Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jti_f.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N GLY 4.A O no hydrogen 2.791 N/A LYS 8.A N ARG 6.A O no hydrogen 2.716 N/A VAL 11.A N LYS 8.A O no hydrogen 3.441 N/A GLN 12.A N LYS 8.A O no hydrogen 3.068 N/A GLN 14.A N VAL 11.A O no hydrogen 3.011 N/A GLN 15.A N VAL 11.A O no hydrogen 2.656 N/A GLN 15.A N GLN 12.A O no hydrogen 3.143 N/A SER 16.A N GLN 12.A O no hydrogen 2.916 N/A ALA 19.A N GLN 15.A O no hydrogen 3.211 N/A ALA 20.A N PRO 17.A O no hydrogen 3.144 N/A GLY 23.A N ALA 19.A O no hydrogen 2.825 N/A LYS 31.A N LYS 27.A O no hydrogen 3.347 N/A ARG 33.A N SER 29.A O no hydrogen 2.927 N/A ARG 34.A N GLY 30.A O no hydrogen 2.911 N/A ASP 35.A N LYS 31.A O no hydrogen 2.885 N/A ALA 36.A N GLU 32.A O no hydrogen 2.870 N/A GLY 37.A N ARG 33.A O no hydrogen 2.936 N/A ASP 38.A N ARG 34.A O no hydrogen 2.878 N/A LYS 39.A N ASP 35.A O no hydrogen 2.868 N/A ASP 40.A N ALA 36.A O no hydrogen 2.877 N/A LYS 41.A N GLY 37.A O no hydrogen 2.931 N/A GLU 42.A N ASP 38.A O no hydrogen 2.882 N/A GLN 43.A N LYS 39.A O no hydrogen 2.874 N/A GLU 44.A N ASP 40.A O no hydrogen 2.885 N/A LEU 45.A N LYS 41.A O no hydrogen 2.915 N/A SER 46.A N GLU 42.A O no hydrogen 3.183 N/A GLU 47.A N GLU 44.A O no hydrogen 3.180 N/A GLY 64.A N VAL 60.A O no hydrogen 2.997 N/A THR 68.A N GLY 64.A O no hydrogen 2.879 N/A SER 69.A N GLU 65.A O no hydrogen 2.901 N/A LEU 70.A N LYS 66.A O no hydrogen 2.894 N/A ARG 72.A N THR 68.A O no hydrogen 3.450 N/A SER 85.A N GLN 81.A O no hydrogen 3.305 N/A THR 86.A N ILE 82.A O no hydrogen 2.891 N/A THR 86.A N ARG 83.A O no hydrogen 3.260 N/A THR 87.A N ARG 83.A O no hydrogen 2.892 N/A THR 90.A N THR 86.A O no hydrogen 2.876 N/A VAL 92.A N MET 89.A O no hydrogen 3.053 N/A LYS 94.A N SER 91.A O no hydrogen 3.279 N/A LEU 96.A N PRO 93.A O no hydrogen 3.025 N/A LYS 97.A N PRO 93.A O no hydrogen 2.676 N/A HIS 102.A N ARG 100.A O no hydrogen 2.623 N/A LYS 105.A N HIS 102.A O no hydrogen 3.008 N/A GLU 108.A N LYS 105.A O no hydrogen 3.290 N/A TYR 110.A N LEU 106.A O no hydrogen 3.516 N/A ARG 120.A N GLU 117.A O no hydrogen 2.566 N/A PHE 121.A N ASN 118.A O no hydrogen 3.357 N/A ALA 122.A N LYS 119.A O no hydrogen 3.334 N/A SER 134.A N ALA 130.A O no hydrogen 2.890 N/A GLY 135.A N MET 131.A O no hydrogen 2.920 N/A GLU 136.A N THR 132.A O no hydrogen 2.873 N/A ARG 137.A N MET 133.A O no hydrogen 2.916 N/A GLU 138.A N SER 134.A O no hydrogen 2.937 N/A CYS 139.A N GLU 136.A O no hydrogen 3.230 N/A LYS 141.A N ARG 137.A O no hydrogen 2.970 N/A TYR 142.A N ARG 137.A O no hydrogen 3.409 N/A LEU 144.A N LEU 140.A O no hydrogen 2.911 N/A VAL 145.A N LYS 141.A O no hydrogen 2.940 N/A GLY 146.A N TYR 142.A O no hydrogen 2.949 N/A HIS 156.A N SER 153.A O no hydrogen 3.249 N/A LEU 162.A N TYR 158.A O no hydrogen 2.931 N/A ALA 163.A N VAL 159.A O no hydrogen 2.877 N/A GLY 164.A N ARG 160.A O no hydrogen 2.875 N/A GLU 165.A N HIS 161.A O no hydrogen 2.930 N/A VAL 166.A N LEU 162.A O no hydrogen 2.895 N/A ALA 167.A N ALA 163.A O no hydrogen 2.869 N/A LYS 168.A N GLY 164.A O no hydrogen 2.919 N/A GLU 169.A N GLU 165.A O no hydrogen 2.892 N/A TRP 170.A N VAL 166.A O no hydrogen 2.874 N/A TRP 170.A N ALA 167.A O no hydrogen 3.096 N/A GLU 172.A N GLU 169.A O no hydrogen 3.198 N/A VAL 179.A N ALA 176.A O no hydrogen 2.600 N/A GLN 180.A N GLU 177.A O no hydrogen 2.935 N/A ARG 181.A N LYS 178.A O no hydrogen 2.909 N/A GLU 182.A N VAL 179.A O no hydrogen 2.864 N/A LEU 185.A N GLU 182.A O no hydrogen 2.902 N/A THR 186.A N GLU 182.A O no hydrogen 2.717 N/A VAL 188.A N PRO 183.A O no hydrogen 2.455 N/A HIS 198.A N TYR 194.A O no hydrogen 2.868 N/A ASN 199.A N ASN 195.A O no hydrogen 2.929 N/A ALA 200.A N MET 196.A O no hydrogen 2.876 N/A GLU 201.A N ALA 197.A O no hydrogen 2.909 N/A HIS 202.A N HIS 198.A O no hydrogen 2.868 N/A GLU 203.A N ASN 199.A O no hydrogen 2.932 N/A ALA 204.A N ALA 200.A O no hydrogen 2.905 N/A CYS 205.A N GLU 201.A O no hydrogen 2.867 N/A LEU 208.A N CYS 205.A O no hydrogen 3.384 N/A LEU 217.A N GLN 213.A O no hydrogen 2.828 N/A GLU 218.A N VAL 214.A O no hydrogen 2.919 N/A LYS 219.A N ASP 215.A O no hydrogen 2.901 N/A ASP 220.A N MET 216.A O no hydrogen 2.872 N/A ILE 221.A N LEU 217.A O no hydrogen 2.912 N/A ASP 222.A N GLU 218.A O no hydrogen 2.893 N/A GLU 223.A N ASP 220.A O no hydrogen 3.091 N/A ASN 224.A N ILE 221.A O no hydrogen 3.162 N/A TYR 232.A N LYS 228.A O no hydrogen 2.749 N/A LEU 233.A N VAL 229.A O no hydrogen 2.943 N/A THR 234.A N CYS 230.A O no hydrogen 2.916 N/A SER 235.A N LEU 231.A O no hydrogen 2.899 N/A CYS 236.A N TYR 232.A O no hydrogen 2.923 N/A VAL 237.A N LEU 233.A O no hydrogen 2.933 N/A ASN 238.A N THR 234.A O no hydrogen 2.914 N/A TYR 239.A N SER 235.A O no hydrogen 2.894 N/A VAL 240.A N CYS 236.A O no hydrogen 2.910 N/A GLU 242.A N TYR 239.A O no hydrogen 3.040 N/A GLU 244.A N PRO 241.A O no hydrogen 3.453 N/A ASN 245.A N PRO 241.A O no hydrogen 3.049 N/A LEU 249.A N PRO 243.A O no hydrogen 2.890 N/A PHE 256.A N ALA 252.A O no hydrogen 2.658 N/A ARG 257.A N LEU 253.A O no hydrogen 2.972 N/A ARG 261.A N LYS 258.A O no hydrogen 3.142 N/A ALA 269.A N ALA 265.A O no hydrogen 3.111 N/A LEU 270.A N LEU 266.A O no hydrogen 2.911 N/A MET 271.A N ARG 267.A O no hydrogen 2.856 N/A LEU 272.A N LEU 268.A O no hydrogen 2.901 N/A ASN 273.A N ALA 269.A O no hydrogen 2.892 N/A ASP 274.A N LEU 270.A O no hydrogen 2.883 N/A MET 275.A N MET 271.A O no hydrogen 2.908 N/A GLU 276.A N LEU 272.A O no hydrogen 2.867 N/A LEU 277.A N ASN 273.A O no hydrogen 2.888 N/A VAL 278.A N ASP 274.A O no hydrogen 2.911 N/A GLU 279.A N MET 275.A O no hydrogen 3.145 N/A ASP 287.A N THR 283.A O no hydrogen 2.876 N/A VAL 288.A N SER 284.A O no hydrogen 2.874 N/A VAL 289.A N CYS 285.A O no hydrogen 2.916 N/A VAL 290.A N LYS 286.A O no hydrogen 2.911 N/A PHE 296.A N LYS 292.A O no hydrogen 3.303 N/A MET 297.A N LYS 292.A O no hydrogen 3.026 N/A ARG 300.A N GLY 482.A O no hydrogen 2.595 N/A VAL 311.A N GLU 309.A O no hydrogen 2.787 N/A THR 318.A N GLU 315.A O no hydrogen 2.887 N/A GLU 319.A N ASP 316.A O no hydrogen 2.945 N/A ILE 320.A N LEU 317.A O no hydrogen 2.906 N/A MET 321.A N LEU 317.A O no hydrogen 3.140 N/A MET 321.A N THR 318.A O no hydrogen 2.918 N/A VAL 324.A N GLU 319.A O no hydrogen 2.664 N/A LEU 326.A N SER 322.A O no hydrogen 2.902 N/A ASN 327.A N ASN 323.A O no hydrogen 2.891 N/A SER 328.A N VAL 324.A O no hydrogen 2.864 N/A ASN 329.A N GLN 325.A O no hydrogen 2.905 N/A PHE 330.A N LEU 326.A O no hydrogen 2.918 N/A LEU 331.A N ASN 327.A O no hydrogen 2.859 N/A ALA 332.A N SER 328.A O no hydrogen 2.905 N/A LEU 333.A N ASN 329.A O no hydrogen 2.907 N/A ALA 334.A N PHE 330.A O no hydrogen 2.864 N/A ARG 335.A N LEU 331.A O no hydrogen 2.855 N/A LEU 337.A N ALA 332.A O no hydrogen 3.321 N/A ASP 338.A N ALA 334.A O no hydrogen 2.914 N/A MET 340.A N GLU 336.A O no hydrogen 2.847 N/A LYS 350.A N ASP 346.A O no hydrogen 3.157 N/A ASN 356.A N HIS 352.A O no hydrogen 2.973 N/A LEU 363.A N ARG 360.A O no hydrogen 2.946 N/A SER 365.A N MET 361.A O no hydrogen 2.903 N/A SER 366.A N ASN 362.A O no hydrogen 2.866 N/A PHE 367.A N LEU 363.A O no hydrogen 2.896 N/A VAL 368.A N ALA 364.A O no hydrogen 2.836 N/A ASN 369.A N SER 365.A O no hydrogen 2.925 N/A GLY 370.A N SER 366.A O no hydrogen 2.908 N/A PHE 371.A N PHE 367.A O no hydrogen 2.846 N/A GLY 386.A N THR 383.A O no hydrogen 3.132 N/A ASN 387.A N THR 383.A O no hydrogen 2.720 N/A LYS 388.A N ASP 384.A O no hydrogen 2.913 N/A LEU 390.A N ASN 387.A O no hydrogen 3.259 N/A MET 398.A N LYS 394.A O no hydrogen 2.726 N/A LEU 399.A N ASP 395.A O no hydrogen 2.900 N/A SER 400.A N HIS 396.A O no hydrogen 2.895 N/A ALA 401.A N GLY 397.A O no hydrogen 2.905 N/A ALA 402.A N MET 398.A O no hydrogen 2.912 N/A ALA 403.A N LEU 399.A O no hydrogen 2.917 N/A SER 404.A N SER 400.A O no hydrogen 2.846 N/A LEU 405.A N ALA 401.A O no hydrogen 2.953 N/A GLY 406.A N ALA 403.A O no hydrogen 2.801 N/A ILE 408.A N SER 404.A O no hydrogen 2.918 N/A ASP 412.A N VAL 442.A O no hydrogen 2.625 N/A GLN 419.A N GLY 415.A O no hydrogen 2.894 N/A ILE 420.A N GLY 416.A O no hydrogen 2.923 N/A ASP 421.A N LEU 417.A O no hydrogen 2.878 N/A TYR 423.A N ILE 420.A O no hydrogen 3.048 N/A SER 426.A N LEU 424.A O no hydrogen 2.705 N/A LYS 432.A N GLU 428.A O no hydrogen 3.457 N/A GLY 434.A N TYR 430.A O no hydrogen 3.209 N/A ALA 435.A N ILE 431.A O no hydrogen 2.885 N/A LEU 436.A N LYS 432.A O no hydrogen 2.914 N/A LEU 437.A N SER 433.A O no hydrogen 2.936 N/A ALA 438.A N GLY 434.A O no hydrogen 2.856 N/A CYS 439.A N ALA 435.A O no hydrogen 2.905 N/A GLY 440.A N LEU 436.A O no hydrogen 2.934 N/A ILE 441.A N LEU 437.A O no hydrogen 2.855 N/A VAL 442.A N ALA 438.A O no hydrogen 2.904 N/A ASN 443.A N CYS 439.A O no hydrogen 3.358 N/A SER 444.A N ILE 441.A O no hydrogen 2.963 N/A VAL 446.A N ASN 443.A O no hydrogen 3.048 N/A TYR 460.A N LEU 456.A O no hydrogen 2.898 N/A VAL 461.A N LEU 457.A O no hydrogen 2.899 N/A LEU 462.A N ASP 459.A O no hydrogen 3.363 N/A ASN 464.A N LEU 462.A O no hydrogen 2.794 N/A MET 468.A N ASN 466.A O no hydrogen 2.540 N/A GLY 471.A N THR 467.A O no hydrogen 3.056 N/A GLY 477.A N ILE 473.A O no hydrogen 3.373 N/A LEU 478.A N PHE 474.A O no hydrogen 2.887 N/A ALA 479.A N GLY 475.A O no hydrogen 2.913 N/A TYR 480.A N LEU 476.A O no hydrogen 3.026 N/A ALA 481.A N LEU 478.A O no hydrogen 3.230 N/A SER 483.A N TYR 480.A O no hydrogen 3.197 N/A THR 490.A N GLU 486.A O no hydrogen 2.891 N/A LEU 491.A N ASP 487.A O no hydrogen 2.909 N/A LEU 492.A N VAL 488.A O no hydrogen 2.904 N/A VAL 495.A N LEU 492.A O no hydrogen 3.112 N/A GLY 497.A N LEU 493.A O no hydrogen 2.906 N/A ALA 506.A N SER 502.A O no hydrogen 3.061 N/A GLY 507.A N MET 503.A O no hydrogen 2.970 N/A VAL 508.A N GLU 504.A O no hydrogen 2.915 N/A THR 509.A N VAL 505.A O no hydrogen 2.827 N/A ALA 510.A N ALA 506.A O no hydrogen 3.052 N/A LEU 511.A N GLY 507.A O no hydrogen 3.021 N/A ALA 512.A N VAL 508.A O no hydrogen 2.828 N/A CYS 513.A N THR 509.A O no hydrogen 2.909 N/A GLY 514.A N ALA 510.A O no hydrogen 2.987 N/A MET 515.A N LEU 511.A O no hydrogen 3.154 N/A ASP 524.A N CYS 521.A O no hydrogen 3.452 N/A THR 526.A N ASN 522.A O no hydrogen 2.885 N/A SER 527.A N GLY 523.A O no hydrogen 2.835 N/A THR 528.A N ASP 524.A O no hydrogen 2.942 N/A ILE 529.A N VAL 525.A O no hydrogen 2.858 N/A LEU 530.A N THR 526.A O no hydrogen 2.864 N/A GLN 531.A N SER 527.A O no hydrogen 2.877 N/A THR 532.A N THR 528.A O no hydrogen 2.917 N/A ILE 533.A N ILE 529.A O no hydrogen 2.864 N/A MET 534.A N LEU 530.A O no hydrogen 2.888 N/A GLU 535.A N THR 532.A O no hydrogen 3.324 N/A LYS 536.A N THR 532.A O no hydrogen 2.911 N/A ARG 547.A N ASP 543.A O no hydrogen 2.469 N/A LEU 549.A N TYR 545.A O no hydrogen 3.286 N/A GLY 554.A N PRO 550.A O no hydrogen 2.908 N/A LEU 555.A N LEU 551.A O no hydrogen 2.888 N/A ASN 556.A N GLY 552.A O no hydrogen 2.909 N/A HIS 557.A N LEU 553.A O no hydrogen 3.024 N/A HIS 557.A N GLY 554.A O no hydrogen 3.208 N/A LEU 558.A N LEU 555.A O no hydrogen 3.257 N/A LYS 560.A N ALA 590.A O no hydrogen 3.015 N/A ILE 567.A N ALA 563.A O no hydrogen 2.771 N/A LEU 568.A N ILE 564.A O no hydrogen 2.891 N/A ALA 569.A N GLU 565.A O no hydrogen 2.902 N/A ALA 570.A N ALA 566.A O no hydrogen 2.897 N/A LEU 571.A N ILE 567.A O no hydrogen 2.881 N/A GLU 572.A N LEU 568.A O no hydrogen 2.910 N/A VAL 573.A N ALA 570.A O no hydrogen 3.436 N/A SER 580.A N GLU 576.A O no hydrogen 2.390 N/A ASN 583.A N SER 580.A O no hydrogen 3.118 N/A LEU 585.A N ALA 582.A O no hydrogen 3.332 N/A CYS 589.A N LEU 585.A O no hydrogen 2.923 N/A TYR 591.A N VAL 588.A O no hydrogen 2.804 N/A VAL 600.A N ASN 596.A O no hydrogen 3.364 N/A GLN 601.A N VAL 597.A O no hydrogen 2.880 N/A GLN 602.A N LEU 598.A O no hydrogen 2.947 N/A LEU 603.A N LYS 599.A O no hydrogen 2.870 N/A LEU 603.A N VAL 600.A O no hydrogen 3.161 N/A HIS 605.A N GLN 601.A O no hydrogen 2.974 N/A ASP 612.A N GLU 609.A O no hydrogen 3.251 N/A LYS 620.A N LYS 616.A O no hydrogen 2.631 N/A ASP 621.A N GLU 617.A O no hydrogen 2.902 N/A LYS 622.A N GLU 618.A O no hydrogen 2.877 N/A LYS 623.A N ASP 619.A O no hydrogen 2.897 N/A GLU 624.A N LYS 620.A O no hydrogen 2.926 N/A LYS 625.A N ASP 621.A O no hydrogen 2.878 N/A LYS 626.A N LYS 622.A O no hydrogen 2.876 N/A ASP 627.A N LYS 623.A O no hydrogen 2.901 N/A LYS 628.A N LYS 625.A O no hydrogen 3.330 N/A ASP 629.A N LYS 626.A O no hydrogen 3.200 N/A GLY 642.A N GLY 638.A O no hydrogen 2.879 N/A VAL 643.A N ALA 639.A O no hydrogen 2.951 N/A ALA 644.A N HIS 640.A O no hydrogen 2.960 N/A VAL 645.A N GLN 641.A O no hydrogen 2.885 N/A LEU 646.A N GLY 642.A O no hydrogen 2.921 N/A GLY 647.A N VAL 643.A O no hydrogen 2.955 N/A ILE 648.A N ALA 644.A O no hydrogen 2.879 N/A ALA 649.A N VAL 645.A O no hydrogen 2.935 N/A LEU 650.A N LEU 646.A O no hydrogen 3.388 N/A GLU 660.A N ILE 657.A O no hydrogen 3.377 N/A MET 661.A N ILE 657.A O no hydrogen 3.008 N/A ARG 664.A N MET 661.A O no hydrogen 3.276 N/A HIS 668.A N ARG 664.A O no hydrogen 2.923 N/A LEU 669.A N PHE 666.A O no hydrogen 2.969 N/A LEU 670.A N PHE 666.A O no hydrogen 3.377 N/A LEU 677.A N GLU 674.A O no hydrogen 2.990 N/A ARG 679.A N PRO 675.A O no hydrogen 2.976 N/A ALA 680.A N THR 676.A O no hydrogen 2.892 N/A VAL 681.A N LEU 677.A O no hydrogen 2.929 N/A LEU 683.A N ALA 680.A O no hydrogen 3.162 N/A LEU 685.A N PRO 682.A O no hydrogen 3.178 N/A ALA 686.A N PRO 682.A O no hydrogen 2.728 N/A ASN 696.A N PRO 693.A O no hydrogen 2.697 N/A LEU 698.A N ARG 694.A O no hydrogen 2.942 N/A ASP 699.A N LEU 695.A O no hydrogen 2.921 N/A THR 700.A N ASN 696.A O no hydrogen 2.862 N/A LEU 701.A N ILE 697.A O no hydrogen 2.867 N/A SER 702.A N LEU 698.A O no hydrogen 2.915 N/A LYS 703.A N THR 700.A O no hydrogen 3.157 N/A PHE 704.A N LEU 701.A O no hydrogen 3.344 N/A SER 716.A N SER 713.A O no hydrogen 3.030 N/A PHE 718.A N TYR 714.A O no hydrogen 2.978 N/A ALA 719.A N ASN 715.A O no hydrogen 2.892 N/A MET 720.A N SER 716.A O no hydrogen 2.979 N/A GLY 721.A N ILE 717.A O no hydrogen 2.810 N/A MET 722.A N PHE 718.A O no hydrogen 2.978 N/A MET 722.A N ALA 719.A O no hydrogen 2.915 N/A VAL 723.A N ALA 719.A O no hydrogen 2.938 N/A GLY 724.A N MET 720.A O no hydrogen 2.505 N/A ALA 733.A N ALA 730.A O no hydrogen 3.248 N/A ALA 734.A N ALA 730.A O no hydrogen 2.963 N/A ARG 737.A N ALA 733.A O no hydrogen 2.964 N/A LEU 739.A N MET 735.A O no hydrogen 2.886 N/A ALA 740.A N LEU 736.A O no hydrogen 2.908 N/A GLN 741.A N ARG 737.A O no hydrogen 2.916 N/A TYR 742.A N GLN 738.A O no hydrogen 2.888 N/A HIS 743.A N ALA 740.A O no hydrogen 3.319 N/A GLN 757.A N HIS 761.A O no hydrogen 3.083 N/A HIS 761.A N GLN 757.A O no hydrogen 3.221 N/A THR 768.A N GLY 765.A O no hydrogen 3.268 N/A LEU 769.A N GLY 765.A O no hydrogen 2.954 N/A CYS 770.A N THR 766.A O no hydrogen 2.859 N/A TYR 772.A N LEU 769.A O no hydrogen 3.285 N/A SER 774.A N CYS 770.A O no hydrogen 2.887 N/A ASP 775.A N PRO 771.A O no hydrogen 2.875 N/A ARG 776.A N TYR 772.A O no hydrogen 2.915 N/A ALA 785.A N GLN 781.A O no hydrogen 2.872 N/A GLY 786.A N GLN 781.A O no hydrogen 2.307 N/A THR 789.A N GLY 786.A O no hydrogen 2.889 N/A VAL 790.A N GLY 786.A O no hydrogen 2.468 N/A ARG 798.A N MET 752.A O no hydrogen 2.769 N/A ASN 799.A N VAL 797.A O no hydrogen 2.907 N/A GLN 817.A N THR 854.A O no hydrogen 2.867 N/A ARG 819.A N THR 852.A O no hydrogen 2.888 N/A ARG 829.A N GLU 827.A O no hydrogen 2.932 N/A THR 852.A N ARG 819.A O no hydrogen 2.911 N/A THR 852.A N MET 820.A O no hydrogen 3.259 N/A THR 854.A N GLN 817.A O no hydrogen 2.893 N/A