG SER 31.A O no hydrogen 2.200 N/A THR 33.A OG1 GLY 219.A O no hydrogen 3.147 N/A ARG 34.A NE GLU 191.A OE2 no hydrogen 2.810 N/A ARG 34.A NH2 GLU 191.A OE2 no hydrogen 3.002 N/A TYR 37.A OH LEU 54.A O no hydrogen 2.164 N/A TYR 38.A N LEU 223.A O no hydrogen 2.850 N/A SER 46.A N ASN 280.A O no hydrogen 2.862 N/A VAL 47.A N TYR 279.A O no hydrogen 3.204 N/A HIS 49.A N LEU 277.A O no hydrogen 2.844 N/A SER 50.A N HIS 49.A ND1 no hydrogen 2.944 N/A ASP 53.A N ARG 273.A O no hydrogen 3.248 N/A LEU 54.A N ASP 53.A OD1 no hydrogen 3.099 N/A PHE 55.A N GLN 271.A O no hydrogen 3.339 N/A PHE 58.A N ASP 290.A OD2 no hydrogen 2.853 N/A PHE 59.A N PHE 32.A O no hydrogen 2.817 N/A ASN 61.A N SER 60.A OG no hydrogen 2.654 N/A VAL 90.A N PHE 194.A O no hydrogen 3.137 N/A ALA 93.A N TYR 266.A O no hydrogen 3.362 N/A SER 94.A OG THR 95.A O no hydrogen 3.464 N/A GLU 96.A N ASN 188.A O no hydrogen 2.824 N/A SER 98.A OG SER 98.A O no hydrogen 2.570 N/A ILE 101.A N GLU 96.A OE2 no hydrogen 2.291 N/A ARG 102.A N LEU 241.A O no hydrogen 3.267 N/A THR 109.A OG1 ASP 111.A O no hydrogen 3.462 N/A ASP 111.A N THR 109.A OG1 no hydrogen 3.164 N/A SER 112.A OG ASP 111.A O no hydrogen 2.814 N/A SER 116.A OG GLU 132.A OE1 no hydrogen 2.897 N/A ILE 119.A N TRP 104.A O no hydrogen 3.409 N/A ALA 123.A N ASN 121.A O no hydrogen 2.332 N/A VAL 127.A N VAL 120.A O no hydrogen 3.194 N/A PHE 133.A N CYS 131.A O no hydrogen 2.390 N/A THR 167.A OG1 THR 167.A O no hydrogen 2.188 N/A SER 172.A OG VAL 171.A O no hydrogen 2.397 N/A LYS 187.A N GLU 96.A O no hydrogen 3.074 N/A LEU 189.A N THR 208.A O no hydrogen 3.007 N/A ARG 190.A N SER 94.A O no hydrogen 3.222 N/A GLU 191.A N LYS 206.A O no hydrogen 3.040 N/A VAL 193.A N TYR 204.A O no hydrogen 3.256 N/A PHE 194.A N VAL 90.A O no hydrogen 3.041 N/A LYS 195.A N LYS 202.A O no hydrogen 3.301 N/A LYS 195.A NZ TYR 37.A OH no hydrogen 2.998 N/A LYS 195.A NZ ASP 53.A OD1 no hydrogen 3.539 N/A PHE 201.A N LEU 229.A O no hydrogen 2.831 N/A LYS 202.A N LYS 195.A O no hydrogen 3.241 N/A TYR 204.A N VAL 193.A O no hydrogen 3.099 N/A SER 205.A N GLU 224.A O no hydrogen 3.409 N/A LYS 206.A NZ GLU 224.A OE2 no hydrogen 3.544 N/A THR 208.A OG1 PRO 209.A O no hydrogen 3.454 N/A ILE 210.A N LYS 187.A O no hydrogen 3.362 N/A LEU 223.A N VAL 36.A O no hydrogen 2.916 N/A GLU 224.A N SER 205.A O no hydrogen 3.198 N/A LEU 226.A N ILE 203.A O no hydrogen 3.168 N/A LEU 229.A N PHE 201.A O no hydrogen 3.350 N/A THR 236.A N GLY 107.A O no hydrogen 2.886 N/A GLY 268.A N TYR 91.A O no hydrogen 2.914 N/A GLN 271.A N PHE 55.A O no hydrogen 3.293 N/A ARG 273.A N GLN 271.A O no hydrogen 2.585 N/A ARG 273.A NE ASP 290.A OD1 no hydrogen 3.263 N/A PHE 275.A N THR 51.A O no hydrogen 3.019 N/A LEU 277.A N HIS 49.A O no hydrogen 2.613 N/A LYS 278.A N ASP 287.A O no hydrogen 2.880 N/A TYR 279.A N VAL 47.A O no hydrogen 3.393 N/A ASN 280.A N THR 284.A O no hydrogen 3.293 N/A ASN 282.A N ASN 280.A OD1 no hydrogen 3.200 N/A GLY 283.A N ASN 280.A O no hydrogen 3.178 N/A THR 284.A N ASN 280.A OD1 no hydrogen 2.977 N/A THR 286.A N LYS 278.A O no hydrogen 3.038 N/A THR 286.A OG1 LYS 278.A O no hydrogen 3.081 N/A ALA 288.A N ASP 287.A OD1 no hydrogen 2.487 N/A CYS 291.A N THR 274.A O no hydrogen 3.192 N/A CYS 291.A SG VAL 289.A O no hydrogen 3.194 N/A LEU 293.A N ASP 290.A O no hydrogen 2.892 N/A SER 297.A N ASP 294.A OD1 no hydrogen 3.106 N/A SER 297.A OG ASP 294.A OD1 no hydrogen 2.776 N/A GLU 298.A N ASP 294.A O no hydrogen 2.951 N/A THR 299.A N PRO 295.A O no hydrogen 2.919 N/A THR 299.A OG1 PRO 295.A O no hydrogen 2.939 N/A LYS 300.A N LEU 296.A O no hydrogen 2.912 N/A CYS 301.A N SER 297.A O no hydrogen 2.899 N/A THR 302.A N GLU 298.A O no hydrogen 2.956 N/A LEU 303.A N THR 299.A O no hydrogen 2.968 N/A LYS 304.A N CYS 301.A O no hydrogen 2.899 N/A SER 305.A N LYS 300.A O no hydrogen 3.228 N/A SER 305.A OG THR 307.A O no hydrogen 2.575 N/A THR 307.A N SER 305.A OG no hydrogen 2.939 N/A VAL 308.A N THR 602.A OG1 no hydrogen 2.952 N/A LYS 310.A NZ ASP 663.A OD1 no hydrogen 2.848 N/A GLY 311.A N THR 599.A O no hydrogen 3.105 N/A TYR 313.A N VAL 597.A O no hydrogen 3.129 N/A TYR 313.A OH GLU 309.A O no hydrogen 2.257 N/A THR 315.A N VAL 595.A O no hydrogen 3.409 N/A PHE 318.A N GLY 593.A O no hydrogen 3.352 N/A THR 323.A N CYS 538.A O no hydrogen 2.794 N/A THR 323.A OG1 CYS 538.A O no hydrogen 3.535 N/A ARG 328.A N ASN 542.A O no hydrogen 2.993 N/A ARG 328.A NH2 GLN 580.A OE1 no hydrogen 2.325 N/A PHE 329.A N SER 530.A OG no hydrogen 3.407 N/A THR 333.A N ASN 334.A OD1 no hydrogen 3.231 N/A ASN 334.A N ASN 334.A OD1 no hydrogen 2.284 N/A ASN 334.A ND2 ASN 360.A OD1 no hydrogen 2.864 N/A PHE 338.A N CYS 336.A O no hydrogen 2.574 N/A VAL 341.A N PHE 338.A O no hydrogen 3.265 N/A PHE 342.A N PHE 338.A O no hydrogen 2.885 N/A ASN 343.A N GLY 339.A O no hydrogen 2.882 N/A SER 349.A OG LEU 452.A O no hydrogen 2.844 N/A TYR 351.A N SER 349.A OG no hydrogen 3.336 N/A TYR 351.A OH THR 470.A OG1 no hydrogen 2.648 N/A ALA 352.A N SER 349.A O no hydrogen 2.716 N/A LYS 356.A N ALA 397.A O no hydrogen 3.404 N/A ARG 357.A NE ASN 394.A OD1 no hydrogen 2.692 N/A ARG 357.A NH2 ASN 394.A OD1 no hydrogen 2.734 N/A ILE 358.A N VAL 395.A O no hydrogen 3.070 N/A SER 359.A OG ILE 358.A O no hydrogen 2.718 N/A CYS 361.A SG SER 359.A O no hydrogen 3.431 N/A VAL 362.A N ASN 334.A O no hydrogen 3.136 N/A SER 366.A N ASP 364.A OD1 no hydrogen 3.382 N/A VAL 367.A N ASP 364.A O no hydrogen 3.388 N/A TYR 369.A N TYR 365.A O no hydrogen 2.879 N/A ASN 370.A N SER 366.A O no hydrogen 2.922 N/A SER 371.A N VAL 367.A O no hydrogen 2.928 N/A SER 371.A OG LEU 368.A O no hydrogen 2.918 N/A SER 375.A N ALA 435.A O no hydrogen 2.417 N/A SER 375.A OG ALA 435.A O no hydrogen 3.099 N/A LYS 378.A N VAL 433.A O no hydrogen 3.471 N/A TYR 380.A N GLY 431.A O no hydrogen 2.608 N/A LYS 386.A N SER 383.A O no hydrogen 2.790 N/A LEU 390.A N LEU 387.A O no hydrogen 2.910 N/A THR 393.A N GLU 516.A O no hydrogen 3.350 N/A THR 393.A OG1 GLU 516.A O no hydrogen 2.482 N/A ASN 394.A ND2 TYR 396.A OH no hydrogen 3.158 N/A TYR 396.A N SER 514.A O no hydrogen 3.414 N/A TYR 396.A OH GLU 516.A OE1 no hydrogen 2.683 N/A ASP 398.A N VAL 512.A O no hydrogen 2.959 N/A SER 399.A N ASN 354.A O no hydrogen 3.319 N/A PHE 400.A N VAL 510.A O no hydrogen 2.908 N/A ARG 403.A NE GLY 504.A O no hydrogen 2.357 N/A ARG 403.A NH2 GLY 504.A O no hydrogen 2.830 N/A GLU 406.A N ARG 403.A O no hydrogen 2.977 N/A GLN 409.A N GLU 406.A O no hydrogen 3.140 N/A ILE 410.A N VAL 407.A O no hydrogen 2.914 N/A GLN 414.A NE2 ARG 408.A O no hydrogen 2.367 N/A LYS 417.A NZ TYR 453.A OH no hydrogen 3.561 N/A ILE 418.A N GLN 409.A OE1 no hydrogen 2.861 N/A ALA 419.A N GLN 409.A OE1 no hydrogen 3.251 N/A ASP 420.A N LYS 417.A O no hydrogen 3.317 N/A TYR 421.A N LYS 417.A O no hydrogen 2.917 N/A ASN 422.A N ILE 418.A O no hydrogen 2.880 N/A ASN 422.A ND2 VAL 350.A O no hydrogen 2.907 N/A TYR 423.A N ILE 418.A O no hydrogen 2.804 N/A TYR 423.A OH ASP 398.A OD2 no hydrogen 2.180 N/A LYS 424.A NZ ALA 419.A O no hydrogen 3.416 N/A CYS 432.A N LEU 513.A O no hydrogen 2.901 N/A VAL 433.A N LYS 378.A O no hydrogen 2.957 N/A ILE 434.A N VAL 511.A O no hydrogen 2.770 N/A TRP 436.A N ARG 509.A O no hydrogen 3.201 N/A SER 438.A N PRO 507.A O no hydrogen 2.399 N/A ASN 439.A ND2 GLN 506.A OE1 no hydrogen 2.614 N/A ASN 440.A N ASN 437.A OD1 no hydrogen 3.335 N/A LEU 441.A N SER 438.A O no hydrogen 2.764 N/A ASP 442.A N SER 438.A O no hydrogen 2.326 N/A ASN 448.A ND2 ASP 442.A O no hydrogen 2.827 N/A ASN 448.A ND2 TYR 451.A OH no hydrogen 2.771 N/A TYR 453.A N GLN 493.A O no hydrogen 2.803 N/A TYR 453.A OH GLN 493.A OE1 no hydrogen 3.253 N/A ARG 454.A NH1 SER 469.A OG no hydrogen 2.678 N/A ARG 454.A NH2 ASP 467.A OD2 no hydrogen 3.113 N/A ARG 454.A NH2 SER 469.A OG no hydrogen 2.781 N/A LEU 455.A N PRO 491.A O no hydrogen 3.140 N/A ARG 457.A NH1 SER 459.A O no hydrogen 2.380 N/A SER 459.A OG ASN 460.A O no hydrogen 3.479 N/A ASN 460.A ND2 ALA 419.A O no hydrogen 3.496 N/A LEU 461.A N ASP 420.A O no hydrogen 3.370 N/A PHE 464.A N LYS 424.A O no hydrogen 3.073 N/A GLU 465.A N LYS 462.A O no hydrogen 2.984 N/A ARG 466.A NH1 ASN 354.A OD1 no hydrogen 3.099 N/A ASP 467.A N GLU 465.A O no hydrogen 2.672 N/A SER 469.A OG ASP 467.A OD1 no hydrogen 2.446 N/A SER 469.A OG ASP 467.A OD2 no hydrogen 3.111 N/A THR 470.A OG1 TYR 351.A OH no hydrogen 2.648 N/A SER 494.A OG TYR 451.A O no hydrogen 2.978 N/A SER 494.A OG TYR 495.A O no hydrogen 3.460 N/A TYR 495.A N TYR 451.A O no hydrogen 2.525 N/A THR 500.A OG1 ASN 501.A OD1 no hydrogen 3.461 N/A ASN 501.A N GLN 498.A O no hydrogen 3.232 N/A ASN 501.A ND2 GLY 496.A O no hydrogen 3.339 N/A GLN 506.A N VAL 503.A O no hydrogen 3.332 N/A TYR 508.A N ILE 402.A O no hydrogen 3.093 N/A ARG 509.A N TRP 436.A O no hydrogen 2.336 N/A ARG 509.A NH1 ALA 344.A O no hydrogen 2.649 N/A ARG 509.A NH2 ALA 344.A O no hydrogen 2.891 N/A VAL 510.A N PHE 400.A O no hydrogen 2.772 N/A VAL 511.A N ILE 434.A O no hydrogen 2.466 N/A VAL 512.A N ASP 398.A O no hydrogen 2.686 N/A LEU 513.A N CYS 432.A O no hydrogen 2.877 N/A SER 514.A N TYR 396.A O no hydrogen 3.284 N/A GLU 516.A N ASN 394.A O no hydrogen 3.080 N/A ALA 520.A N LEU 518.A O no hydrogen 2.743 N/A THR 523.A N PHE 392.A O no hydrogen 2.788 N/A VAL 524.A N PHE 392.A O no hydrogen 3.162 N/A SER 530.A OG PHE 329.A O no hydrogen 3.347 N/A THR 531.A N VAL 327.A O no hydrogen 2.891 N/A ASN 536.A N LEU 552.A O no hydrogen 3.365 N/A VAL 539.A N GLY 550.A O no hydrogen 3.112 N/A ASN 540.A N GLU 324.A O no hydrogen 3.115 N/A PHE 541.A N VAL 539.A O no hydrogen 2.710 N/A PHE 543.A N LEU 546.A O no hydrogen 2.810 N/A GLY 545.A N ASN 542.A OD1 no hydrogen 2.987 N/A LEU 546.A N PHE 543.A O no hydrogen 2.685 N/A VAL 551.A N THR 588.A O no hydrogen 2.857 N/A THR 553.A OG1 VAL 551.A O no hydrogen 2.447 N/A SER 555.A N ILE 584.A O no hydrogen 2.824 N/A LYS 557.A NZ ASP 574.A O no hydrogen 2.743 N/A LYS 557.A NZ ASP 574.A OD2 no hydrogen 2.251 N/A LYS 558.A NZ ASN 556.A O no hydrogen 2.988 N/A LEU 560.A N GLN 563.A OE1 no hydrogen 2.870 N/A GLN 563.A N LEU 560.A O no hydrogen 2.413 N/A ARG 567.A NH1 ASP 571.A O no hydrogen 3.426 N/A ASP 571.A N ASP 568.A O no hydrogen 2.871 N/A ASP 574.A N GLY 566.A O no hydrogen 2.850 N/A ASP 578.A N GLU 583.A O no hydrogen 3.503 N/A GLN 580.A N ASP 578.A OD1 no hydrogen 3.299 N/A GLN 580.A NE2 SER 530.A OG no hydrogen 2.349 N/A THR 581.A N ASP 578.A O no hydrogen 2.956 N/A THR 581.A OG1 GLN 580.A O no hydrogen 2.403 N/A ASP 586.A N THR 553.A O no hydrogen 2.319 N/A CYS 590.A SG VAL 320.A O no hydrogen 3.791 N/A GLY 593.A N PHE 318.A O no hydrogen 3.029 N/A VAL 595.A N SER 316.A O no hydrogen 3.012 N/A SER 596.A N LEU 611.A O no hydrogen 3.147 N/A VAL 597.A N TYR 313.A O no hydrogen 2.697 N/A ILE 598.A N ALA 609.A O no hydrogen 2.733 N/A THR 599.A N GLY 311.A O no hydrogen 3.084 N/A THR 599.A OG1 PRO 600.A O no hydrogen 2.562 N/A THR 602.A N VAL 308.A O no hydrogen 2.756 N/A THR 602.A OG1 VAL 308.A O no hydrogen 3.564 N/A THR 604.A N GLY 601.A O no hydrogen 2.513 N/A SER 605.A N GLY 601.A O no hydrogen 3.274 N/A GLU 607.A N SER 605.A OG no hydrogen 3.018 N/A ALA 609.A N ILE 598.A O no hydrogen 2.926 N/A VAL 610.A N ILE 651.A O no hydrogen 3.126 N/A LEU 611.A N SER 596.A O no hydrogen 2.660 N/A TYR 612.A N CYS 649.A O no hydrogen 3.213 N/A GLN 613.A N GLY 594.A O no hydrogen 2.941 N/A ASP 614.A N ALA 647.A O no hydrogen 3.263 N/A CYS 617.A N GLN 644.A OE1 no hydrogen 3.372 N/A GLU 619.A N ASN 616.A O no hydrogen 3.280 N/A GLN 644.A NE2 THR 645.A O no hydrogen 3.110 N/A THR 645.A N GLY 648.A O no hydrogen 3.164 N/A ARG 646.A N THR 645.A OG1 no hydrogen 2.328 N/A CYS 649.A N TYR 612.A O no hydrogen 2.940 N/A LEU 650.A N PHE 643.A O no hydrogen 2.797 N/A ILE 651.A N VAL 610.A O no hydrogen 2.866 N/A GLU 654.A N ILE 692.A O no hydrogen 3.358 N/A VAL 656.A N ALA 694.A O no hydrogen 3.446 N/A ASN 658.A ND2 TYR 660.A OH no hydrogen 2.548 N/A ILE 664.A N ALA 672.A O no hydrogen 3.203 N/A ILE 670.A N GLY 667.A O no hydrogen 3.364 N/A CYS 671.A N TYR 695.A O no hydrogen 3.016 N/A CYS 671.A SG GLY 669.A O no hydrogen 3.947 N/A CYS 671.A SG ILE 670.A O no hydrogen 3.139 N/A ALA 672.A N ILE 664.A O no hydrogen 2.874 N/A SER 673.A N ILE 693.A O no hydrogen 2.677 N/A SER 673.A OG ALA 672.A O no hydrogen 2.606 N/A SER 673.A OG TYR 695.A OH no hydrogen 2.228 N/A TYR 674.A OH GLN 690.A OE1 no hydrogen 2.191 N/A GLN 675.A N SER 691.A O no hydrogen 3.106 N/A GLN 690.A NE2 THR 676.A OG1 no hydrogen 2.547 N/A SER 691.A N GLN 675.A O no hydrogen 3.175 N/A SER 691.A OG GLU 654.A OE2 no hydrogen 3.330 N/A SER 691.A OG ILE 692.A O no hydrogen 3.163 N/A ILE 693.A N SER 673.A O no hydrogen 2.660 N/A ALA 694.A N GLU 654.A O no hydrogen 3.124 N/A TYR 695.A OH GLU 661.A O no hydrogen 3.112 N/A TYR 695.A OH SER 673.A OG no hydrogen 2.228 N/A MET 697.A N GLY 669.A O no hydrogen 3.118 N/A SER 698.A OG SER 659.A O no hydrogen 3.539 N/A SER 708.A OG ASN 710.A OD1 no hydrogen 2.670 N/A ASN 710.A N SER 708.A OG no hydrogen 2.561 N/A SER 711.A N SER 708.A OG no hydrogen 2.491 N/A ILE 714.A N LYS 1073.A O no hydrogen 3.374 N/A THR 716.A N GLN 1071.A O no hydrogen 2.311 N/A THR 716.A OG1 GLN 1071.A O no hydrogen 2.561 N/A ASN 717.A N GLN 1071.A O no hydrogen 3.437 N/A THR 719.A N VAL 1068.A O no hydrogen 2.668 N/A SER 721.A OG THR 1066.A OG1 no hydrogen 2.602 N/A THR 723.A N HIS 1064.A O no hydrogen 3.392 N/A GLU 725.A N PHE 1062.A O no hydrogen 3.367 N/A LEU 727.A N VAL 1060.A O no hydrogen 3.038 N/A MET 731.A N GLN 774.A OE1 no hydrogen 2.475 N/A LYS 733.A NZ ASP 775.A OD1 no hydrogen 2.920 N/A LYS 733.A NZ ASP 775.A OD2 no hydrogen 2.522 N/A SER 735.A N THR 859.A O no hydrogen 2.937 N/A ASP 737.A N GLY 857.A O no hydrogen 3.399 N/A MET 740.A N ASP 737.A OD2 no hydrogen 3.055 N/A TYR 741.A N ASP 737.A O no hydrogen 2.951 N/A TYR 741.A OH LEU 962.A O no hydrogen 2.999 N/A ILE 742.A N CYS 738.A O no hydrogen 2.848 N/A CYS 743.A N THR 739.A O no hydrogen 2.987 N/A GLY 744.A N MET 740.A O no hydrogen 3.012 N/A SER 750.A N SER 746.A O no hydrogen 2.960 N/A SER 750.A OG SER 746.A O no hydrogen 2.842 N/A SER 750.A OG THR 747.A O no hydrogen 2.595 N/A ASN 751.A N THR 747.A O no hydrogen 2.947 N/A LEU 752.A N GLU 748.A O no hydrogen 2.937 N/A LEU 753.A N CYS 749.A O no hydrogen 2.880 N/A LEU 754.A N SER 750.A O no hydrogen 2.931 N/A GLN 755.A N LEU 752.A O no hydrogen 2.972 N/A TYR 756.A N LEU 753.A O no hydrogen 2.919 N/A TYR 756.A OH ASP 994.A OD1 no hydrogen 3.368 N/A TYR 756.A OH THR 998.A OG1 no hydrogen 3.046 N/A GLN 762.A NE2 SER 758.A O no hydrogen 3.535 N/A ASN 764.A N CYS 760.A O no hydrogen 2.924 N/A ARG 765.A N THR 761.A O no hydrogen 2.898 N/A ALA 766.A N GLN 762.A O no hydrogen 2.854 N/A LEU 767.A N LEU 763.A O no hydrogen 2.992 N/A THR 768.A N ASN 764.A O no hydrogen 2.931 N/A THR 768.A OG1 ASN 764.A O no hydrogen 3.399 N/A GLY 769.A N ARG 765.A O no hydrogen 2.906 N/A ILE 770.A N ALA 766.A O no hydrogen 2.969 N/A ALA 771.A N LEU 767.A O no hydrogen 3.005 N/A VAL 772.A N THR 768.A O no hydrogen 2.988 N/A GLU 773.A N GLY 769.A O no hydrogen 2.945 N/A GLN 774.A N ILE 770.A O no hydrogen 2.975 N/A GLN 774.A NE2 ILE 770.A O no hydrogen 3.323 N/A ASP 775.A N ALA 771.A O no hydrogen 3.131 N/A LYS 776.A N VAL 772.A O no hydrogen 2.960 N/A ASN 777.A N GLU 773.A O no hydrogen 2.858 N/A ASN 777.A ND2 VAL 729.A O no hydrogen 3.622 N/A THR 778.A N GLN 774.A O no hydrogen 3.093 N/A GLN 779.A N ASP 775.A O no hydrogen 3.043 N/A GLU 780.A N LYS 776.A O no hydrogen 2.899 N/A VAL 781.A N ASN 777.A O no hydrogen 2.972 N/A PHE 782.A N THR 778.A O no hydrogen 2.991 N/A ALA 783.A N GLN 779.A O no hydrogen 2.900 N/A GLN 784.A N PHE 782.A O no hydrogen 2.533 N/A GLN 784.A NE2 ALA 1026.A O no hydrogen 3.692 N/A THR 791.A OG1 PRO 792.A O no hydrogen 2.968 N/A LYS 795.A NZ THR 791.A OG1 no hydrogen 3.429 N/A LYS 795.A NZ PRO 792.A O no hydrogen 2.474 N/A ASP 796.A N ASP 796.A OD1 no hydrogen 2.501 N/A GLY 798.A N ASP 796.A O no hydrogen 2.970 N/A PHE 800.A N PHE 797.A O no hydrogen 2.756 N/A ASN 801.A N ASN 928.A OD1 no hydrogen 3.006 N/A ILE 805.A N PHE 802.A O no hydrogen 3.416 N/A LEU 806.A N PHE 802.A O no hydrogen 3.002 N/A ASP 808.A N ARG 815.A O no hydrogen 3.062 N/A SER 810.A N ASP 808.A OD1 no hydrogen 3.178 N/A SER 810.A OG ASP 808.A OD1 no hydrogen 3.403 N/A LYS 811.A NZ ASP 820.A OD1 no hydrogen 3.265 N/A LYS 811.A NZ ASP 820.A OD2 no hydrogen 2.250 N/A SER 813.A OG SER 813.A O no hydrogen 2.242 N/A ARG 815.A N SER 813.A O no hydrogen 2.595 N/A ARG 815.A NH2 ASP 820.A OD1 no hydrogen 3.108 N/A ASP 820.A N SER 816.A O no hydrogen 2.876 N/A LEU 821.A N PHE 817.A O no hydrogen 2.985 N/A LEU 822.A N ILE 818.A O no hydrogen 2.937 N/A PHE 823.A N GLU 819.A O no hydrogen 2.895 N/A ASN 824.A N ASP 820.A O no hydrogen 2.957 N/A LYS 825.A N LEU 821.A O no hydrogen 3.201 N/A VAL 826.A N PHE 823.A O no hydrogen 3.496 N/A THR 827.A N GLN 949.A OE1 no hydrogen 3.489 N/A THR 859.A N GLY 857.A O no hydrogen 3.059 N/A MET 869.A N THR 866.A O no hydrogen 2.679 N/A ILE 870.A N THR 866.A O no hydrogen 2.941 N/A ALA 871.A N ASP 867.A O no hydrogen 2.904 N/A GLN 872.A N GLU 868.A O no hydrogen 2.959 N/A TYR 873.A N MET 869.A O no hydrogen 2.919 N/A THR 874.A N ILE 870.A O no hydrogen 2.984 N/A THR 874.A OG1 ALA 871.A O no hydrogen 3.317 N/A SER 875.A N ALA 871.A O no hydrogen 2.927 N/A ALA 876.A N GLN 872.A O no hydrogen 2.901 N/A LEU 877.A N TYR 873.A O no hydrogen 2.950 N/A LEU 878.A N THR 874.A O no hydrogen 2.915 N/A ALA 879.A N SER 875.A O no hydrogen 2.909 N/A GLY 880.A N ALA 876.A O no hydrogen 2.887 N/A THR 881.A N LEU 877.A O no hydrogen 2.946 N/A THR 881.A OG1 LEU 877.A O no hydrogen 3.307 N/A ILE 882.A N LEU 878.A O no hydrogen 2.941 N/A THR 883.A N ALA 879.A O no hydrogen 2.982 N/A THR 883.A OG1 ALA 879.A O no hydrogen 2.549 N/A SER 884.A N GLY 880.A O no hydrogen 2.897 N/A SER 884.A N THR 881.A O no hydrogen 3.271 N/A SER 884.A OG GLY 880.A O no hydrogen 2.295 N/A GLY 885.A N THR 881.A O no hydrogen 2.921 N/A THR 887.A N SER 884.A O no hydrogen 3.312 N/A THR 887.A OG1 SER 884.A O no hydrogen 2.401 N/A THR 887.A OG1 LEU 894.A O no hydrogen 3.409 N/A GLY 889.A N TRP 886.A O no hydrogen 2.847 N/A ALA 890.A N TRP 886.A O no hydrogen 3.004 N/A GLY 891.A N THR 887.A O no hydrogen 2.894 N/A GLN 895.A N GLN 895.A OE1 no hydrogen 2.582 N/A ILE 896.A N THR 883.A O no hydrogen 3.227 N/A GLN 901.A N PRO 897.A O no hydrogen 2.930 N/A MET 902.A N PHE 898.A O no hydrogen 2.903 N/A ALA 903.A N ALA 899.A O no hydrogen 2.868 N/A TYR 904.A N MET 900.A O no hydrogen 2.916 N/A ARG 905.A N GLN 901.A O no hydrogen 2.954 N/A ARG 905.A NH1 GLY 1035.A O no hydrogen 2.976 N/A ARG 905.A NH1 LEU 1049.A O no hydrogen 2.734 N/A PHE 906.A N MET 902.A O no hydrogen 2.851 N/A ASN 907.A N ALA 903.A O no hydrogen 2.903 N/A GLY 908.A N ARG 905.A O no hydrogen 2.637 N/A ILE 909.A N PHE 906.A O no hydrogen 3.317 N/A GLY 910.A N ASN 907.A O no hydrogen 3.441 N/A VAL 911.A N PHE 906.A O no hydrogen 3.174 N/A THR 912.A N GLN 1106.A OE1 no hydrogen 3.083 N/A THR 912.A OG1 GLN 1106.A OE1 no hydrogen 2.406 N/A GLN 913.A N GLN 913.A OE1 no hydrogen 3.274 N/A VAL 915.A N THR 912.A O no hydrogen 3.023 N/A TYR 917.A N GLN 913.A O no hydrogen 2.942 N/A GLU 918.A N ASN 914.A O no hydrogen 2.875 N/A ASN 919.A N VAL 915.A O no hydrogen 2.946 N/A GLN 920.A NE2 GLY 798.A O no hydrogen 2.864 N/A ILE 923.A N ASN 919.A O no hydrogen 2.892 N/A ALA 924.A N GLN 920.A O no hydrogen 2.886 N/A ASN 925.A N LYS 921.A O no hydrogen 2.958 N/A GLN 926.A N LEU 922.A O no hydrogen 2.895 N/A GLN 926.A NE2 PHE 718.A O no hydrogen 3.114 N/A PHE 927.A N ILE 923.A O no hydrogen 2.892 N/A ASN 928.A N ALA 924.A O no hydrogen 2.929 N/A ASN 928.A ND2 GLY 799.A O no hydrogen 3.432 N/A SER 929.A N ASN 925.A O no hydrogen 2.911 N/A SER 929.A OG ASN 925.A O no hydrogen 2.497 N/A ALA 930.A N GLN 926.A O no hydrogen 2.906 N/A ILE 931.A N PHE 927.A O no hydrogen 2.939 N/A GLY 932.A N ASN 928.A O no hydrogen 2.935 N/A LYS 933.A N SER 929.A O no hydrogen 2.899 N/A ILE 934.A N ALA 930.A O no hydrogen 2.946 N/A GLN 935.A N ILE 931.A O no hydrogen 2.944 N/A ASP 936.A N GLY 932.A O no hydrogen 2.920 N/A SER 937.A N LYS 933.A O no hydrogen 2.900 N/A LEU 938.A N ILE 934.A O no hydrogen 2.962 N/A SER 939.A N GLN 935.A O no hydrogen 2.863 N/A SER 939.A OG GLN 935.A O no hydrogen 2.330 N/A SER 939.A OG ASP 936.A O no hydrogen 3.097 N/A SER 940.A N ASP 936.A O no hydrogen 2.915 N/A THR 941.A N SER 937.A O no hydrogen 2.929 N/A SER 943.A OG SER 943.A O no hydrogen 2.277 N/A LYS 947.A NZ ILE 726.A O no hydrogen 3.519 N/A GLN 949.A N LEU 945.A O no hydrogen 3.014 N/A GLN 949.A NE2 THR 827.A OG1 no hydrogen 2.642 N/A ASP 950.A N GLY 946.A O no hydrogen 2.825 N/A VAL 951.A N LYS 947.A O no hydrogen 2.998 N/A VAL 952.A N LEU 948.A O no hydrogen 3.039 N/A ASN 953.A N GLN 949.A O no hydrogen 2.877 N/A GLN 954.A N ASP 950.A O no hydrogen 2.884 N/A ASN 955.A N VAL 951.A O no hydrogen 3.064 N/A ALA 956.A N VAL 952.A O no hydrogen 2.950 N/A GLN 957.A N ASN 953.A O no hydrogen 2.872 N/A ALA 958.A N GLN 954.A O no hydrogen 2.961 N/A LEU 959.A N ASN 955.A O no hydrogen 2.984 N/A ASN 960.A N ALA 956.A O no hydrogen 2.937 N/A THR 961.A N GLN 957.A O no hydrogen 2.901 N/A THR 961.A OG1 GLN 957.A O no hydrogen 3.076 N/A LEU 962.A N ALA 958.A O no hydrogen 2.940 N/A VAL 963.A N LEU 959.A O no hydrogen 2.954 N/A LYS 964.A N ASN 960.A O no hydrogen 2.901 N/A GLN 965.A N THR 961.A O no hydrogen 2.929 N/A LEU 966.A N VAL 963.A O no hydrogen 2.812 N/A SER 967.A N LYS 964.A O no hydrogen 3.265 N/A SER 968.A OG GLN 965.A O no hydrogen 3.107 N/A ALA 972.A N ASN 969.A O no hydrogen 2.761 N/A ILE 973.A N GLN 992.A OE1 no hydrogen 3.278 N/A ILE 980.A N VAL 976.A O no hydrogen 2.991 N/A LEU 981.A N LEU 977.A O no hydrogen 2.894 N/A SER 982.A N ASN 978.A O no hydrogen 2.902 N/A SER 982.A OG ASP 979.A O no hydrogen 3.120 N/A ARG 983.A N ASP 979.A O no hydrogen 2.888 N/A LEU 984.A N ILE 980.A O no hydrogen 2.990 N/A GLU 988.A N ASP 985.A O no hydrogen 3.083 N/A GLU 988.A N ASP 985.A OD1 no hydrogen 3.221 N/A ALA 989.A N ASP 985.A O no hydrogen 2.857 N/A GLU 990.A N PRO 986.A O no hydrogen 2.886 N/A GLN 992.A N GLU 988.A O no hydrogen 3.040 N/A ILE 993.A N ALA 989.A O no hydrogen 2.850 N/A ASP 994.A N GLU 990.A O no hydrogen 2.853 N/A ARG 995.A N VAL 991.A O no hydrogen 2.964 N/A ARG 995.A NH1 GLY 971.A O no hydrogen 2.792 N/A LEU 996.A N GLN 992.A O no hydrogen 3.018 N/A ILE 997.A N ILE 993.A O no hydrogen 2.838 N/A THR 998.A N ASP 994.A O no hydrogen 2.926 N/A THR 998.A OG1 TYR 756.A OH no hydrogen 3.046 N/A GLY 999.A N ARG 995.A O no hydrogen 3.014 N/A ARG 1000.A N LEU 996.A O no hydrogen 2.934 N/A ARG 1000.A NH1 ILE 742.A O no hydrogen 2.392 N/A LEU 1001.A N ILE 997.A O no hydrogen 2.835 N/A GLN 1002.A N THR 998.A O no hydrogen 2.944 N/A SER 1003.A N GLY 999.A O no hydrogen 2.997 N/A LEU 1004.A N ARG 1000.A O no hydrogen 2.903 N/A GLN 1005.A N LEU 1001.A O no hydrogen 2.913 N/A THR 1006.A N GLN 1002.A O no hydrogen 2.953 N/A THR 1006.A OG1 GLN 1002.A O no hydrogen 3.531 N/A TYR 1007.A N SER 1003.A O no hydrogen 3.002 N/A VAL 1008.A N LEU 1004.A O no hydrogen 2.950 N/A THR 1009.A N GLN 1005.A O no hydrogen 2.951 N/A GLN 1010.A N THR 1006.A O no hydrogen 2.954 N/A GLN 1011.A N TYR 1007.A O no hydrogen 2.938 N/A LEU 1012.A N VAL 1008.A O no hydrogen 2.904 N/A ILE 1013.A N THR 1009.A O no hydrogen 3.018 N/A ARG 1014.A N GLN 1010.A O no hydrogen 2.926 N/A ALA 1015.A N GLN 1011.A O no hydrogen 2.841 N/A ALA 1016.A N LEU 1012.A O no hydrogen 2.969 N/A GLU 1017.A N ILE 1013.A O no hydrogen 3.050 N/A ILE 1018.A N ARG 1014.A O no hydrogen 2.914 N/A ARG 1019.A N ALA 1015.A O no hydrogen 2.866 N/A ARG 1019.A NH1 GLU 773.A OE2 no hydrogen 2.350 N/A ALA 1020.A N ALA 1016.A O no hydrogen 2.947 N/A SER 1021.A N GLU 1017.A O no hydrogen 3.012 N/A ALA 1022.A N ILE 1018.A O no hydrogen 2.818 N/A ASN 1023.A N ARG 1019.A O no hydrogen 2.867 N/A LEU 1024.A N ALA 1020.A O no hydrogen 2.958 N/A ALA 1025.A N SER 1021.A O no hydrogen 2.876 N/A ALA 1026.A N ALA 1022.A O no hydrogen 2.876 N/A THR 1027.A N ASN 1023.A O no hydrogen 2.930 N/A LYS 1028.A N LEU 1024.A O no hydrogen 2.850 N/A LYS 1028.A NZ GLU 725.A OE1 no hydrogen 3.148 N/A LYS 1028.A NZ GLU 725.A OE2 no hydrogen 2.362 N/A LYS 1028.A NZ PHE 1042.A O no hydrogen 3.120 N/A MET 1029.A N ALA 1025.A O no hydrogen 2.850 N/A SER 1030.A N ALA 1026.A O no hydrogen 2.929 N/A GLU 1031.A N THR 1027.A O no hydrogen 2.944 N/A CYS 1032.A N LYS 1028.A O no hydrogen 2.820 N/A CYS 1032.A SG HIS 1048.A NE2 no hydrogen 3.336 N/A CYS 1032.A SG SER 1051.A OG no hydrogen 3.086 N/A CYS 1032.A SG HIS 1064.A ND1 no hydrogen 3.199 N/A VAL 1033.A N MET 1029.A O no hydrogen 2.948 N/A LEU 1034.A N MET 1029.A O no hydrogen 3.259 N/A GLN 1036.A NE2 ARG 905.A O no hydrogen 3.335 N/A GLN 1036.A NE2 HIS 1048.A O no hydrogen 3.238 N/A PHE 1042.A N ARG 1039.A O no hydrogen 3.082 N/A CYS 1043.A SG SER 1037.A OG no hydrogen 3.167 N/A TYR 1047.A N TYR 1067.A O no hydrogen 3.292 N/A LEU 1049.A N VAL 1065.A O no hydrogen 3.137 N/A MET 1050.A N VAL 1065.A O no hydrogen 3.405 N/A GLN 1054.A NE2 PRO 1053.A O no hydrogen 2.178 N/A VAL 1060.A N LEU 727.A O no hydrogen 2.943 N/A VAL 1061.A N GLN 1054.A O no hydrogen 2.738 N/A PHE 1062.A N GLU 725.A O no hydrogen 3.326 N/A LEU 1063.A N PHE 1052.A O no hydrogen 2.990 N/A HIS 1064.A N THR 723.A O no hydrogen 2.876 N/A HIS 1064.A NE2 GLU 725.A OE1 no hydrogen 2.273 N/A THR 1066.A N SER 721.A O no hydrogen 2.925 N/A THR 1066.A OG1 SER 721.A O no hydrogen 3.376 N/A TYR 1067.A N TYR 1047.A O no hydrogen 2.720 N/A VAL 1068.A N THR 719.A O no hydrogen 2.803 N/A ALA 1070.A N ASN 717.A O no hydrogen 3.219 N/A LYS 1073.A N ILE 714.A O no hydrogen 3.350 N/A THR 1077.A N ASN 710.A O no hydrogen 2.730 N/A THR 1077.A OG1 ALA 1078.A O no hydrogen 3.423 N/A THR 1077.A OG1 PHE 1095.A O no hydrogen 2.650 N/A ILE 1081.A N HIS 1088.A O no hydrogen 3.291 N/A CYS 1082.A N VAL 1133.A O no hydrogen 2.653 N/A HIS 1083.A N LYS 1086.A O no hydrogen 3.471 N/A LYS 1086.A NZ ASP 1084.A OD2 no hydrogen 3.149 N/A HIS 1088.A N ILE 1081.A O no hydrogen 2.908 N/A PHE 1089.A N PHE 1121.A O no hydrogen 2.951 N/A ARG 1091.A N ASN 1119.A O no hydrogen 2.972 N/A ARG 1091.A NH1 THR 1117.A O no hydrogen 3.222 N/A VAL 1094.A N THR 1105.A O no hydrogen 2.853 N/A VAL 1096.A N PHE 1103.A O no hydrogen 2.603 N/A ASN 1098.A ND2 THR 1100.A OG1 no hydrogen 2.385 N/A THR 1100.A OG1 HIS 1101.A ND1 no hydrogen 2.527 N/A HIS 1101.A N ASN 1098.A OD1 no hydrogen 3.446 N/A PHE 1103.A N VAL 1096.A O no hydrogen 2.736 N/A VAL 1104.A N GLN 1113.A O no hydrogen 3.297 N/A THR 1105.A N VAL 1094.A O no hydrogen 2.966 N/A THR 1105.A OG1 GLN 1106.A O no hydrogen 3.181 N/A ASN 1108.A ND2 GLY 910.A O no hydrogen 3.629 N/A TYR 1110.A N PRO 715.A O no hydrogen 2.605 N/A GLU 1111.A N THR 1105.A OG1 no hydrogen 2.949 N/A THR 1117.A N TYR 1138.A O no hydrogen 3.149 N/A THR 1117.A OG1 TYR 1138.A O no hydrogen 3.139 N/A ASP 1118.A N THR 1116.A OG1 no hydrogen 2.966 N/A ASN 1119.A N THR 1116.A O no hydrogen 3.274 N/A ASN 1119.A ND2 GLN 1113.A OE1 no hydrogen 3.356 N/A THR 1120.A OG1 PHE 1089.A O no hydrogen 2.417 N/A THR 1120.A OG1 PHE 1121.A O no hydrogen 3.233 N/A PHE 1121.A N PHE 1089.A O no hydrogen 2.914 N/A SER 1123.A N ALA 1087.A O no hydrogen 3.008 N/A CYS 1126.A SG GLY 1085.A O no hydrogen 3.053 N/A ASP 1127.A N ASN 1125.A OD1 no hydrogen 2.866 N/A VAL 1133.A N ALA 1080.A O no hydrogen 3.090 N/A ASN 1135.A N CYS 1082.A O no hydrogen 3.270 N/A GLN 1142.A NE2 ASP 1139.A OD2 no hydrogen 2.394 N/A LEU 1145.A N LEU 1141.A O no hydrogen 2.903 N/A ASP 1146.A N GLN 1142.A O no hydrogen 2.907 N/A SER 1147.A N PRO 1143.A O no hydrogen 2.891 N/A SER 1147.A OG PRO 1143.A O no hydrogen 2.619 N/A SER 1147.A OG GLU 1144.A O no hydrogen 3.332 N/A