Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3muu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLY 52.A O no hydrogen 3.364 N/A THR 4.A OG1 TYR 92.A OH no hydrogen 3.278 N/A TYR 7.A N SER 43.A O no hydrogen 3.097 N/A GLY 9.A N SER 22.A O no hydrogen 3.098 N/A CYS 11.A N CYS 20.A O no hydrogen 3.024 N/A CYS 11.A SG TYR 13.A O no hydrogen 3.478 N/A CYS 11.A SG THR 118.A O no hydrogen 3.652 N/A CYS 14.A N HIS 16.A O no hydrogen 3.132 N/A CYS 20.A N CYS 11.A O no hydrogen 2.947 N/A CYS 20.A SG SER 22.A OG no hydrogen 3.359 N/A SER 22.A OG PRO 23.A O no hydrogen 2.910 N/A LYS 25.A N SER 43.A OG no hydrogen 3.138 N/A LYS 25.A NZ THR 10.A O no hydrogen 2.992 N/A GLU 27.A N GLN 41.A O no hydrogen 2.929 N/A TRP 30.A N ARG 39.A O no hydrogen 2.767 N/A GLU 32.A N TYR 148.A OH no hydrogen 3.320 N/A ASP 34.A N THR 146.A O no hydrogen 3.235 N/A ASN 36.A N ASP 35.A OD1 no hydrogen 2.496 N/A ASN 36.A ND2 CYS 98.A O no hydrogen 3.431 N/A THR 37.A OG1 ASP 35.A OD2 no hydrogen 3.209 N/A ILE 38.A N ALA 96.A O no hydrogen 2.758 N/A ARG 39.A N TRP 30.A O no hydrogen 3.198 N/A ARG 39.A NH2 ASP 350.A OD1 no hydrogen 3.388 N/A ILE 40.A N LEU 94.A O no hydrogen 2.888 N/A GLN 41.A N GLN 28.A O no hydrogen 3.155 N/A THR 42.A N TYR 92.A O no hydrogen 2.971 N/A THR 42.A OG1 ALA 44.A O no hydrogen 3.529 N/A THR 42.A OG1 TYR 92.A O no hydrogen 2.932 N/A SER 43.A OG TYR 7.A O no hydrogen 3.088 N/A GLN 45.A N ARG 60.A O no hydrogen 3.114 N/A PHE 46.A N GLY 91.A O no hydrogen 2.713 N/A GLY 47.A N LYS 58.A O no hydrogen 2.511 N/A SER 51.A N ASP 49.A OD1 no hydrogen 3.240 N/A ALA 53.A N SER 51.A O no hydrogen 2.818 N/A SER 55.A N GLY 47.A O no hydrogen 2.966 N/A LYS 58.A N SER 55.A O no hydrogen 3.334 N/A TYR 59.A N GLY 72.A O no hydrogen 3.340 N/A ARG 60.A N GLN 45.A O no hydrogen 2.724 N/A TYR 61.A N LYS 70.A O no hydrogen 3.303 N/A SER 62.A OG THR 68.A O no hydrogen 3.260 N/A THR 68.A OG1 SER 62.A OG no hydrogen 3.382 N/A LYS 70.A NZ SER 62.A OG no hydrogen 3.144 N/A GLY 72.A N TYR 59.A O no hydrogen 3.218 N/A THR 73.A OG1 ASN 57.A O no hydrogen 3.285 N/A ASP 75.A N THR 73.A O no hydrogen 2.948 N/A LYS 77.A N SER 107.A O no hydrogen 3.308 N/A SER 79.A N THR 105.A O no hydrogen 3.062 N/A SER 79.A OG THR 105.A O no hydrogen 3.466 N/A SER 81.A N THR 80.A OG1 no hydrogen 2.670 N/A SER 81.A OG SER 81.A O no hydrogen 2.478 N/A CYS 84.A SG PRO 83.A O no hydrogen 3.207 N/A LEU 87.A N LEU 95.A O no hydrogen 2.804 N/A LYS 90.A N PHE 93.A O no hydrogen 2.983 N/A TYR 92.A OH THR 4.A OG1 no hydrogen 3.278 N/A TYR 92.A OH SER 5.A O no hydrogen 2.653 N/A PHE 93.A N LYS 90.A O no hydrogen 3.071 N/A LEU 94.A N ILE 40.A O no hydrogen 2.802 N/A ALA 96.A N ILE 38.A O no hydrogen 3.084 N/A LYS 97.A N ARG 85.A O no hydrogen 3.338 N/A VAL 104.A N LEU 119.A O no hydrogen 2.886 N/A THR 105.A N SER 79.A O no hydrogen 2.769 N/A VAL 106.A N CYS 117.A O no hydrogen 2.920 N/A SER 107.A N LYS 77.A O no hydrogen 3.403 N/A ILE 108.A N THR 115.A O no hydrogen 2.967 N/A VAL 109.A N ASP 75.A O no hydrogen 3.129 N/A CYS 117.A N VAL 106.A O no hydrogen 3.090 N/A THR 118.A N TYR 13.A O no hydrogen 3.148 N/A LEU 119.A N VAL 104.A O no hydrogen 2.601 N/A ILE 123.A N GLY 101.A O no hydrogen 2.688 N/A LYS 126.A NZ ASP 31.A OD1 no hydrogen 3.027 N/A LYS 126.A NZ ALA 33.A O no hydrogen 2.884 N/A VAL 128.A N TYR 133.A OH no hydrogen 3.339 N/A ARG 130.A NH1 THR 191.A OG1 no hydrogen 2.431 N/A LYS 132.A N LEU 187.A O no hydrogen 2.899 N/A LYS 141.A N VAL 163.A O no hydrogen 2.861 N/A LYS 141.A NZ ASN 227.A O no hydrogen 2.901 N/A LYS 141.A NZ GLU 229.A OE2 no hydrogen 3.320 N/A ILE 143.A N CYS 162.A O no hydrogen 2.743 N/A CYS 145.A N SER 160.A O no hydrogen 2.863 N/A CYS 145.A SG ILE 143.A O no hydrogen 4.028 N/A THR 146.A N ASP 34.A OD2 no hydrogen 2.915 N/A THR 146.A OG1 ASP 34.A OD1 no hydrogen 3.531 N/A THR 146.A OG1 ASP 34.A OD2 no hydrogen 3.542 N/A VAL 147.A N ILE 158.A O no hydrogen 2.913 N/A ASP 149.A N LYS 156.A O no hydrogen 2.964 N/A ILE 158.A N VAL 147.A O no hydrogen 3.072 N/A SER 160.A N CYS 145.A O no hydrogen 2.498 N/A THR 161.A OG1 ILE 143.A O no hydrogen 3.431 N/A CYS 162.A N ILE 143.A O no hydrogen 2.818 N/A VAL 163.A N LYS 141.A O no hydrogen 3.093 N/A ILE 172.A N SER 179.A O no hydrogen 3.121 N/A GLY 174.A N HIS 177.A O no hydrogen 3.055 N/A ILE 178.A N PHE 214.A O no hydrogen 2.980 N/A SER 179.A N ILE 172.A O no hydrogen 3.253 N/A LEU 180.A N ARG 212.A O no hydrogen 3.045 N/A GLN 181.A N ASN 170.A O no hydrogen 3.203 N/A LEU 182.A N THR 210.A O no hydrogen 2.918 N/A THR 184.A N GLY 208.A O no hydrogen 2.909 N/A THR 188.A N ILE 206.A O no hydrogen 3.060 N/A LEU 189.A N ARG 130.A O no hydrogen 3.048 N/A LEU 190.A N GLU 204.A O no hydrogen 2.705 N/A THR 191.A N ILE 224.A O no hydrogen 2.935 N/A THR 192.A OG1 THR 202.A O no hydrogen 3.433 N/A ARG 193.A N GLU 222.A O no hydrogen 3.198 N/A ARG 193.A NE GLU 222.A OE1 no hydrogen 2.812 N/A ARG 193.A NH1 ALA 489.A O no hydrogen 2.919 N/A ARG 193.A NH1 CYS 493.A O no hydrogen 3.243 N/A ARG 193.A NH2 GLU 222.A OE1 no hydrogen 2.906 N/A ARG 193.A NH2 CYS 493.A O no hydrogen 3.106 N/A ARG 194.A N PRO 199.A O no hydrogen 2.927 N/A ARG 194.A NE THR 215.A OG1 no hydrogen 3.187 N/A ARG 194.A NH2 THR 215.A OG1 no hydrogen 2.797 N/A THR 202.A N THR 192.A O no hydrogen 3.236 N/A THR 202.A OG1 GLU 200.A O no hydrogen 2.965 N/A GLU 204.A N LEU 190.A O no hydrogen 3.291 N/A ILE 206.A N THR 188.A O no hydrogen 2.732 N/A GLY 208.A N THR 184.A O no hydrogen 2.933 N/A THR 210.A N LEU 182.A O no hydrogen 3.271 N/A THR 210.A OG1 VAL 211.A O no hydrogen 3.547 N/A ARG 212.A NE VAL 211.A O no hydrogen 2.982 N/A PHE 214.A N ILE 178.A O no hydrogen 2.970 N/A VAL 216.A N LYS 176.A O no hydrogen 3.048 N/A ARG 218.A N VAL 216.A O no hydrogen 2.560 N/A ASP 219.A N ASP 217.A OD1 no hydrogen 2.950 N/A LEU 221.A N VAL 233.A O no hydrogen 2.849 N/A GLU 222.A N ARG 193.A O no hydrogen 2.971 N/A TYR 223.A N VAL 231.A O no hydrogen 2.783 N/A ILE 224.A N THR 191.A O no hydrogen 3.110 N/A VAL 231.A N GLU 229.A O no hydrogen 2.927 N/A ARG 232.A NH2 GLU 222.A OE2 no hydrogen 3.355 N/A VAL 233.A N LEU 221.A O no hydrogen 2.917 N/A TYR 241.A N ILE 516.A O no hydrogen 2.864 N/A HIS 243.A N ILE 514.A O no hydrogen 2.774 N/A THR 245.A N ILE 512.A O no hydrogen 3.117 N/A VAL 247.A N ILE 510.A O no hydrogen 2.763 N/A ASN 249.A N GLY 508.A O no hydrogen 2.855 N/A ASN 249.A ND2 TYR 507.A O no hydrogen 3.504 N/A GLN 252.A N VAL 273.A O no hydrogen 3.200 N/A ILE 253.A N VAL 250.A O no hydrogen 3.462 N/A TYR 255.A N ILE 271.A O no hydrogen 2.833 N/A ALA 257.A N LEU 269.A O no hydrogen 2.875 N/A VAL 259.A N LEU 267.A O no hydrogen 3.505 N/A ARG 261.A NH1 ASN 518.A OD1 no hydrogen 2.878 N/A ARG 261.A NH2 ASN 518.A OD1 no hydrogen 3.021 N/A TYR 264.A N ARG 261.A O no hydrogen 3.140 N/A ALA 265.A N ILE 522.A O no hydrogen 2.568 N/A LEU 267.A N VAL 259.A O no hydrogen 3.276 N/A ASN 268.A ND2 GLY 374.A O no hydrogen 3.314 N/A GLU 270.A N VAL 372.A O no hydrogen 3.177 N/A ILE 271.A N TYR 255.A O no hydrogen 3.066 N/A THR 272.A N ARG 370.A O no hydrogen 2.915 N/A THR 272.A OG1 ARG 370.A O no hydrogen 3.410 N/A SER 275.A N ASP 504.A OD1 no hydrogen 3.435 N/A SER 275.A OG CYS 505.A O no hydrogen 3.487 N/A GLU 276.A N LYS 366.A O no hydrogen 3.151 N/A LEU 278.A N ALA 365.A O no hydrogen 2.814 N/A SER 280.A N HIS 362.A O no hydrogen 3.199 N/A SER 280.A OG HIS 362.A O no hydrogen 2.727 N/A SER 280.A OG THR 363.A O no hydrogen 3.384 N/A ASN 282.A N LYS 360.A O no hydrogen 3.248 N/A GLU 284.A N ALA 358.A O no hydrogen 2.838 N/A TYR 285.A OH PRO 426.A O no hydrogen 2.534 N/A ILE 286.A N ALA 440.A O no hydrogen 2.461 N/A THR 287.A OG1 ILE 438.A O no hydrogen 2.977 N/A CYS 288.A SG CYS 351.A O no hydrogen 3.823 N/A THR 291.A N GLU 346.A O no hydrogen 3.032 N/A THR 292.A OG1 GLN 470.A OE1 no hydrogen 3.435 N/A VAL 293.A N TYR 344.A O no hydrogen 2.645 N/A LYS 300.A N SER 339.A O no hydrogen 3.281 N/A CYS 302.A N ASN 338.A OD1 no hydrogen 3.147 N/A TYR 315.A N HIS 312.A O no hydrogen 3.172 N/A TYR 315.A OH GLU 342.A OE1 no hydrogen 2.796 N/A THR 316.A N ALA 343.A O no hydrogen 2.957 N/A THR 316.A OG1 ALA 343.A O no hydrogen 3.389 N/A LYS 318.A N SER 341.A O no hydrogen 2.816 N/A PHE 320.A N GLN 340.A O no hydrogen 2.794 N/A GLY 322.A N ASN 338.A O no hydrogen 2.687 N/A TYR 324.A OH GLN 340.A OE1 no hydrogen 2.983 N/A TYR 324.A OH ASN 463.A O no hydrogen 3.246 N/A CYS 332.A SG ASN 338.A OD1 no hydrogen 2.926 N/A SER 339.A OG GLY 303.A O no hydrogen 2.558 N/A GLN 340.A N PHE 320.A O no hydrogen 2.817 N/A ALA 343.A N THR 316.A O no hydrogen 2.958 N/A TYR 344.A N VAL 293.A O no hydrogen 2.996 N/A GLU 346.A N THR 291.A O no hydrogen 2.620 N/A SER 348.A N LYS 289.A O no hydrogen 3.035 N/A SER 348.A OG GLU 32.A OE2 no hydrogen 3.194 N/A CYS 351.A N SER 348.A O no hydrogen 2.862 N/A CYS 351.A SG LYS 289.A O no hydrogen 3.461 N/A SER 353.A N ASP 350.A O no hydrogen 2.951 N/A SER 353.A OG LEU 157.A O no hydrogen 2.716 N/A ASP 354.A N ASP 350.A O no hydrogen 3.319 N/A HIS 355.A ND1 CYS 351.A O no hydrogen 3.197 N/A ALA 356.A N THR 287.A O no hydrogen 3.045 N/A GLN 357.A N ILE 415.A O no hydrogen 2.915 N/A ALA 358.A N TYR 285.A O no hydrogen 3.027 N/A LYS 360.A N ASN 282.A O no hydrogen 3.195 N/A LYS 360.A NZ HIS 411.A NE2 no hydrogen 3.302 N/A LYS 360.A NZ GLU 427.A OE2 no hydrogen 2.955 N/A VAL 361.A N HIS 411.A O no hydrogen 2.632 N/A HIS 362.A N SER 280.A O no hydrogen 3.203 N/A ALA 365.A N LEU 278.A O no hydrogen 2.925 N/A LYS 366.A N GLU 276.A O no hydrogen 3.324 N/A GLY 368.A N SER 274.A O no hydrogen 2.579 N/A LEU 369.A N LEU 380.A O no hydrogen 2.993 N/A ARG 370.A N THR 272.A O no hydrogen 2.917 N/A ILE 371.A N SER 378.A O no hydrogen 2.845 N/A VAL 372.A N GLU 270.A O no hydrogen 2.939 N/A TYR 373.A N THR 376.A O no hydrogen 2.860 N/A GLY 374.A N ASN 268.A O no hydrogen 3.268 N/A THR 376.A N TYR 373.A O no hydrogen 3.191 N/A THR 376.A OG1 TYR 373.A O no hydrogen 3.348 N/A SER 378.A N ILE 371.A O no hydrogen 2.705 N/A LEU 380.A N LEU 369.A O no hydrogen 3.011 N/A VAL 382.A N VAL 367.A O no hydrogen 3.019 N/A ASN 385.A N TYR 383.A O no hydrogen 3.245 N/A THR 388.A N ASN 385.A OD1 no hydrogen 3.326 N/A GLY 390.A N VAL 397.A O no hydrogen 2.661 N/A SER 392.A N GLY 390.A O no hydrogen 2.311 N/A ILE 398.A N SER 513.A O no hydrogen 3.203 N/A SER 403.A OG ASN 509.A O no hydrogen 3.096 N/A PHE 409.A N THR 407.A OG1 no hydrogen 3.133 N/A LYS 412.A NZ PHE 425.A O no hydrogen 3.438 N/A VAL 413.A N ILE 359.A O no hydrogen 2.790 N/A VAL 414.A N TYR 421.A O no hydrogen 2.799 N/A ILE 415.A N GLN 357.A O no hydrogen 3.315 N/A HIS 416.A N LEU 419.A O no hydrogen 2.685 N/A ARG 417.A NH1 ASP 34.A OD1 no hydrogen 3.284 N/A ARG 417.A NH2 SER 353.A O no hydrogen 3.148 N/A TYR 421.A N VAL 414.A O no hydrogen 2.782 N/A PHE 425.A N TYR 423.A O no hydrogen 2.875 N/A TYR 428.A OH ASP 447.A O no hydrogen 2.771 N/A GLY 429.A N GLN 439.A OE1 no hydrogen 2.695 N/A ALA 430.A N GLU 427.A O no hydrogen 2.868 N/A GLN 439.A N ILE 449.A O no hydrogen 3.212 N/A GLN 439.A NE2 GLU 427.A O no hydrogen 3.299 N/A THR 441.A OG1 LYS 446.A O no hydrogen 2.775 N/A ASP 447.A N SER 445.A O no hydrogen 3.014 N/A ILE 449.A N GLN 439.A O no hydrogen 3.147 N/A SER 451.A N ASP 437.A O no hydrogen 3.071 N/A ARG 455.A N THR 469.A O no hydrogen 3.070 N/A LEU 457.A N PRO 467.A O no hydrogen 3.181 N/A LYS 462.A N SER 460.A O no hydrogen 3.306 N/A THR 469.A N ARG 455.A O no hydrogen 2.912 N/A GLN 470.A NE2 THR 452.A OG1 no hydrogen 2.914 N/A ALA 471.A N THR 452.A O no hydrogen 3.051 N/A GLY 474.A N ASP 437.A OD2 no hydrogen 3.080 N/A LYS 478.A N PHE 475.A O no hydrogen 2.704 N/A LYS 478.A NZ ASP 354.A OD2 no hydrogen 2.805 N/A ASN 479.A N GLU 476.A O no hydrogen 2.931 N/A ASN 480.A N TRP 477.A O no hydrogen 2.903 N/A SER 481.A N LYS 478.A O no hydrogen 3.088 N/A SER 481.A OG LYS 478.A O no hydrogen 2.962 N/A ARG 483.A NH1 GLU 487.A OE1 no hydrogen 3.216 N/A ARG 483.A NH1 GLU 487.A OE2 no hydrogen 3.121 N/A LEU 485.A N VAL 420.A O no hydrogen 2.901 N/A GLN 486.A NE2 GLY 418.A O no hydrogen 3.349 N/A GLU 487.A N PRO 484.A O no hydrogen 3.119 N/A THR 488.A N LEU 485.A O no hydrogen 2.826 N/A ALA 489.A N LEU 485.A O no hydrogen 2.792 N/A GLY 492.A N ALA 489.A O no hydrogen 3.447 N/A LYS 494.A N VAL 503.A O no hydrogen 2.775 N/A ALA 496.A N ARG 501.A O no hydrogen 2.902 N/A ASN 498.A N PRO 499.A O no hydrogen 2.940 N/A ARG 501.A N ALA 496.A O no hydrogen 3.078 N/A ALA 502.A N VAL 277.A O no hydrogen 3.223 N/A ASP 504.A N SER 275.A O no hydrogen 2.895 N/A CYS 505.A SG ALA 502.A O no hydrogen 3.409 N/A ASN 509.A N SER 403.A OG no hydrogen 2.839 N/A ILE 510.A N VAL 247.A O no hydrogen 2.583 N/A ILE 512.A N THR 245.A O no hydrogen 2.981 N/A SER 513.A N ILE 398.A O no hydrogen 2.962 N/A SER 513.A OG GLU 242.A OE2 no hydrogen 3.498 N/A ILE 514.A N HIS 243.A O no hydrogen 2.854 N/A ASP 515.A N LYS 396.A O no hydrogen 3.126 N/A ILE 516.A N TYR 241.A O no hydrogen 2.823 N/A ALA 520.A N PRO 517.A O no hydrogen 3.036 N/A PHE 521.A N ASN 518.A O no hydrogen 3.017 N/A THR 524.A OG1 GLY 263.A O no hydrogen 2.627 N/A SER 531.A N VAL 554.A O no hydrogen 3.019 N/A SER 531.A OG VAL 554.A O no hydrogen 3.371 N/A THR 532.A OG1 SER 531.A O no hydrogen 2.549 N/A THR 532.A OG1 THR 532.A O no hydrogen 2.490 N/A LYS 534.A N GLN 552.A O no hydrogen 3.057 N/A GLU 536.A N THR 550.A O no hydrogen 2.929 N/A CYS 540.A SG THR 541.A O no hydrogen 3.705 N/A SER 543.A OG GLN 236.A O no hydrogen 3.044 N/A SER 543.A OG TYR 542.A O no hydrogen 2.518 N/A GLY 548.A N PHE 589.A O no hydrogen 2.855 N/A THR 550.A N GLU 536.A O no hydrogen 2.575 N/A THR 550.A OG1 GLU 536.A O no hydrogen 3.454 N/A LEU 551.A N VAL 585.A O no hydrogen 2.690 N/A TYR 553.A N GLY 583.A O no hydrogen 3.334 N/A TYR 553.A OH LEU 580.A O no hydrogen 3.038 N/A VAL 554.A N SER 531.A O no hydrogen 3.147 N/A SER 555.A OG ARG 557.A O no hydrogen 3.273 N/A SER 555.A OG LEU 580.A O no hydrogen 2.885 N/A ASP 556.A N LEU 529.A O no hydrogen 2.754 N/A GLY 559.A N VAL 579.A O no hydrogen 3.343 N/A GLN 560.A NE2 HIS 578.A ND1 no hydrogen 3.666 N/A CYS 561.A N VAL 577.A O no hydrogen 2.876 N/A VAL 563.A N SER 575.A O no hydrogen 2.637 N/A HIS 564.A N SER 601.A O no hydrogen 3.257 N/A SER 565.A OG ALA 570.A O no hydrogen 2.757 N/A HIS 566.A N ILE 599.A O no hydrogen 2.841 N/A THR 569.A OG1 ASN 597.A O no hydrogen 3.322 N/A ALA 570.A N SER 567.A O no hydrogen 3.263 N/A THR 571.A N SER 590.A O no hydrogen 3.233 N/A THR 571.A OG1 SER 590.A OG no hydrogen 3.301 N/A GLN 573.A N HIS 588.A O no hydrogen 2.866 N/A SER 575.A OG ASN 268.A OD1 no hydrogen 3.027 N/A VAL 577.A N CYS 561.A O no hydrogen 2.677 N/A VAL 585.A N LEU 551.A O no hydrogen 3.012 N/A VAL 587.A N ALA 549.A O no hydrogen 2.882 N/A PHE 589.A N GLY 548.A O no hydrogen 3.208 N/A SER 590.A N THR 571.A O no hydrogen 2.986 N/A SER 590.A OG THR 571.A O no hydrogen 3.475 N/A ILE 599.A N SER 567.A OG no hydrogen 3.393 N/A SER 601.A N HIS 564.A O no hydrogen 2.909 N/A SER 601.A OG HIS 564.A O no hydrogen 2.872 N/A SER 601.A OG HIS 566.A NE2 no hydrogen 2.835 N/A THR 607.A N VAL 600.A O no hydrogen 2.953 N/A CYS 609.A N PHE 598.A O no hydrogen 3.314 N/A CYS 613.A N PRO 594.A O no hydrogen 2.823 N/A CYS 613.A SG PRO 594.A O no hydrogen 3.850 N/A