Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aju_UR.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N GLU 7.A OE1 no hydrogen 3.416 N/A GLU 5.A N ASP 4.A OD1 no hydrogen 2.501 N/A GLU 6.A N GLU 6.A OE2 no hydrogen 2.647 N/A GLN 8.A N ASP 4.A O no hydrogen 2.884 N/A LEU 9.A N GLU 5.A O no hydrogen 2.909 N/A LEU 10.A N GLU 6.A O no hydrogen 2.886 N/A ALA 11.A N GLU 7.A O no hydrogen 2.854 N/A LYS 12.A N GLN 8.A O no hydrogen 2.886 N/A LYS 12.A NZ ASP 17.A O no hydrogen 3.569 N/A PHE 13.A N LEU 9.A O no hydrogen 2.966 N/A VAL 14.A N LEU 10.A O no hydrogen 2.856 N/A PHE 15.A N ALA 11.A O no hydrogen 2.931 N/A GLY 16.A N LYS 12.A O no hydrogen 2.939 N/A GLY 16.A N PHE 13.A O no hydrogen 3.342 N/A THR 19.A N ASP 17.A OD1 no hydrogen 2.578 N/A GLN 22.A N THR 18.A O no hydrogen 2.933 N/A GLU 23.A N THR 19.A O no hydrogen 2.880 N/A ASN 24.A N ASP 20.A O no hydrogen 2.928 N/A LEU 25.A N LEU 21.A O no hydrogen 2.903 N/A ALA 26.A N GLN 22.A O no hydrogen 2.933 N/A LYS 27.A N GLU 23.A O no hydrogen 2.915 N/A LYS 27.A NZ GLU 23.A OE2 no hydrogen 3.254 N/A PHE 28.A N LEU 25.A O no hydrogen 3.161 N/A ASP 41.A N ASP 40.A OD1 no hydrogen 2.883 N/A GLU 42.A N ASP 38.A O no hydrogen 2.934 N/A LYS 43.A N SER 39.A O no hydrogen 2.903 N/A VAL 46.A N ILE 66.A O no hydrogen 3.114 N/A ILE 48.A N SER 64.A O no hydrogen 2.508 N/A LYS 55.A N THR 51.A O no hydrogen 2.912 N/A LYS 56.A N ASN 52.A O no hydrogen 2.885 N/A LEU 57.A N LYS 53.A O no hydrogen 2.939 N/A ARG 58.A N THR 54.A O no hydrogen 2.945 N/A ILE 66.A N VAL 46.A O no hydrogen 3.249 N/A HIS 70.A ND1 ASN 67.A OD1 no hydrogen 2.533 N/A TYR 71.A N ASN 67.A O no hydrogen 2.952 N/A ILE 72.A N GLY 68.A O no hydrogen 2.856 N/A ASN 73.A N VAL 69.A O no hydrogen 2.922 N/A ARG 74.A N HIS 70.A O no hydrogen 2.972 N/A ARG 74.A NH2 THR 54.A O no hydrogen 3.496 N/A LEU 75.A N TYR 71.A O no hydrogen 2.872 N/A ARG 76.A N ILE 72.A O no hydrogen 2.806 N/A SER 77.A N ASN 73.A O no hydrogen 3.002 N/A SER 77.A OG ASN 73.A O no hydrogen 3.557 N/A SER 77.A OG ARG 74.A O no hydrogen 2.197 N/A GLN 78.A N ARG 74.A O no hydrogen 3.004 N/A PHE 79.A N LEU 75.A O no hydrogen 2.932 N/A GLU 80.A N ARG 76.A O no hydrogen 2.851 N/A LYS 81.A N SER 77.A O no hydrogen 2.929 N/A LYS 81.A NZ GLN 78.A OE1 no hydrogen 2.937 N/A ILE 82.A N GLN 78.A O no hydrogen 2.940 N/A TYR 83.A N PHE 79.A O no hydrogen 2.942 N/A ARG 85.A NE ASP 90.A OD1 no hydrogen 3.227 N/A ASP 90.A N PRO 86.A O no hydrogen 2.970 N/A ASP 91.A N LYS 87.A O no hydrogen 2.885 N/A SER 93.A OG GLU 92.A O no hydrogen 2.583 N/A THR 103.A OG1 ASN 100.A O no hydrogen 2.627 N/A LYS 104.A N ASN 100.A O no hydrogen 2.935 N/A LYS 104.A NZ ASP 98.A OD2 no hydrogen 2.909 N/A ILE 105.A N ALA 101.A O no hydrogen 2.971 N/A LEU 106.A N LEU 102.A O no hydrogen 2.934 N/A SER 107.A N THR 103.A O no hydrogen 2.920 N/A THR 108.A N LYS 104.A O no hydrogen 2.953 N/A THR 109.A N ILE 105.A O no hydrogen 3.040 N/A THR 109.A OG1 ILE 105.A O no hydrogen 3.243 N/A TYR 112.A OH LEU 106.A O no hydrogen 3.294 N/A TYR 112.A OH THR 109.A O no hydrogen 2.883 N/A ASN 118.A N THR 115.A O no hydrogen 3.370 N/A LEU 127.A N ASN 441.A OD1 no hydrogen 2.889 N/A VAL 130.A N LYS 477.A O no hydrogen 2.985 N/A LEU 132.A N LEU 475.A O no hydrogen 2.954 N/A LYS 133.A N GLY 173.A O no hydrogen 3.280 N/A LYS 133.A NZ ASN 176.A O no hydrogen 3.476 N/A ASN 136.A ND2 GLY 471.A O no hydrogen 2.179 N/A ALA 137.A N ASP 134.A OD2 no hydrogen 3.194 N/A SER 138.A N ASP 134.A O no hydrogen 3.029 N/A SER 138.A OG ASN 176.A O no hydrogen 2.380 N/A HIS 139.A N ALA 135.A O no hydrogen 2.913 N/A HIS 142.A N ASP 163.A OD2 no hydrogen 2.553 N/A SER 143.A N ASP 163.A OD2 no hydrogen 2.395 N/A SER 143.A OG ALA 144.A O no hydrogen 3.242 N/A ILE 145.A N ASN 468.A O no hydrogen 3.395 N/A GLN 146.A N GLY 160.A O no hydrogen 3.185 N/A SER 147.A OG CYS 192.A O no hydrogen 3.284 N/A SER 149.A N LEU 158.A O no hydrogen 3.327 N/A SER 149.A OG LEU 148.A O no hydrogen 2.278 N/A SER 149.A OG CYS 192.A O no hydrogen 3.497 N/A HIS 151.A N LEU 156.A O no hydrogen 3.112 N/A SER 153.A N HIS 151.A ND1 no hydrogen 2.901 N/A LYS 154.A N HIS 151.A ND1 no hydrogen 2.824 N/A LEU 157.A N TYR 169.A O no hydrogen 2.861 N/A LEU 158.A N SER 149.A O no hydrogen 2.824 N/A THR 159.A N ARG 167.A O no hydrogen 2.877 N/A ASP 163.A N SER 143.A OG no hydrogen 3.025 N/A LYS 164.A N GLY 161.A O no hydrogen 2.773 N/A THR 165.A OG1 ASP 163.A O no hydrogen 2.734 N/A THR 165.A OG1 HIS 183.A ND1 no hydrogen 3.140 N/A LEU 166.A N LEU 182.A O no hydrogen 2.871 N/A ARG 167.A N THR 159.A O no hydrogen 2.943 N/A ILE 168.A N THR 180.A O no hydrogen 2.857 N/A TYR 169.A N LEU 157.A O no hydrogen 2.911 N/A TYR 169.A OH HIS 139.A O no hydrogen 2.824 N/A HIS 170.A N HIS 177.A O no hydrogen 2.861 N/A ASP 172.A N ASN 176.A OD1 no hydrogen 2.713 N/A THR 175.A OG1 ASP 172.A OD2 no hydrogen 3.347 N/A HIS 177.A N HIS 170.A O no hydrogen 3.022 N/A HIS 177.A ND1 ASN 176.A O no hydrogen 2.717 N/A THR 180.A N ILE 168.A O no hydrogen 3.067 N/A SER 181.A OG SER 181.A O no hydrogen 2.426 N/A LEU 182.A N LEU 166.A O no hydrogen 2.877 N/A HIS 183.A ND1 THR 165.A OG1 no hydrogen 3.140 N/A LEU 184.A N LYS 164.A O no hydrogen 2.916 N/A SER 187.A OG VAL 185.A O no hydrogen 3.306 N/A SER 187.A OG TYR 214.A OH no hydrogen 2.810 N/A ILE 189.A N GLY 161.A O no hydrogen 3.341 N/A GLN 190.A N ALA 209.A O no hydrogen 2.988 N/A THR 191.A N ALA 209.A O no hydrogen 2.948 N/A CYS 192.A SG SER 147.A OG no hydrogen 2.467 N/A THR 193.A N PHE 207.A O no hydrogen 2.911 N/A THR 196.A OG1 SER 197.A O no hydrogen 3.133 N/A SER 197.A OG GLN 203.A OE1 no hydrogen 2.102 N/A ASN 200.A ND2 GLN 203.A OE1 no hydrogen 2.407 N/A GLN 204.A NE2 GLN 201.A O no hydrogen 3.009 N/A ASN 205.A N TYR 195.A O no hydrogen 2.903 N/A ILE 206.A N TRP 218.A O no hydrogen 2.884 N/A PHE 207.A N THR 193.A O no hydrogen 2.955 N/A THR 208.A N HIS 216.A O no hydrogen 2.939 N/A ALA 209.A N THR 191.A O no hydrogen 2.904 N/A ARG 212.A N GLY 210.A O no hydrogen 2.672 N/A ARG 212.A NH1 ARG 211.A O no hydrogen 2.905 N/A TYR 214.A OH SER 187.A OG no hydrogen 2.810 N/A MET 215.A N PHE 229.A O no hydrogen 2.883 N/A HIS 216.A N THR 208.A O no hydrogen 2.904 N/A SER 217.A N GLU 227.A O no hydrogen 2.879 N/A TRP 218.A N ILE 206.A O no hydrogen 2.884 N/A ASP 219.A N LYS 225.A O no hydrogen 2.977 N/A SER 221.A OG SER 221.A O no hydrogen 2.623 N/A GLU 227.A N SER 217.A O no hydrogen 2.882 N/A PHE 229.A N MET 215.A O no hydrogen 2.854 N/A HIS 235.A ND1 THR 238.A OG1 no hydrogen 3.070 N/A THR 238.A OG1 HIS 235.A ND1 no hydrogen 3.070 N/A SER 241.A OG GLU 243.A OE1 no hydrogen 2.423 N/A PHE 242.A N ARG 212.A O no hydrogen 2.866 N/A LYS 246.A N LEU 263.A O no hydrogen 2.958 N/A ALA 248.A N ILE 261.A O no hydrogen 2.983 N/A HIS 249.A N TYR 298.A OH no hydrogen 2.751 N/A GLN 251.A NE2 GLY 304.A O no hydrogen 3.540 N/A ASN 252.A N SER 257.A O no hydrogen 2.939 N/A ASN 252.A ND2 THR 255.A OG1 no hydrogen 2.557 N/A SER 257.A N THR 255.A O no hydrogen 2.406 N/A HIS 259.A N LEU 250.A O no hydrogen 2.917 N/A HIS 259.A ND1 GLY 260.A O no hydrogen 2.817 N/A ILE 261.A N ALA 248.A O no hydrogen 2.840 N/A VAL 262.A N LEU 274.A O no hydrogen 2.879 N/A LEU 263.A N LYS 246.A O no hydrogen 2.880 N/A LEU 264.A N ASN 272.A O no hydrogen 2.903 N/A GLN 265.A N GLN 265.A OE1 no hydrogen 2.836 N/A GLY 269.A N ASN 268.A OD1 no hydrogen 2.380 N/A ILE 271.A N CYS 285.A O no hydrogen 2.866 N/A ASN 272.A N LEU 264.A O no hydrogen 2.901 N/A ASN 272.A ND2 THR 238.A OG1 no hydrogen 3.365 N/A ILE 273.A N MET 283.A O no hydrogen 2.878 N/A LEU 274.A N VAL 262.A O no hydrogen 2.923 N/A HIS 275.A N LEU 280.A O no hydrogen 3.327 N/A SER 276.A N GLY 260.A O no hydrogen 3.150 N/A GLY 279.A N HIS 275.A O no hydrogen 2.769 N/A LEU 280.A N SER 278.A OG no hydrogen 3.290 N/A MET 283.A N ILE 273.A O no hydrogen 3.028 N/A CYS 285.A N ILE 271.A O no hydrogen 2.978 N/A ILE 287.A N GLY 269.A O no hydrogen 2.748 N/A GLU 288.A N GLU 288.A OE2 no hydrogen 2.341 N/A ILE 291.A N ASN 268.A O no hydrogen 2.962 N/A THR 292.A N VAL 313.A O no hydrogen 3.325 N/A ASP 293.A N VAL 313.A O no hydrogen 3.154 N/A PHE 294.A N ASP 293.A OD1 no hydrogen 2.515 N/A CYS 295.A N ILE 311.A O no hydrogen 2.840 N/A CYS 295.A SG ILE 296.A O no hydrogen 3.674 N/A ASP 297.A N ILE 309.A O no hydrogen 2.861 N/A GLN 299.A N ARG 307.A O no hydrogen 2.903 N/A ILE 301.A N LYS 305.A O no hydrogen 2.947 N/A LYS 305.A N SER 302.A O no hydrogen 3.092 N/A PHE 306.A N GLN 251.A OE1 no hydrogen 3.359 N/A ARG 307.A N GLN 299.A O no hydrogen 2.875 N/A ILE 309.A N ASP 297.A O no hydrogen 2.852 N/A LEU 310.A N PHE 322.A O no hydrogen 2.887 N/A ILE 311.A N CYS 295.A O no hydrogen 2.909 N/A ALA 312.A N TRP 320.A O no hydrogen 2.948 N/A VAL 313.A N ASP 293.A O no hydrogen 2.867 N/A ASN 314.A N GLU 318.A O no hydrogen 2.958 N/A ALA 315.A N ASN 314.A OD1 no hydrogen 2.358 N/A GLY 317.A N ASN 314.A O no hydrogen 3.090 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.441 N/A VAL 319.A N TRP 334.A O no hydrogen 2.851 N/A TRP 320.A N ALA 312.A O no hydrogen 2.929 N/A GLU 321.A N ARG 332.A O no hydrogen 2.928 N/A PHE 322.A N LEU 310.A O no hydrogen 2.914 N/A ASP 323.A N HIS 329.A O no hydrogen 3.102 N/A LEU 324.A N THR 308.A O no hydrogen 2.908 N/A ILE 331.A N GLU 321.A O no hydrogen 2.290 N/A ARG 332.A N GLU 321.A O no hydrogen 3.030 N/A ARG 332.A NE GLU 321.A OE1 no hydrogen 3.338 N/A ARG 332.A NH1 ALA 386.A O no hydrogen 2.952 N/A ARG 332.A NH2 MET 387.A O no hydrogen 2.288 N/A TRP 334.A N VAL 319.A O no hydrogen 2.974 N/A TRP 334.A NE1 GLU 321.A OE1 no hydrogen 2.297 N/A ASP 336.A N GLY 317.A O no hydrogen 2.887 N/A GLN 337.A N TYR 381.A OH no hydrogen 3.240 N/A GLN 337.A NE2 PRO 392.A O no hydrogen 2.625 N/A ILE 342.A N ALA 315.A O no hydrogen 3.051 N/A THR 343.A N GLY 372.A O no hydrogen 3.018 N/A LYS 344.A N GLY 372.A O no hydrogen 2.967 N/A LYS 344.A NZ SER 406.A O no hydrogen 3.511 N/A ILE 345.A N ASP 293.A OD2 no hydrogen 2.494 N/A GLN 346.A N ALA 370.A O no hydrogen 2.943 N/A GLN 346.A NE2 VAL 347.A O no hydrogen 2.204 N/A GLY 348.A N TRP 368.A O no hydrogen 2.891 N/A GLY 350.A N ASN 366.A OD1 no hydrogen 3.122 N/A THR 351.A OG1 LYS 364.A O no hydrogen 3.080 N/A THR 352.A N CYS 355.A O no hydrogen 2.685 N/A THR 353.A N THR 352.A OG1 no hydrogen 2.474 N/A CYS 355.A SG GLY 350.A O no hydrogen 3.837 N/A CYS 355.A SG PRO 412.A O no hydrogen 3.478 N/A LYS 362.A N GLN 359.A O no hydrogen 3.378 N/A ILE 363.A N ILE 360.A O no hydrogen 3.209 N/A LYS 364.A NZ ILE 363.A O no hydrogen 3.346 N/A ASN 366.A ND2 ASP 297.A OD1 no hydrogen 3.008 N/A ARG 367.A N GLY 348.A O no hydrogen 2.961 N/A TRP 368.A N GLY 348.A O no hydrogen 2.915 N/A LEU 369.A N TYR 381.A O no hydrogen 2.997 N/A ALA 370.A N GLN 346.A O no hydrogen 2.868 N/A VAL 371.A N ASN 379.A O no hydrogen 2.951 N/A GLY 372.A N LYS 344.A O no hydrogen 2.914 N/A SER 373.A N PHE 377.A O no hydrogen 2.912 N/A GLU 374.A N GLU 374.A OE2 no hydrogen 2.683 N/A SER 375.A OG SER 375.A O no hydrogen 2.541 N/A GLY 376.A N SER 373.A O no hydrogen 2.381 N/A VAL 378.A N LEU 398.A O no hydrogen 2.969 N/A ASN 379.A N VAL 371.A O no hydrogen 2.876 N/A ASN 379.A ND2 ASP 336.A OD1 no hydrogen 2.714 N/A LEU 380.A N ALA 396.A O no hydrogen 2.914 N/A TYR 381.A N LEU 369.A O no hydrogen 2.901 N/A TYR 381.A OH ASP 336.A OD1 no hydrogen 2.175 N/A ARG 383.A N ARG 367.A O no hydrogen 3.037 N/A ARG 383.A NH2 GLU 321.A OE2 no hydrogen 3.492 N/A ASN 384.A N ASP 382.A OD1 no hydrogen 2.917 N/A ASN 385.A N ASP 382.A O no hydrogen 3.311 N/A ALA 386.A N ASP 382.A O no hydrogen 2.989 N/A MET 387.A N ARG 383.A O no hydrogen 3.009 N/A SER 389.A N ASN 385.A O no hydrogen 2.940 N/A SER 389.A OG ASN 385.A O no hydrogen 3.238 N/A SER 389.A OG ALA 386.A O no hydrogen 2.827 N/A SER 390.A N ALA 386.A O no hydrogen 3.026 N/A THR 391.A OG1 THR 391.A O no hydrogen 2.341 N/A ALA 396.A N LEU 380.A O no hydrogen 3.052 N/A LEU 398.A N VAL 378.A O no hydrogen 2.900 N/A ASP 399.A N GLN 400.A OE1 no hydrogen 2.966 N/A THR 402.A OG1 THR 403.A OG1 no hydrogen 2.957 N/A THR 403.A OG1 THR 402.A OG1 no hydrogen 2.957 N/A SER 406.A N ALA 420.A O no hydrogen 2.952 N/A SER 406.A OG ALA 420.A O no hydrogen 2.723 N/A ASN 407.A N ALA 420.A O no hydrogen 2.948 N/A ASN 407.A ND2 SER 406.A OG no hydrogen 3.381 N/A ASN 407.A ND2 THR 453.A O no hydrogen 3.694 N/A GLN 409.A N CYS 418.A O no hydrogen 3.050 N/A GLN 409.A NE2 VAL 455.A O no hydrogen 2.374 N/A SER 411.A N ILE 416.A O no hydrogen 2.864 N/A GLY 414.A N SER 411.A O no hydrogen 2.845 N/A GLN 415.A N SER 411.A OG no hydrogen 2.973 N/A ILE 416.A N SER 411.A OG no hydrogen 3.312 N/A LEU 417.A N VAL 431.A O no hydrogen 2.912 N/A CYS 418.A N GLN 409.A O no hydrogen 2.898 N/A CYS 418.A SG GLN 409.A O no hydrogen 3.769 N/A MET 419.A N ARG 429.A O no hydrogen 2.897 N/A ALA 420.A N ASN 407.A O no hydrogen 2.862 N/A SER 421.A N ALA 427.A O no hydrogen 2.906 N/A SER 421.A OG THR 404.A O no hydrogen 2.582 N/A ASP 426.A N GLY 450.A O no hydrogen 3.084 N/A ARG 429.A N MET 419.A O no hydrogen 2.904 N/A ARG 429.A NH1 LEU 428.A O no hydrogen 3.147 N/A VAL 431.A N LEU 417.A O no hydrogen 2.854 N/A HIS 432.A N SER 437.A O no hydrogen 2.870 N/A LEU 433.A N GLN 415.A O no hydrogen 2.913 N/A SER 435.A OG HIS 432.A ND1 no hydrogen 3.127 N/A CYS 436.A SG PRO 434.A O no hydrogen 3.505 N/A SER 437.A N HIS 432.A O no hydrogen 3.003 N/A SER 437.A OG VAL 438.A O no hydrogen 3.374 N/A PHE 439.A N LEU 430.A O no hydrogen 2.899 N/A SER 440.A OG LYS 125.A O no hydrogen 2.701 N/A ASN 441.A ND2 LEU 127.A O no hydrogen 2.547 N/A THR 444.A OG1 THR 447.A OG1 no hydrogen 2.834 N/A THR 447.A N THR 444.A O no hydrogen 3.321 N/A THR 447.A OG1 THR 444.A O no hydrogen 2.837 N/A THR 447.A OG1 THR 444.A OG1 no hydrogen 2.834 N/A LYS 451.A NZ ALA 423.A O no hydrogen 2.564 N/A THR 453.A N GLY 467.A O no hydrogen 3.061 N/A SER 454.A N GLY 467.A O no hydrogen 2.951 N/A SER 454.A OG ILE 145.A O no hydrogen 2.481 N/A SER 454.A OG THR 453.A O no hydrogen 2.763 N/A ALA 456.A N ALA 465.A O no hydrogen 2.921 N/A SER 458.A N LEU 463.A O no hydrogen 2.904 N/A SER 460.A N SER 458.A OG no hydrogen 3.350 N/A LEU 464.A N TRP 476.A O no hydrogen 2.852 N/A ALA 465.A N ALA 456.A O no hydrogen 2.912 N/A VAL 466.A N ARG 474.A O no hydrogen 2.903 N/A GLY 467.A N SER 454.A O no hydrogen 2.821 N/A ASN 468.A N LYS 472.A O no hydrogen 2.949 N/A ASN 468.A ND2 LEU 449.A O no hydrogen 3.597 N/A GLU 469.A N LYS 451.A O no hydrogen 3.249 N/A GLY 471.A N ASN 468.A O no hydrogen 3.473 N/A LYS 472.A NZ ASN 136.A O no hydrogen 3.409 N/A ARG 474.A N VAL 466.A O no hydrogen 2.821 N/A TRP 476.A N LEU 464.A O no hydrogen 2.924 N/A LYS 477.A N VAL 130.A O no hydrogen 2.809 N/A LEU 478.A N GLY 462.A O no hydrogen 2.913 N/A ASN 479.A N ASP 128.A O no hydrogen 2.869 N/A TYR 481.A N LEU 478.A O no hydrogen 3.325 N/A