Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6zqi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N HIS 144.A ND1 no hydrogen 3.517 N/A CYS 3.A SG THR 32.A OG1 no hydrogen 3.472 N/A ARG 9.A NE THR 32.A OG1 no hydrogen 3.219 N/A ARG 9.A NH1 GLU 378.A OE2 no hydrogen 2.597 N/A ARG 9.A NH2 GLU 378.A OE2 no hydrogen 3.133 N/A ILE 12.A N THR 32.A O no hydrogen 2.941 N/A GLY 18.A N MET 15.A O no hydrogen 3.260 N/A VAL 21.A N LEU 294.A O no hydrogen 2.956 N/A ILE 23.A N CYS 292.A O no hydrogen 2.909 N/A LEU 25.A N LEU 290.A O no hydrogen 2.873 N/A GLY 29.A N GLU 26.A O no hydrogen 3.272 N/A CYS 30.A N ASN 8.A O no hydrogen 3.039 N/A CYS 30.A SG VAL 31.A O no hydrogen 3.709 N/A CYS 30.A SG PHE 43.A O no hydrogen 3.356 N/A VAL 31.A N PHE 43.A O no hydrogen 2.970 N/A THR 32.A OG1 ASP 42.A OD1 no hydrogen 2.582 N/A VAL 33.A N LEU 41.A O no hydrogen 2.906 N/A MET 34.A N ILE 12.A O no hydrogen 3.115 N/A THR 40.A OG1 ILE 360.A O no hydrogen 2.493 N/A LEU 41.A N VAL 33.A O no hydrogen 2.913 N/A ASP 42.A N SER 142.A O no hydrogen 2.879 N/A PHE 43.A N VAL 31.A O no hydrogen 2.878 N/A GLU 44.A N LEU 140.A O no hydrogen 2.983 N/A VAL 46.A N ARG 138.A O no hydrogen 2.970 N/A THR 48.A N ILE 285.A O no hydrogen 2.952 N/A THR 49.A N GLU 136.A O no hydrogen 2.988 N/A ALA 50.A N ALA 283.A O no hydrogen 2.922 N/A VAL 56.A N GLY 127.A O no hydrogen 2.928 N/A SER 58.A N HIS 227.A O no hydrogen 2.891 N/A TYR 59.A N LEU 125.A O no hydrogen 2.989 N/A CYS 60.A N PRO 225.A O no hydrogen 3.299 N/A CYS 60.A SG GLU 62.A O no hydrogen 3.342 N/A CYS 60.A SG LYS 123.A O no hydrogen 3.198 N/A ASN 64.A N THR 120.A O no hydrogen 2.987 N/A ALA 69.A N CYS 116.A O no hydrogen 2.890 N/A ASP 71.A N VAL 114.A O no hydrogen 2.893 N/A ARG 73.A N SER 112.A O no hydrogen 2.917 N/A LYS 84.A NZ GLU 67.A OE1 no hydrogen 2.778 N/A MET 85.A N LEU 82.A O no hydrogen 3.325 N/A PHE 90.A N ASP 87.A O no hydrogen 3.510 N/A VAL 91.A N ALA 117.A O no hydrogen 2.941 N/A LYS 93.A N THR 115.A O no hydrogen 2.974 N/A ARG 94.A NH2 ALA 80.A O no hydrogen 3.464 N/A GLY 95.A N ILE 113.A O no hydrogen 2.901 N/A ARG 99.A N GLY 109.A O no hydrogen 3.318 N/A ASN 103.A N GLY 100.A O no hydrogen 3.090 N/A GLY 109.A N LEU 107.A O no hydrogen 3.207 N/A GLY 111.A N VAL 97.A O no hydrogen 2.912 N/A SER 112.A N ARG 73.A O no hydrogen 2.870 N/A SER 112.A OG GLY 78.A O no hydrogen 3.336 N/A ILE 113.A N GLY 95.A O no hydrogen 2.915 N/A VAL 114.A N ASP 71.A O no hydrogen 2.908 N/A THR 115.A N LYS 93.A O no hydrogen 2.973 N/A CYS 116.A N ALA 69.A O no hydrogen 2.956 N/A ALA 117.A N VAL 91.A O no hydrogen 2.982 N/A LYS 118.A N SER 66.A O no hydrogen 2.984 N/A THR 120.A N ASN 64.A O no hydrogen 3.226 N/A THR 120.A OG1 ASN 64.A O no hydrogen 3.525 N/A CYS 121.A SG LYS 123.A O no hydrogen 3.124 N/A LYS 123.A N GLU 62.A O no hydrogen 3.397 N/A LEU 125.A N TYR 59.A O no hydrogen 2.881 N/A THR 126.A N THR 206.A O no hydrogen 2.922 N/A GLY 127.A N ARG 57.A O no hydrogen 2.837 N/A LYS 128.A N TYR 204.A O no hydrogen 2.895 N/A SER 129.A N ALA 54.A O no hydrogen 3.064 N/A ASN 134.A N GLN 131.A O no hydrogen 3.048 N/A LEU 135.A N PRO 132.A O no hydrogen 3.385 N/A GLU 136.A N THR 49.A O no hydrogen 2.900 N/A TYR 137.A N ILE 170.A O no hydrogen 2.909 N/A VAL 139.A N ILE 168.A O no hydrogen 2.936 N/A LEU 140.A N GLU 44.A O no hydrogen 2.870 N/A VAL 141.A N ALA 166.A O no hydrogen 2.901 N/A SER 142.A N ASP 42.A O no hydrogen 2.902 N/A VAL 143.A N ASN 164.A O no hydrogen 3.145 N/A HIS 144.A N THR 40.A O no hydrogen 3.128 N/A SER 146.A OG ALA 145.A O no hydrogen 2.450 N/A SER 146.A OG VAL 365.A O no hydrogen 2.623 N/A ASN 153.A ND2 GLN 159.A O no hydrogen 2.488 N/A ASP 155.A N ASN 154.A OD1 no hydrogen 2.683 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.670 N/A ASN 164.A N ASP 161.A O no hydrogen 2.849 N/A ARG 165.A N ASP 161.A O no hydrogen 3.294 N/A ALA 166.A N VAL 141.A O no hydrogen 2.929 N/A ILE 168.A N VAL 139.A O no hydrogen 2.895 N/A ILE 170.A N TYR 137.A O no hydrogen 2.877 N/A ALA 174.A N THR 171.A OG1 no hydrogen 3.417 N/A ARG 176.A NH2 GLU 178.A OE1 no hydrogen 3.298 N/A VAL 177.A N MET 189.A O no hydrogen 2.902 N/A VAL 179.A N ILE 187.A O no hydrogen 2.897 N/A LEU 181.A N GLY 185.A O no hydrogen 2.865 N/A SER 186.A OG GLU 180.A OE1 no hydrogen 3.408 N/A ILE 187.A N VAL 179.A O no hydrogen 2.929 N/A SER 188.A N LYS 295.A O no hydrogen 2.960 N/A SER 188.A OG GLU 178.A OE1 no hydrogen 2.385 N/A MET 189.A N VAL 177.A O no hydrogen 2.919 N/A GLU 190.A N ARG 293.A O no hydrogen 2.931 N/A CYS 191.A N PRO 175.A O no hydrogen 3.291 N/A GLU 192.A N LYS 291.A O no hydrogen 2.906 N/A ARG 194.A N GLU 192.A O no hydrogen 2.706 N/A SER 195.A OG ARG 194.A O no hydrogen 2.572 N/A SER 195.A OG HIS 289.A NE2 no hydrogen 2.430 N/A TYR 203.A N VAL 214.A O no hydrogen 2.887 N/A TYR 204.A N LYS 128.A O no hydrogen 2.903 N/A LEU 205.A N TRP 212.A O no hydrogen 2.896 N/A THR 206.A N THR 126.A O no hydrogen 2.911 N/A THR 206.A OG1 HIS 211.A ND1 no hydrogen 3.134 N/A MET 207.A N LYS 210.A O no hydrogen 2.891 N/A LYS 210.A N MET 207.A O no hydrogen 2.903 N/A LYS 210.A NZ ASN 208.A O no hydrogen 2.807 N/A HIS 211.A ND1 THR 206.A OG1 no hydrogen 3.134 N/A TRP 212.A N LEU 205.A O no hydrogen 2.912 N/A LEU 213.A N LEU 274.A O no hydrogen 3.311 N/A VAL 214.A N TYR 203.A O no hydrogen 2.917 N/A ARG 216.A N ASP 201.A OD1 no hydrogen 3.223 N/A ARG 216.A NE LEU 202.A O no hydrogen 3.451 N/A TRP 218.A N ASN 215.A O no hydrogen 3.224 N/A PHE 219.A N ASN 215.A O no hydrogen 2.886 N/A ASP 221.A N TRP 218.A O no hydrogen 3.075 N/A SER 223.A OG SER 223.A O no hydrogen 2.519 N/A HIS 227.A N SER 58.A O no hydrogen 2.941 N/A SER 232.A OG ASN 234.A O no hydrogen 2.874 N/A ASN 238.A N TRP 226.A O no hydrogen 3.409 N/A LYS 240.A NZ TRP 237.A O no hydrogen 3.410 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.600 N/A LEU 243.A N LYS 240.A O no hydrogen 2.926 N/A VAL 244.A N GLU 241.A O no hydrogen 3.309 N/A GLU 245.A N VAL 257.A O no hydrogen 2.898 N/A LYS 252.A NZ SER 72.A OG no hydrogen 2.980 N/A GLN 254.A NE2 GLU 248.A O no hydrogen 3.394 N/A VAL 257.A N GLU 245.A O no hydrogen 2.905 N/A LEU 259.A N LEU 243.A O no hydrogen 3.145 N/A SER 261.A OG GLU 62.A OE1 no hydrogen 2.483 N/A GLN 262.A NE2 GLY 260.A O no hydrogen 2.689 N/A VAL 266.A N GLN 262.A O no hydrogen 3.270 N/A HIS 267.A N GLU 263.A O no hydrogen 2.916 N/A HIS 267.A ND1 GLU 263.A O no hydrogen 3.121 N/A ALA 268.A N GLY 264.A O no hydrogen 2.903 N/A ALA 269.A N ALA 265.A O no hydrogen 2.900 N/A LEU 270.A N VAL 266.A O no hydrogen 2.908 N/A SER 278.A OG HIS 211.A NE2 no hydrogen 2.645 N/A ASP 279.A N LYS 282.A O no hydrogen 2.888 N/A LYS 282.A N ASP 279.A O no hydrogen 2.913 N/A ALA 283.A N ALA 50.A O no hydrogen 2.894 N/A THR 284.A N GLU 277.A O no hydrogen 2.908 N/A ILE 285.A N THR 48.A O no hydrogen 2.856 N/A HIS 289.A NE2 SER 195.A OG no hydrogen 2.430 N/A LEU 290.A N LEU 25.A O no hydrogen 2.895 N/A CYS 292.A N ILE 23.A O no hydrogen 2.930 N/A ARG 293.A N GLU 190.A O no hydrogen 2.879 N/A ARG 293.A NH2 THR 428.A O no hydrogen 2.784 N/A LEU 294.A N VAL 21.A O no hydrogen 2.840 N/A LYS 295.A N SER 188.A O no hydrogen 2.871 N/A LEU 296.A N THR 19.A O no hydrogen 3.342 N/A LYS 298.A N ASP 297.A OD1 no hydrogen 2.528 N/A LYS 298.A NZ ASP 297.A OD2 no hydrogen 3.279 N/A ARG 300.A N PHE 184.A O no hydrogen 2.893 N/A CYS 309.A SG LYS 341.A O no hydrogen 3.182 N/A THR 310.A OG1 ASP 337.A OD2 no hydrogen 2.683 N/A ALA 312.A N ALA 334.A O no hydrogen 2.950 N/A THR 314.A N GLN 332.A O no hydrogen 2.946 N/A ALA 316.A N GLU 330.A O no hydrogen 3.096 N/A THR 322.A N THR 326.A O no hydrogen 3.046 N/A THR 322.A OG1 THR 326.A O no hydrogen 3.059 N/A THR 322.A OG1 THR 326.A OG1 no hydrogen 2.361 N/A GLY 325.A N THR 322.A O no hydrogen 3.321 N/A THR 326.A OG1 THR 322.A OG1 no hydrogen 2.361 N/A THR 326.A OG1 GLU 378.A OE2 no hydrogen 3.307 N/A ALA 327.A N ILE 379.A O no hydrogen 2.905 N/A VAL 329.A N VAL 377.A O no hydrogen 2.879 N/A LEU 331.A N MET 375.A O no hydrogen 2.891 N/A GLN 332.A N THR 314.A O no hydrogen 2.871 N/A TYR 333.A N SER 373.A O no hydrogen 2.870 N/A ALA 334.A N ALA 312.A O no hydrogen 2.870 N/A GLY 335.A N ALA 371.A O no hydrogen 3.014 N/A CYS 340.A SG GLY 338.A O no hydrogen 3.561 N/A LYS 341.A N ALA 307.A O no hydrogen 2.481 N/A LYS 341.A NZ MET 304.A O no hydrogen 2.882 N/A VAL 342.A N PRO 364.A O no hydrogen 2.964 N/A VAL 345.A N ILE 389.A O no hydrogen 2.910 N/A THR 347.A N TYR 387.A O no hydrogen 2.941 N/A THR 347.A OG1 SER 352.A OG no hydrogen 2.576 N/A THR 347.A OG1 ALA 354.A O no hydrogen 3.306 N/A SER 348.A N THR 347.A OG1 no hydrogen 2.598 N/A ASP 349.A N SER 352.A OG no hydrogen 2.848 N/A THR 350.A OG1 ASP 349.A OD1 no hydrogen 3.489 N/A ASN 351.A N ASP 349.A OD1 no hydrogen 2.978 N/A SER 352.A N ASP 349.A O no hydrogen 3.109 N/A SER 352.A OG THR 347.A OG1 no hydrogen 2.576 N/A SER 352.A OG ASP 349.A O no hydrogen 2.399 N/A ALA 354.A N THR 347.A OG1 no hydrogen 3.242 N/A SER 355.A OG GLY 357.A O no hydrogen 3.391 N/A THR 356.A N ILE 346.A O no hydrogen 3.022 N/A ILE 360.A N GLU 378.A O no hydrogen 3.124 N/A THR 361.A N GLU 378.A O no hydrogen 3.253 N/A ASN 363.A ND2 GLY 303.A O no hydrogen 3.136 N/A VAL 366.A N CYS 340.A O no hydrogen 3.408 N/A THR 367.A OG1 GLU 368.A OE2 no hydrogen 2.638 N/A SER 369.A OG SER 369.A O no hydrogen 2.389 N/A SER 373.A N TYR 333.A O no hydrogen 2.941 N/A SER 373.A OG LYS 374.A O no hydrogen 3.529 N/A MET 375.A N LEU 331.A O no hydrogen 2.913 N/A VAL 377.A N VAL 329.A O no hydrogen 2.899 N/A ILE 379.A N ALA 327.A O no hydrogen 2.915 N/A ASP 380.A N ARG 358.A O no hydrogen 3.358 N/A GLY 384.A N ARG 403.A O no hydrogen 2.906 N/A SER 386.A N TRP 401.A O no hydrogen 2.894 N/A SER 386.A OG THR 347.A O no hydrogen 3.092 N/A TYR 387.A N THR 347.A O no hydrogen 2.883 N/A ILE 388.A N HIS 399.A O no hydrogen 2.894 N/A ILE 389.A N VAL 345.A O no hydrogen 2.919 N/A VAL 390.A N ILE 397.A O no hydrogen 2.909 N/A GLY 391.A N PRO 343.A O no hydrogen 3.027 N/A ILE 397.A N VAL 390.A O no hydrogen 2.912 N/A HIS 399.A N ILE 388.A O no hydrogen 2.906 N/A TRP 401.A N SER 386.A O no hydrogen 2.913 N/A ARG 403.A N GLY 384.A O no hydrogen 2.897 N/A ARG 403.A NH1 PRO 381.A O no hydrogen 2.955 N/A GLY 409.A N SER 406.A OG no hydrogen 2.815 N/A ARG 410.A N SER 406.A O no hydrogen 3.112 N/A ARG 410.A NH2 ASP 380.A OD2 no hydrogen 3.186 N/A ALA 411.A N SER 407.A O no hydrogen 2.905 N/A PHE 412.A N ILE 408.A O no hydrogen 2.883 N/A GLU 413.A N GLY 409.A O no hydrogen 2.929 N/A ALA 414.A N ARG 410.A O no hydrogen 2.900 N/A THR 415.A N ALA 411.A O no hydrogen 2.887 N/A THR 415.A OG1 ALA 411.A O no hydrogen 2.852 N/A MET 416.A N PHE 412.A O no hydrogen 2.912 N/A ARG 417.A N GLU 413.A O no hydrogen 2.924 N/A GLY 418.A N ALA 414.A O no hydrogen 2.884 N/A ALA 419.A N THR 415.A O no hydrogen 2.897 N/A LYS 420.A N MET 416.A O no hydrogen 2.921 N/A ARG 421.A N ARG 417.A O no hydrogen 2.900 N/A ARG 421.A NH2 ASP 10.A OD2 no hydrogen 2.743 N/A MET 422.A N GLY 418.A O no hydrogen 2.895 N/A ALA 423.A N ALA 419.A O no hydrogen 2.900 N/A VAL 424.A N LYS 420.A O no hydrogen 2.909 N/A LEU 425.A N ARG 421.A O no hydrogen 3.042 N/A GLY 426.A N VAL 424.A O no hydrogen 2.809 N/A THR 428.A OG1 ASP 427.A O no hydrogen 2.606 N/A SER 434.A OG VAL 435.A O no hydrogen 3.135 N/A SER 441.A N GLY 437.A O no hydrogen 2.874 N/A SER 441.A OG GLY 437.A O no hydrogen 3.253 N/A SER 441.A OG MET 438.A O no hydrogen 2.450 N/A VAL 442.A N MET 438.A O no hydrogen 2.915 N/A GLY 443.A N PHE 439.A O no hydrogen 2.935 N/A LYS 444.A N ASN 440.A O no hydrogen 2.855 N/A PHE 445.A N SER 441.A O no hydrogen 2.969 N/A VAL 446.A N VAL 442.A O no hydrogen 2.972 N/A HIS 447.A N GLY 443.A O no hydrogen 2.911 N/A GLN 448.A N LYS 444.A O no hydrogen 2.919 N/A GLN 448.A NE2 ASP 22.A OD1 no hydrogen 3.381 N/A VAL 449.A N PHE 445.A O no hydrogen 2.915 N/A PHE 450.A N VAL 446.A O no hydrogen 2.953 N/A PHE 450.A N HIS 447.A O no hydrogen 3.186 N/A GLY 451.A N HIS 447.A O no hydrogen 2.871 N/A PHE 454.A N PHE 450.A O no hydrogen 2.927 N/A LYS 455.A N GLY 451.A O no hydrogen 2.900 N/A LYS 455.A NZ GLU 13.A OE1 no hydrogen 2.923 N/A LEU 457.A N ALA 453.A O no hydrogen 2.914 N/A PHE 458.A N PHE 454.A O no hydrogen 3.242 N/A GLY 459.A N LEU 457.A O no hydrogen 2.579 N/A SER 462.A OG THR 465.A OG1 no hydrogen 3.320 N/A SER 462.A OG GLN 466.A OE1 no hydrogen 2.958 N/A PHE 464.A N SER 462.A OG no hydrogen 3.227 N/A THR 465.A N SER 462.A OG no hydrogen 3.105 N/A THR 465.A OG1 SER 462.A OG no hydrogen 3.320 N/A THR 465.A OG1 GLN 466.A OE1 no hydrogen 3.136 N/A GLN 466.A N GLN 466.A OE1 no hydrogen 2.492 N/A ILE 469.A N THR 465.A O no hydrogen 2.904 N/A GLY 470.A N GLN 466.A O no hydrogen 2.900 N/A PHE 471.A N LEU 467.A O no hydrogen 2.897 N/A LEU 472.A N LEU 468.A O no hydrogen 2.908 N/A LEU 473.A N ILE 469.A O no hydrogen 2.892 N/A ILE 474.A N GLY 470.A O no hydrogen 2.898 N/A TRP 475.A N PHE 471.A O no hydrogen 2.913 N/A MET 476.A N LEU 472.A O no hydrogen 2.879 N/A GLY 477.A N LEU 473.A O no hydrogen 2.908 N/A LEU 478.A N ILE 474.A O no hydrogen 2.883 N/A LEU 478.A N TRP 475.A O no hydrogen 3.118 N/A ASN 479.A N TRP 475.A O no hydrogen 3.095 N/A MET 490.A N ALA 486.A O no hydrogen 2.976 N/A GLY 491.A N MET 487.A O no hydrogen 2.902 N/A ILE 492.A N SER 488.A O no hydrogen 2.913 N/A GLY 493.A N PHE 489.A O no hydrogen 2.897 N/A ALA 494.A N MET 490.A O no hydrogen 2.923 N/A MET 495.A N GLY 491.A O no hydrogen 2.895 N/A LEU 496.A N ILE 492.A O no hydrogen 2.915 N/A ILE 497.A N GLY 493.A O no hydrogen 2.916 N/A PHE 498.A N ALA 494.A O no hydrogen 2.918 N/A LEU 499.A N MET 495.A O no hydrogen 2.891 N/A ALA 500.A N LEU 496.A O no hydrogen 2.913 N/A THR 501.A N ILE 497.A O no hydrogen 2.903 N/A THR 501.A OG1 ILE 497.A O no hydrogen 2.370 N/A SER 502.A N PHE 498.A O no hydrogen 3.002 N/A SER 502.A OG LEU 499.A O no hydrogen 3.066 N/A SER 502.A OG VAL 503.A O no hydrogen 3.237 N/A