Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8gwf_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N THR 12.A O no hydrogen 3.391 N/A CYS 5.A N SER 10.A O no hydrogen 2.891 N/A VAL 6.A N PHE 24.A O no hydrogen 3.083 N/A CYS 8.A SG SER 100.A OG no hydrogen 3.361 N/A ASN 9.A N CYS 5.A O no hydrogen 2.983 N/A SER 10.A OG THR 96.A O no hydrogen 3.516 N/A THR 12.A N GLY 3.A O no hydrogen 2.781 N/A THR 12.A OG1 LEU 25.A O no hydrogen 2.915 N/A SER 13.A OG SER 44.A OG no hydrogen 3.130 N/A LEU 14.A N THR 12.A OG1 no hydrogen 2.927 N/A ARG 15.A N LEU 43.A O no hydrogen 2.520 N/A CYS 16.A SG HIS 33.A NE2 no hydrogen 3.142 N/A CYS 16.A SG LEU 41.A O no hydrogen 3.990 N/A GLY 17.A N LEU 41.A O no hydrogen 2.807 N/A CYS 19.A SG HIS 33.A NE2 no hydrogen 3.705 N/A CYS 19.A SG HIS 39.A ND1 no hydrogen 3.217 N/A ARG 21.A NE GLU 136.A OE2 no hydrogen 2.428 N/A ARG 21.A NH2 GLU 136.A OE2 no hydrogen 2.983 N/A ARG 22.A N CYS 19.A O no hydrogen 3.125 N/A LEU 25.A N LEU 14.A O no hydrogen 3.198 N/A CYS 30.A N CYS 26.A O no hydrogen 2.300 N/A TYR 31.A N CYS 27.A O no hydrogen 2.932 N/A ASP 32.A N LYS 28.A O no hydrogen 2.951 N/A HIS 33.A N CYS 29.A O no hydrogen 2.863 N/A VAL 34.A N CYS 30.A O no hydrogen 2.902 N/A ILE 35.A N TYR 31.A O no hydrogen 2.936 N/A SER 36.A N ASP 32.A O no hydrogen 3.238 N/A SER 36.A OG ASP 32.A O no hydrogen 3.246 N/A THR 37.A OG1 SER 36.A O no hydrogen 2.737 N/A THR 37.A OG1 ASN 107.A OD1 no hydrogen 2.208 N/A SER 38.A OG SER 38.A O no hydrogen 2.237 N/A HIS 39.A ND1 HIS 33.A NE2 no hydrogen 3.080 N/A LYS 40.A NZ VAL 34.A O no hydrogen 2.352 N/A LEU 43.A N ARG 15.A O no hydrogen 2.483 N/A SER 44.A N ASN 46.A O no hydrogen 3.266 N/A SER 44.A OG SER 13.A O no hydrogen 3.375 N/A SER 44.A OG SER 13.A OG no hydrogen 3.130 N/A TYR 48.A N VAL 42.A O no hydrogen 3.396 N/A TYR 48.A OH PHE 90.A O no hydrogen 2.414 N/A CYS 50.A N VAL 57.A O no hydrogen 3.425 N/A CYS 50.A SG HIS 75.A ND1 no hydrogen 4.000 N/A ASN 51.A N TYR 70.A O no hydrogen 3.096 N/A CYS 55.A N ALA 52.A O no hydrogen 3.022 N/A THR 61.A OG1 ASP 59.A OD2 no hydrogen 2.796 N/A TYR 64.A N TYR 71.A O no hydrogen 2.358 N/A LEU 65.A N PHE 81.A O no hydrogen 2.366 N/A GLY 66.A N SER 69.A O no hydrogen 3.450 N/A SER 69.A OG ASN 51.A OD1 no hydrogen 2.375 N/A SER 69.A OG TYR 70.A O no hydrogen 3.084 N/A TYR 70.A N ASN 51.A OD1 no hydrogen 2.815 N/A TYR 71.A N TYR 64.A O no hydrogen 2.660 N/A CYS 72.A SG SER 74.A OG no hydrogen 2.712 N/A CYS 72.A SG HIS 75.A ND1 no hydrogen 2.475 N/A LYS 73.A N GLN 62.A OE1 no hydrogen 3.442 N/A LYS 73.A NZ GLN 62.A O no hydrogen 3.277 N/A HIS 75.A N CYS 72.A O no hydrogen 3.220 N/A LYS 76.A NZ LYS 73.A O no hydrogen 3.322 N/A LEU 83.A N LEU 63.A O no hydrogen 3.502 N/A GLN 88.A N ALA 85.A O no hydrogen 3.052 N/A THR 96.A N TYR 93.A O no hydrogen 3.403 N/A CYS 97.A SG LYS 94.A O no hydrogen 3.184 N/A SER 100.A OG GLY 99.A O no hydrogen 2.749 N/A ASN 107.A N VAL 103.A O no hydrogen 2.777 N/A ASN 107.A ND2 VAL 103.A O no hydrogen 2.639 N/A ALA 108.A N THR 104.A O no hydrogen 2.896 N/A ILE 109.A N ASP 105.A O no hydrogen 2.895 N/A ALA 110.A N PHE 106.A O no hydrogen 2.909 N/A THR 111.A N ASN 107.A O no hydrogen 2.668 N/A THR 111.A OG1 ASN 107.A O no hydrogen 2.313 N/A THR 111.A OG1 ALA 108.A O no hydrogen 3.305 N/A CYS 112.A N ALA 108.A O no hydrogen 2.779 N/A CYS 112.A SG ALA 108.A O no hydrogen 3.101 N/A CYS 112.A SG ASP 119.A OD1 no hydrogen 3.078 N/A THR 115.A N ASP 119.A OD2 no hydrogen 2.537 N/A THR 115.A OG1 ASP 113.A OD2 no hydrogen 2.984 N/A ASN 116.A N ASP 119.A OD2 no hydrogen 2.477 N/A ASP 119.A N ASN 116.A O no hydrogen 3.211 N/A ILE 121.A N ALA 117.A O no hydrogen 2.944 N/A LEU 122.A N GLY 118.A O no hydrogen 2.909 N/A ALA 123.A N ASP 119.A O no hydrogen 2.906 N/A ASN 124.A N TYR 120.A O no hydrogen 2.920 N/A ASN 124.A ND2 TYR 414.A O no hydrogen 3.447 N/A THR 125.A N LEU 122.A O no hydrogen 3.304 N/A THR 125.A OG1 ILE 121.A O no hydrogen 2.482 N/A CYS 126.A SG LEU 122.A O no hydrogen 3.691 N/A CYS 126.A SG ALA 123.A O no hydrogen 3.449 N/A CYS 126.A SG THR 127.A O no hydrogen 3.675 N/A LYS 131.A N THR 127.A O no hydrogen 2.918 N/A LYS 131.A NZ ASN 124.A O no hydrogen 2.877 N/A LEU 132.A N GLU 128.A O no hydrogen 2.961 N/A PHE 133.A N ARG 129.A O no hydrogen 2.871 N/A ALA 134.A N LEU 130.A O no hydrogen 2.868 N/A ALA 135.A N LYS 131.A O no hydrogen 2.937 N/A GLU 136.A N LEU 132.A O no hydrogen 2.929 N/A THR 137.A N PHE 133.A O no hydrogen 2.901 N/A LEU 138.A N ALA 134.A O no hydrogen 2.872 N/A LYS 139.A N ALA 135.A O no hydrogen 2.988 N/A LYS 139.A NZ HIS 226.A NE2 no hydrogen 3.000 N/A ALA 140.A N GLU 136.A O no hydrogen 2.896 N/A THR 141.A N THR 137.A O no hydrogen 2.874 N/A GLU 142.A N LEU 138.A O no hydrogen 2.999 N/A GLU 143.A N LYS 139.A O no hydrogen 2.913 N/A THR 144.A N ALA 140.A O no hydrogen 2.922 N/A THR 144.A OG1 ALA 140.A O no hydrogen 3.000 N/A THR 144.A OG1 THR 141.A O no hydrogen 2.551 N/A PHE 145.A N THR 141.A O no hydrogen 2.910 N/A LYS 146.A N GLU 142.A O no hydrogen 2.949 N/A LEU 147.A N GLU 143.A O no hydrogen 2.878 N/A SER 148.A N THR 144.A O no hydrogen 2.925 N/A SER 148.A N PHE 145.A O no hydrogen 3.235 N/A SER 148.A OG THR 144.A O no hydrogen 2.722 N/A ALA 152.A N PHE 221.A O no hydrogen 3.147 N/A THR 153.A N SER 166.A O no hydrogen 2.557 N/A THR 153.A OG1 GLU 168.A OE2 no hydrogen 3.421 N/A VAL 154.A N ASP 219.A O no hydrogen 3.232 N/A SER 159.A OG ASP 160.A O no hydrogen 2.901 N/A GLU 162.A N SER 159.A O no hydrogen 3.248 N/A SER 166.A N THR 153.A O no hydrogen 3.128 N/A SER 166.A OG TRP 167.A O no hydrogen 3.086 N/A ASN 177.A ND2 ASN 509.A OD1 no hydrogen 2.318 N/A ASN 179.A N ASN 177.A OD1 no hydrogen 3.034 N/A TYR 180.A N ASN 177.A O no hydrogen 3.034 N/A PHE 182.A N TYR 198.A O no hydrogen 3.082 N/A THR 183.A N VAL 222.A O no hydrogen 2.977 N/A TYR 185.A N TYR 220.A O no hydrogen 3.040 N/A ARG 186.A N VAL 193.A O no hydrogen 2.889 N/A SER 191.A OG ASN 190.A OD1 no hydrogen 2.340 N/A VAL 193.A N ARG 186.A O no hydrogen 2.352 N/A TYR 198.A N PHE 182.A O no hydrogen 2.762 N/A TYR 198.A OH THR 211.A O no hydrogen 2.302 N/A THR 199.A OG1 LEU 176.A O no hydrogen 3.503 N/A LEU 215.A N TYR 213.A O no hydrogen 2.698 N/A ASP 219.A N VAL 154.A O no hydrogen 3.029 N/A THR 224.A OG1 THR 183.A O no hydrogen 2.625 N/A SER 225.A OG GLU 143.A O no hydrogen 3.024 N/A SER 225.A OG GLU 143.A OE1 no hydrogen 2.613 N/A THR 235.A N GLU 128.A OE2 no hydrogen 3.177 N/A THR 235.A OG1 ASN 374.A OD1 no hydrogen 3.551 N/A TYR 242.A N MET 270.A O no hydrogen 2.551 N/A THR 251.A OG1 ASN 253.A O no hydrogen 2.897 N/A SER 255.A OG LEU 293.A O no hydrogen 3.436 N/A GLU 257.A N SER 255.A O no hydrogen 2.715 N/A ASN 261.A ND2 PHE 287.A O no hydrogen 2.992 N/A ASN 264.A N SER 260.A O no hydrogen 2.949 N/A ASN 264.A ND2 SER 260.A O no hydrogen 2.687 N/A TYR 265.A N ASN 261.A O no hydrogen 2.941 N/A GLN 266.A N VAL 262.A O no hydrogen 2.882 N/A LYS 267.A N ALA 263.A O no hydrogen 3.015 N/A LYS 267.A N ASN 264.A O no hydrogen 3.286 N/A VAL 268.A N ASN 264.A O no hydrogen 2.925 N/A GLY 269.A N TYR 265.A O no hydrogen 2.925 N/A GLN 271.A NE2 LYS 267.A O no hydrogen 3.697 N/A GLN 271.A NE2 SER 274.A OG no hydrogen 2.894 N/A SER 274.A N TYR 389.A O no hydrogen 2.372 N/A THR 275.A OG1 TYR 391.A O no hydrogen 2.356 N/A LEU 276.A N TYR 391.A O no hydrogen 3.147 N/A THR 282.A OG1 PRO 279.A O no hydrogen 2.278 N/A GLY 290.A N HIS 286.A O no hydrogen 2.933 N/A LEU 291.A N PHE 287.A O no hydrogen 2.927 N/A ALA 292.A N ALA 288.A O no hydrogen 2.864 N/A ALA 292.A N ILE 289.A O no hydrogen 3.128 N/A LEU 293.A N GLY 290.A O no hydrogen 3.271 N/A TYR 294.A N GLY 290.A O no hydrogen 2.975 N/A TYR 295.A N LEU 291.A O no hydrogen 2.964 N/A ARG 299.A N ASP 362.A OD2 no hydrogen 3.234 N/A ILE 300.A N GLN 347.A O no hydrogen 2.877 N/A VAL 301.A N ILE 363.A O no hydrogen 2.781 N/A TYR 302.A N VAL 349.A O no hydrogen 2.885 N/A THR 303.A OG1 ALA 304.A O no hydrogen 3.208 N/A CYS 305.A SG ASP 367.A O no hydrogen 3.470 N/A CYS 305.A SG GLU 368.A O no hydrogen 3.085 N/A SER 306.A OG SER 528.A OG no hydrogen 3.427 N/A CYS 314.A N VAL 310.A O no hydrogen 2.904 N/A CYS 314.A N ASP 311.A O no hydrogen 3.209 N/A GLU 315.A N ASP 311.A O no hydrogen 2.946 N/A LYS 319.A N GLU 315.A O no hydrogen 2.932 N/A TYR 320.A N LYS 316.A O no hydrogen 2.912 N/A LEU 321.A N ALA 317.A O no hydrogen 3.062 N/A CYS 326.A SG ALA 317.A O no hydrogen 3.553 N/A CYS 326.A SG PRO 322.A O no hydrogen 3.490 N/A SER 327.A OG TYR 348.A O no hydrogen 2.510 N/A ARG 328.A N LYS 340.A O no hydrogen 2.718 N/A ARG 328.A NE ILE 329.A O no hydrogen 3.360 N/A ARG 328.A NH2 ILE 329.A O no hydrogen 2.858 N/A CYS 335.A SG HIS 307.A O no hydrogen 3.931 N/A LYS 338.A NZ CYS 314.A O no hydrogen 2.818 N/A LYS 338.A NZ GLU 315.A O no hydrogen 3.503 N/A LYS 340.A NZ CYS 326.A O no hydrogen 3.131 N/A LYS 340.A NZ SER 343.A OG no hydrogen 2.639 N/A LYS 340.A NZ GLU 346.A OE1 no hydrogen 3.001 N/A TYR 348.A OH ALA 292.A O no hydrogen 2.248 N/A PHE 350.A N SER 327.A O no hydrogen 3.229 N/A CYS 351.A N TYR 302.A O no hydrogen 3.335 N/A CYS 351.A SG ILE 329.A O no hydrogen 3.087 N/A CYS 351.A SG THR 352.A O no hydrogen 3.134 N/A CYS 351.A SG ASN 354.A OD1 no hydrogen 3.834 N/A CYS 351.A SG ALA 355.A O no hydrogen 3.525 N/A THR 359.A OG1 THR 360.A O no hydrogen 3.311 N/A ILE 363.A N ARG 299.A O no hydrogen 2.953 N/A VAL 364.A N HIS 388.A O no hydrogen 3.146 N/A VAL 365.A N VAL 301.A O no hydrogen 2.415 N/A PHE 366.A N VAL 390.A O no hydrogen 2.715 N/A ASP 367.A N THR 303.A O no hydrogen 2.855 N/A GLU 368.A N ASP 367.A OD1 no hydrogen 2.412 N/A ILE 369.A N ILE 392.A O no hydrogen 3.159 N/A SER 370.A OG LEU 398.A O no hydrogen 2.385 N/A ALA 372.A N ILE 369.A O no hydrogen 3.243 N/A THR 373.A N ASP 376.A OD2 no hydrogen 3.213 N/A THR 373.A OG1 ASP 376.A OD2 no hydrogen 2.522 N/A ASN 374.A ND2 ASN 124.A OD1 no hydrogen 3.303 N/A TYR 375.A OH MET 229.A O no hydrogen 2.796 N/A LEU 377.A N THR 373.A O no hydrogen 3.179 N/A SER 378.A N ASN 374.A O no hydrogen 2.887 N/A SER 378.A OG ASN 374.A O no hydrogen 2.818 N/A VAL 379.A N TYR 375.A O no hydrogen 2.906 N/A VAL 380.A N ASP 376.A O no hydrogen 2.933 N/A ASN 381.A N LEU 377.A O no hydrogen 2.918 N/A ASN 381.A ND2 THR 235.A O no hydrogen 3.323 N/A ALA 382.A N SER 378.A O no hydrogen 2.880 N/A ARG 383.A N VAL 379.A O no hydrogen 2.897 N/A LEU 384.A N VAL 380.A O no hydrogen 3.052 N/A LYS 387.A N ASP 362.A O no hydrogen 3.189 N/A LYS 387.A NZ ASP 362.A OD1 no hydrogen 3.291 N/A HIS 388.A N ASP 362.A O no hydrogen 2.828 N/A VAL 390.A N VAL 364.A O no hydrogen 3.110 N/A TYR 391.A N SER 274.A O no hydrogen 3.025 N/A ILE 392.A N PHE 366.A O no hydrogen 2.294 N/A GLY 393.A N LEU 276.A O no hydrogen 3.102 N/A ASP 394.A N GLN 397.A OE1 no hydrogen 2.971 N/A ALA 396.A N ASP 394.A OD1 no hydrogen 2.522 N/A ARG 402.A N ALA 400.A O no hydrogen 2.467 N/A ARG 402.A NH1 TYR 414.A O no hydrogen 3.215 N/A ARG 402.A NH1 PHE 415.A O no hydrogen 3.360 N/A ARG 402.A NH2 PHE 415.A O no hydrogen 2.738 N/A GLU 413.A N GLU 413.A OE1 no hydrogen 2.556 N/A TYR 414.A N GLU 411.A O no hydrogen 2.904 N/A PHE 415.A N PRO 412.A O no hydrogen 3.436 N/A ASN 416.A ND2 ILE 369.A O no hydrogen 3.263 N/A SER 417.A N ASN 374.A OD1 no hydrogen 2.657 N/A CYS 419.A N ASN 416.A OD1 no hydrogen 2.955 N/A ARG 420.A N ASN 416.A O no hydrogen 3.377 N/A ARG 420.A NH2 ASN 124.A O no hydrogen 3.245 N/A LEU 421.A N SER 417.A O no hydrogen 2.891 N/A MET 422.A N VAL 418.A O no hydrogen 2.944 N/A LYS 423.A N ARG 420.A O no hydrogen 2.905 N/A THR 424.A N ARG 420.A O no hydrogen 2.850 N/A THR 424.A OG1 LEU 421.A O no hydrogen 3.549 N/A CYS 434.A SG HIS 457.A ND1 no hydrogen 3.016 N/A ARG 435.A N GLY 281.A O no hydrogen 2.805 N/A CYS 437.A SG PRO 438.A O no hydrogen 3.650 N/A ASP 443.A N ALA 439.A O no hydrogen 2.897 N/A THR 444.A N GLU 440.A O no hydrogen 2.942 N/A THR 444.A OG1 GLU 440.A O no hydrogen 2.505 N/A VAL 445.A N ILE 441.A O no hydrogen 2.911 N/A SER 446.A N VAL 442.A O no hydrogen 2.873 N/A SER 446.A OG VAL 442.A O no hydrogen 2.299 N/A SER 446.A OG LEU 454.A O no hydrogen 3.454 N/A ALA 447.A N ASP 443.A O no hydrogen 2.923 N/A LEU 448.A N THR 444.A O no hydrogen 2.958 N/A VAL 449.A N VAL 445.A O no hydrogen 2.859 N/A TYR 450.A N VAL 445.A O no hydrogen 2.524 N/A LYS 453.A NZ LEU 431.A O no hydrogen 3.005 N/A HIS 457.A ND1 LYS 455.A O no hydrogen 2.593 N/A CYS 464.A SG GLU 440.A OE1 no hydrogen 3.045 N/A LYS 466.A N THR 581.A O no hydrogen 2.876 N/A VAL 477.A N SER 479.A O no hydrogen 3.250 N/A ILE 481.A N THR 474.A O no hydrogen 3.463 N/A ASN 482.A ND2 GLN 511.A OE1 no hydrogen 2.331 N/A ASN 482.A ND2 THR 542.A O no hydrogen 2.954 N/A ARG 483.A NH1 ARG 483.A O no hydrogen 2.821 N/A GLN 485.A N ASN 482.A O no hydrogen 2.844 N/A ILE 486.A N ASN 482.A O no hydrogen 2.945 N/A GLY 487.A N ARG 483.A O no hydrogen 2.985 N/A VAL 489.A N GLN 485.A O no hydrogen 2.899 N/A GLU 491.A N GLY 487.A O no hydrogen 2.941 N/A PHE 492.A N VAL 488.A O no hydrogen 2.842 N/A LEU 493.A N VAL 489.A O no hydrogen 2.932 N/A THR 494.A OG1 ARG 490.A O no hydrogen 3.094 N/A THR 494.A OG1 GLU 491.A O no hydrogen 2.643 N/A ALA 498.A N ASN 496.A OD1 no hydrogen 3.078 N/A TRP 499.A NE1 GLY 564.A O no hydrogen 2.607 N/A SER 506.A OG GLN 524.A O no hydrogen 2.292 N/A SER 510.A OG ALA 480.A O no hydrogen 3.058 N/A ASN 512.A N TYR 508.A O no hydrogen 3.276 N/A ASN 512.A ND2 ILE 505.A O no hydrogen 3.515 N/A ASN 512.A ND2 TYR 508.A O no hydrogen 3.213 N/A ALA 513.A N ASN 509.A O no hydrogen 2.906 N/A VAL 514.A N SER 510.A O no hydrogen 2.909 N/A ALA 515.A N GLN 511.A O no hydrogen 2.876 N/A SER 516.A N ASN 512.A O no hydrogen 2.890 N/A LYS 517.A N ALA 513.A O no hydrogen 2.907 N/A ILE 518.A N VAL 514.A O no hydrogen 2.905 N/A LEU 519.A N ALA 515.A O no hydrogen 2.885 N/A GLY 520.A N ALA 515.A O no hydrogen 2.703 N/A GLN 524.A N PHE 504.A O no hydrogen 3.196 N/A SER 528.A OG SER 306.A OG no hydrogen 3.427 N/A SER 529.A OG SER 529.A O no hydrogen 2.230 N/A SER 529.A OG SER 532.A OG no hydrogen 2.959 N/A SER 532.A OG SER 529.A O no hydrogen 3.430 N/A GLU 533.A N GLU 533.A OE1 no hydrogen 2.729 N/A TYR 536.A OH GLN 463.A OE1 no hydrogen 3.402 N/A ILE 538.A N VAL 503.A O no hydrogen 2.968 N/A PHE 539.A N LEU 566.A O no hydrogen 2.611 N/A GLN 541.A NE2 SER 570.A O no hydrogen 2.556 N/A THR 543.A N GLN 541.A OE1 no hydrogen 2.893 N/A THR 545.A OG1 HIS 547.A ND1 no hydrogen 3.095 N/A HIS 547.A N THR 545.A OG1 no hydrogen 3.333 N/A HIS 547.A ND1 THR 545.A OG1 no hydrogen 3.095 N/A CYS 549.A SG ASP 571.A OD1 no hydrogen 3.399 N/A ILE 558.A N PHE 554.A O no hydrogen 2.904 N/A THR 559.A N VAL 556.A O no hydrogen 2.905 N/A THR 559.A OG1 VAL 556.A O no hydrogen 2.828 N/A ARG 560.A N ALA 557.A O no hydrogen 3.399 N/A ARG 560.A NH1 SER 529.A OG no hydrogen 2.868 N/A LYS 562.A N ASP 535.A O no hydrogen 2.995 N/A LYS 562.A NZ ARG 436.A O no hydrogen 2.254 N/A SER 570.A OG ILE 568.A O no hydrogen 3.385 N/A ASP 573.A N ASP 571.A O no hydrogen 2.372 N/A LYS 577.A N TYR 575.A O no hydrogen 2.928 N/A THR 581.A OG1 ALA 462.A O no hydrogen 3.106 N/A THR 581.A OG1 CYS 464.A O no hydrogen 2.171 N/A