Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7kek_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 36.A N ASN 35.A OD1 no hydrogen 2.768 N/A ILE 42.A N ASP 40.A OD1 no hydrogen 2.684 N/A THR 81.A OG1 ALA 78.A O no hydrogen 2.703 N/A GLY 82.A N ALA 78.A O no hydrogen 2.915 N/A ARG 83.A N GLN 79.A O no hydrogen 3.013 N/A PHE 84.A N GLU 80.A O no hydrogen 3.411 N/A LYS 85.A N THR 81.A O no hydrogen 2.978 N/A LYS 86.A N GLY 82.A O no hydrogen 3.376 N/A ARG 87.A N ARG 83.A O no hydrogen 2.806 N/A ILE 88.A N PHE 84.A O no hydrogen 3.260 N/A ILE 88.A N LYS 85.A O no hydrogen 3.232 N/A GLU 89.A N LYS 85.A O no hydrogen 3.319 N/A SER 91.A OG LYS 90.A O no hydrogen 3.298 N/A GLN 94.A N SER 91.A O no hydrogen 3.248 N/A VAL 96.A N PHE 92.A O no hydrogen 3.267 N/A ASP 98.A N GLN 94.A O no hydrogen 2.985 N/A LEU 99.A N ALA 95.A O no hydrogen 2.587 N/A LYS 100.A N VAL 96.A O no hydrogen 2.976 N/A GLU 101.A N LYS 97.A O no hydrogen 2.955 N/A GLY 102.A N ASP 98.A O no hydrogen 3.311 N/A GLY 102.A N LEU 99.A O no hydrogen 2.887 N/A VAL 103.A N LEU 99.A O no hydrogen 2.981 N/A GLU 104.A N LYS 100.A O no hydrogen 2.542 N/A CYS 106.A SG GLY 102.A O no hydrogen 3.662 N/A ILE 107.A N VAL 103.A O no hydrogen 2.881 N/A TYR 108.A N GLU 104.A O no hydrogen 3.177 N/A TYR 108.A OH GLU 104.A OE2 no hydrogen 3.409 N/A ASN 110.A N CYS 106.A O no hydrogen 3.462 N/A ASN 111.A N ILE 107.A O no hydrogen 3.101 N/A ASN 111.A N TYR 108.A O no hydrogen 3.114 N/A GLN 112.A N GLN 109.A O no hydrogen 3.467 N/A TYR 119.A OH GLU 117.A OE1 no hydrogen 2.708 N/A HIS 127.A ND1 HIS 127.A O no hydrogen 2.642 N/A LYS 135.A N GLU 476.A O no hydrogen 3.115 N/A LEU 137.A N ILE 474.A O no hydrogen 3.014 N/A PHE 140.A N VAL 472.A O no hydrogen 3.059 N/A CYS 147.A SG LYS 148.A O no hydrogen 3.817 N/A LYS 148.A NZ ASP 469.A OD1 no hydrogen 3.308 N/A ARG 149.A NE ASP 142.A OD2 no hydrogen 3.224 N/A ARG 149.A NH1 PRO 181.A O no hydrogen 2.644 N/A ARG 149.A NH1 GLN 183.A O no hydrogen 2.846 N/A ARG 149.A NH2 ASP 142.A OD2 no hydrogen 3.007 N/A ARG 149.A NH2 GLN 183.A O no hydrogen 3.244 N/A SER 150.A OG GLN 468.A O no hydrogen 3.152 N/A VAL 151.A N ASP 467.A O no hydrogen 3.030 N/A SER 152.A OG SER 167.A OG no hydrogen 2.597 N/A SER 152.A OG VAL 205.A O no hydrogen 3.353 N/A SER 152.A OG THR 206.A O no hydrogen 2.792 N/A SER 155.A N ALA 165.A O no hydrogen 2.952 N/A HIS 157.A N LYS 163.A O no hydrogen 3.364 N/A THR 162.A N GLY 160.A O no hydrogen 2.984 N/A LYS 163.A NZ ASP 216.A OD1 no hydrogen 3.070 N/A VAL 164.A N TRP 187.A O no hydrogen 3.010 N/A VAL 166.A N TYR 185.A O no hydrogen 3.213 N/A SER 167.A N GLU 153.A O no hydrogen 3.023 N/A SER 167.A OG SER 152.A OG no hydrogen 2.597 N/A SER 167.A OG GLU 153.A O no hydrogen 3.264 N/A SER 167.A OG VAL 205.A O no hydrogen 3.539 N/A SER 167.A OG THR 206.A O no hydrogen 2.995 N/A ALA 169.A N SER 150.A O no hydrogen 3.194 N/A ARG 172.A NH2 GLN 175.A OE1 no hydrogen 3.316 N/A GLN 175.A NE2 PHE 173.A O no hydrogen 3.367 N/A THR 182.A OG1 THR 182.A O no hydrogen 2.624 N/A ALA 184.A N LEU 199.A O no hydrogen 3.245 N/A TYR 185.A N VAL 166.A O no hydrogen 3.306 N/A VAL 186.A N ILE 197.A O no hydrogen 3.216 N/A TRP 187.A N VAL 164.A O no hydrogen 3.172 N/A LEU 189.A N THR 162.A O no hydrogen 3.236 N/A GLU 196.A N VAL 186.A O no hydrogen 3.092 N/A LYS 198.A NZ GLN 183.A OE1 no hydrogen 3.355 N/A LEU 199.A N ALA 184.A O no hydrogen 2.876 N/A MET 200.A N GLU 236.A O no hydrogen 2.666 N/A SER 201.A OG THR 182.A O no hydrogen 3.451 N/A SER 201.A OG SER 203.A O no hydrogen 2.925 N/A THR 206.A N GLY 221.A O no hydrogen 2.773 N/A THR 206.A OG1 GLY 221.A O no hydrogen 3.315 N/A ASN 207.A N GLY 221.A O no hydrogen 3.455 N/A SER 209.A N GLY 219.A O no hydrogen 3.100 N/A GLY 219.A N SER 209.A O no hydrogen 3.173 N/A GLY 220.A N ALA 228.A O no hydrogen 2.822 N/A GLY 221.A N ASN 207.A O no hydrogen 2.797 N/A CYS 222.A N LEU 226.A O no hydrogen 2.766 N/A CYS 222.A SG SER 203.A O no hydrogen 3.450 N/A TYR 223.A N ALA 204.A O no hydrogen 2.818 N/A LEU 227.A N SER 242.A OG no hydrogen 3.084 N/A ALA 228.A N GLY 220.A O no hydrogen 2.783 N/A VAL 229.A N MET 240.A O no hydrogen 3.039 N/A TRP 230.A N ILE 218.A O no hydrogen 2.851 N/A TRP 230.A NE1 MET 200.A O no hydrogen 3.250 N/A GLY 232.A N ASP 216.A O no hydrogen 3.352 N/A GLY 235.A N ASP 231.A O no hydrogen 2.674 N/A GLU 236.A N LYS 198.A O no hydrogen 3.031 N/A ILE 239.A N VAL 229.A O no hydrogen 2.859 N/A MET 240.A N VAL 229.A O no hydrogen 3.503 N/A SER 242.A N LEU 227.A O no hydrogen 3.225 N/A SER 247.A OG GLY 225.A O no hydrogen 2.719 N/A VAL 252.A N CYS 222.A O no hydrogen 3.421 N/A THR 253.A N THR 269.A O no hydrogen 3.090 N/A THR 253.A OG1 PRO 251.A O no hydrogen 3.354 N/A HIS 256.A N VAL 267.A O no hydrogen 3.306 N/A TRP 257.A NE1 SER 209.A O no hydrogen 3.200 N/A LEU 258.A N GLU 265.A O no hydrogen 2.660 N/A SER 260.A OG SER 260.A O no hydrogen 2.700 N/A SER 260.A OG TYR 311.A OH no hydrogen 2.526 N/A LYS 261.A N MET 259.A O no hydrogen 2.847 N/A GLY 263.A N THR 262.A OG1 no hydrogen 2.748 N/A CYS 266.A N TRP 278.A O no hydrogen 3.099 N/A CYS 266.A SG THR 280.A OG1 no hydrogen 3.489 N/A VAL 267.A N HIS 256.A O no hydrogen 2.957 N/A THR 268.A N MET 276.A O no hydrogen 2.859 N/A THR 268.A OG1 VAL 267.A O no hydrogen 2.890 N/A THR 269.A N HIS 254.A O no hydrogen 3.245 N/A THR 269.A OG1 GLY 306.A O no hydrogen 3.026 N/A SER 270.A OG HIS 248.A ND1 no hydrogen 3.034 N/A GLY 273.A N SER 270.A O no hydrogen 3.136 N/A VAL 275.A N LEU 291.A O no hydrogen 2.864 N/A MET 276.A N THR 268.A O no hydrogen 2.936 N/A TRP 278.A N CYS 266.A O no hydrogen 2.637 N/A THR 280.A OG1 SER 264.A O no hydrogen 3.166 N/A VAL 288.A N TRP 277.A O no hydrogen 3.423 N/A LYS 290.A NZ ASN 246.A O no hydrogen 3.217 N/A LYS 290.A NZ ASN 246.A OD1 no hydrogen 3.523 N/A LEU 291.A N VAL 275.A O no hydrogen 3.209 N/A ILE 293.A N GLY 273.A O no hydrogen 3.207 N/A ILE 294.A N ASN 292.A O no hydrogen 3.099 N/A ILE 304.A N ILE 293.A O no hydrogen 3.343 N/A GLY 306.A N SER 270.A O no hydrogen 2.755 N/A THR 307.A N GLY 323.A O no hydrogen 2.805 N/A THR 307.A OG1 GLY 305.A O no hydrogen 3.057 N/A THR 307.A OG1 GLU 325.A OE2 no hydrogen 3.328 N/A ALA 308.A N GLY 323.A O no hydrogen 3.322 N/A GLU 310.A N LEU 321.A O no hydrogen 2.687 N/A GLY 316.A N ASN 312.A O no hydrogen 2.950 N/A LYS 319.A NZ GLU 383.A OE2 no hydrogen 3.000 N/A PHE 320.A N ALA 332.A O no hydrogen 3.176 N/A LEU 321.A N GLU 310.A O no hydrogen 2.996 N/A ILE 322.A N LEU 330.A O no hydrogen 2.809 N/A GLY 323.A N ALA 308.A O no hydrogen 2.648 N/A THR 324.A N SER 328.A O no hydrogen 3.227 N/A THR 324.A OG1 SER 328.A O no hydrogen 2.679 N/A THR 324.A OG1 SER 328.A OG no hydrogen 2.866 N/A SER 328.A OG GLU 295.A OE1 no hydrogen 2.978 N/A SER 328.A OG THR 324.A OG1 no hydrogen 2.866 N/A ILE 329.A N TYR 346.A O no hydrogen 3.055 N/A LEU 330.A N ILE 322.A O no hydrogen 2.742 N/A THR 331.A OG1 THR 343.A OG1 no hydrogen 2.747 N/A THR 331.A OG1 THR 344.A O no hydrogen 3.323 N/A ALA 332.A N PHE 320.A O no hydrogen 2.925 N/A ASN 333.A N GLU 341.A O no hydrogen 2.954 N/A LYS 334.A N SER 318.A O no hydrogen 3.338 N/A THR 343.A N THR 331.A O no hydrogen 2.843 N/A THR 343.A OG1 THR 331.A O no hydrogen 3.354 N/A THR 343.A OG1 THR 331.A OG1 no hydrogen 2.747 N/A THR 343.A OG1 THR 344.A OG1 no hydrogen 3.406 N/A THR 344.A N THR 331.A OG1 no hydrogen 2.843 N/A THR 344.A N THR 343.A OG1 no hydrogen 2.712 N/A THR 344.A OG1 THR 331.A OG1 no hydrogen 3.326 N/A THR 344.A OG1 THR 343.A OG1 no hydrogen 3.406 N/A ARG 345.A NH1 ILE 342.A O no hydrogen 3.223 N/A TYR 346.A N ILE 329.A O no hydrogen 2.765 N/A ARG 352.A NE SER 326.A O no hydrogen 3.300 N/A ARG 352.A NH1 SER 326.A O no hydrogen 3.559 N/A HIS 353.A NE2 SER 377.A O no hydrogen 3.032 N/A GLY 355.A N ASP 375.A OD2 no hydrogen 2.898 N/A VAL 357.A N THR 324.A O no hydrogen 3.240 N/A SER 359.A OG TYR 358.A O no hydrogen 3.039 N/A ASN 361.A N LEU 371.A O no hydrogen 3.047 N/A ARG 362.A NH1 PRO 367.A O no hydrogen 3.181 N/A ARG 362.A NH1 GLU 383.A OE2 no hydrogen 3.364 N/A ARG 362.A NH2 GLU 383.A OE2 no hydrogen 3.308 N/A SER 363.A N TYR 369.A O no hydrogen 3.479 N/A SER 363.A OG ASN 366.A O no hydrogen 2.572 N/A SER 363.A OG TYR 369.A O no hydrogen 3.320 N/A GLN 365.A NE2 PRO 406.A O no hydrogen 2.979 N/A LEU 371.A N ASN 361.A O no hydrogen 2.871 N/A SER 372.A N LYS 379.A O no hydrogen 2.999 N/A VAL 373.A N SER 359.A O no hydrogen 2.807 N/A SER 377.A N ASP 375.A OD1 no hydrogen 3.264 N/A SER 377.A OG ASP 375.A OD1 no hydrogen 3.475 N/A CYS 378.A SG LYS 379.A O no hydrogen 3.492 N/A LYS 379.A N SER 372.A O no hydrogen 3.072 N/A LYS 379.A NZ GLY 351.A O no hydrogen 2.663 N/A LYS 379.A NZ ARG 352.A O no hydrogen 3.453 N/A ILE 380.A N ILE 390.A O no hydrogen 2.892 N/A TRP 381.A N PHE 370.A O no hydrogen 2.807 N/A THR 387.A OG1 GLU 503.A OE1 no hydrogen 3.195 N/A ILE 389.A N ILE 380.A O no hydrogen 2.770 N/A THR 392.A N CYS 378.A O no hydrogen 3.288 N/A SER 397.A OG GLY 396.A O no hydrogen 2.672 N/A SER 397.A OG TYR 398.A O no hydrogen 3.181 N/A LEU 399.A N ASP 375.A O no hydrogen 2.908 N/A SER 400.A N VAL 415.A O no hydrogen 3.136 N/A SER 400.A OG LEU 444.A O no hydrogen 2.794 N/A CYS 403.A N PHE 413.A O no hydrogen 2.937 N/A CYS 403.A SG ASP 401.A OD1 no hydrogen 3.700 N/A SER 405.A N ALA 411.A O no hydrogen 3.179 N/A SER 405.A OG THR 407.A OG1 no hydrogen 3.101 N/A THR 407.A OG1 SER 405.A OG no hydrogen 3.101 N/A THR 407.A OG1 TYR 482.A O no hydrogen 2.613 N/A ARG 408.A NE LEU 481.A O no hydrogen 3.024 N/A ARG 408.A NH2 SER 480.A O no hydrogen 2.705 N/A SER 409.A OG GLU 488.A OE2 no hydrogen 3.349 N/A PHE 412.A N TRP 424.A O no hydrogen 3.369 N/A PHE 413.A N CYS 403.A O no hydrogen 2.800 N/A LEU 414.A N ASP 422.A O no hydrogen 2.965 N/A VAL 415.A N ASP 401.A O no hydrogen 3.103 N/A ARG 416.A N TRP 420.A O no hydrogen 2.843 N/A ARG 417.A N TYR 398.A O no hydrogen 3.064 N/A ASP 418.A N SER 397.A OG no hydrogen 2.781 N/A GLY 419.A N ARG 416.A O no hydrogen 3.267 N/A MET 421.A N HIS 437.A O no hydrogen 2.958 N/A ASP 422.A N LEU 414.A O no hydrogen 2.943 N/A VAL 423.A N PHE 435.A O no hydrogen 3.198 N/A TRP 424.A N PHE 412.A O no hydrogen 3.123 N/A TYR 427.A OH PRO 486.A O no hydrogen 3.229 N/A ARG 429.A N ASP 425.A O no hydrogen 3.466 N/A GLN 430.A NE2 GLU 499.A OE2 no hydrogen 3.315 N/A GLU 432.A N ASN 431.A OD1 no hydrogen 2.724 N/A ALA 434.A N VAL 423.A O no hydrogen 2.890 N/A HIS 437.A N MET 421.A O no hydrogen 2.904 N/A SER 440.A OG SER 442.A O no hydrogen 3.527 N/A SER 442.A N SER 440.A OG no hydrogen 3.060 N/A THR 445.A N GLY 466.A O no hydrogen 2.655 N/A THR 445.A OG1 VAL 151.A O no hydrogen 2.608 N/A THR 445.A OG1 GLY 466.A O no hydrogen 2.948 N/A CYS 446.A N GLY 466.A O no hydrogen 3.329 N/A CYS 446.A SG GLU 153.A OE2 no hydrogen 3.244 N/A CYS 446.A SG ASP 401.A OD2 no hydrogen 3.424 N/A CYS 446.A SG ILE 447.A O no hydrogen 3.613 N/A LYS 448.A N ALA 464.A O no hydrogen 2.848 N/A ASN 450.A N LEU 462.A O no hydrogen 3.191 N/A ASN 450.A ND2 ASN 458.A O no hydrogen 2.836 N/A THR 452.A OG1 PRO 158.A O no hydrogen 3.093 N/A THR 452.A OG1 GLU 159.A O no hydrogen 3.356 N/A THR 452.A OG1 GLN 451.A O no hydrogen 2.485 N/A GLY 454.A N HIS 457.A O no hydrogen 2.914 N/A GLY 460.A N ASN 450.A O no hydrogen 2.863 N/A LYS 461.A NZ TYR 482.A OH no hydrogen 3.096 N/A LEU 462.A N ASN 450.A OD1 no hydrogen 2.980 N/A CYS 463.A N LEU 475.A O no hydrogen 3.170 N/A ILE 465.A N THR 473.A O no hydrogen 2.915 N/A GLY 466.A N CYS 446.A O no hydrogen 2.696 N/A ASP 467.A N THR 471.A O no hydrogen 2.965 N/A GLN 468.A N PRO 443.A O no hydrogen 2.985 N/A GLY 470.A N ASP 467.A O no hydrogen 3.273 N/A VAL 472.A N PHE 140.A O no hydrogen 3.072 N/A THR 473.A N ILE 465.A O no hydrogen 3.138 N/A LEU 475.A N CYS 463.A O no hydrogen 3.232 N/A GLU 476.A N LYS 135.A O no hydrogen 2.898 N/A LEU 477.A N LYS 461.A O no hydrogen 2.961 N/A CYS 478.A SG GLU 130.A OE2 no hydrogen 2.883 N/A CYS 478.A SG ASN 131.A O no hydrogen 3.702 N/A SER 480.A OG GLU 130.A OE2 no hydrogen 3.511 N/A LEU 481.A N CYS 478.A O no hydrogen 3.038 N/A THR 483.A OG1 ASP 479.A O no hydrogen 2.700 N/A ILE 491.A N LYS 487.A O no hydrogen 3.297 N/A ILE 492.A N GLU 488.A O no hydrogen 3.134 N/A ASN 493.A N LYS 489.A O no hydrogen 3.307 N/A GLU 494.A N ASP 490.A O no hydrogen 3.040 N/A MET 495.A N ILE 491.A O no hydrogen 2.919 N/A PHE 496.A N ILE 492.A O no hydrogen 2.935 N/A GLU 497.A N ASN 493.A O no hydrogen 2.918 N/A ARG 498.A N GLU 494.A O no hydrogen 2.959 N/A GLU 499.A N MET 495.A O no hydrogen 2.927 N/A TYR 500.A N PHE 496.A O no hydrogen 2.761 N/A ARG 501.A N GLU 497.A O no hydrogen 3.034 N/A LYS 502.A N ARG 498.A O no hydrogen 2.917 N/A LYS 502.A NZ LYS 502.A O no hydrogen 2.694 N/A GLU 503.A N GLU 499.A O no hydrogen 3.035 N/A LYS 504.A N TYR 500.A O no hydrogen 3.262 N/A ASN 505.A N ARG 501.A O no hydrogen 3.172 N/A LEU 506.A N LYS 502.A O no hydrogen 2.952 N/A GLU 507.A N GLU 503.A O no hydrogen 3.376 N/A THR 508.A N LYS 504.A O no hydrogen 3.339 N/A THR 508.A OG1 ASN 505.A O no hydrogen 2.427 N/A ILE 509.A N ASN 505.A O no hydrogen 3.027 N/A LYS 510.A N LEU 506.A O no hydrogen 2.898 N/A LYS 510.A NZ ASP 349.A OD2 no hydrogen 3.558 N/A LYS 511.A N GLU 507.A O no hydrogen 2.804 N/A GLN 512.A N THR 508.A O no hydrogen 3.029 N/A GLN 513.A N ILE 509.A O no hydrogen 3.041 N/A GLU 514.A N LYS 510.A O no hydrogen 3.275 N/A LEU 515.A N LYS 511.A O no hydrogen 2.928 N/A ALA 516.A N GLN 512.A O no hydrogen 2.666 N/A LYS 517.A N GLN 513.A O no hydrogen 3.030 N/A ARG 518.A N GLU 514.A O no hydrogen 3.373 N/A GLN 519.A N LEU 515.A O no hydrogen 2.859 N/A VAL 520.A N ALA 516.A O no hydrogen 3.080 N/A GLN 521.A N LYS 517.A O no hydrogen 3.155 N/A LYS 522.A N ARG 518.A O no hydrogen 2.310 N/A GLU 532.A N LYS 528.A O no hydrogen 3.281 N/A LYS 533.A N GLU 529.A O no hydrogen 3.100 N/A LYS 534.A N LYS 530.A O no hydrogen 3.056 N/A LYS 535.A N TRP 531.A O no hydrogen 3.010 N/A LEU 536.A N GLU 532.A O no hydrogen 2.974 N/A GLU 537.A N LYS 533.A O no hydrogen 2.987 N/A MET 538.A N LYS 534.A O no hydrogen 3.294 N/A ILE 539.A N LYS 535.A O no hydrogen 3.302 N/A GLU 540.A N LEU 536.A O no hydrogen 2.912 N/A THR 541.A N GLU 537.A O no hydrogen 3.032 N/A THR 541.A OG1 GLU 537.A O no hydrogen 3.361 N/A THR 541.A OG1 MET 538.A O no hydrogen 2.653 N/A ALA 542.A N MET 538.A O no hydrogen 3.139 N/A GLU 543.A N ILE 539.A O no hydrogen 2.933 N/A ALA 544.A N GLU 540.A O no hydrogen 3.026 N/A SER 545.A N THR 541.A O no hydrogen 3.044 N/A SER 545.A OG THR 541.A O no hydrogen 3.501 N/A SER 545.A OG ALA 542.A O no hydrogen 2.527 N/A PHE 546.A N ALA 542.A O no hydrogen 2.974 N/A HIS 547.A N GLU 543.A O no hydrogen 2.987 N/A GLU 548.A N ALA 544.A O no hydrogen 3.355 N/A ASN 549.A N SER 545.A O no hydrogen 3.113 N/A LEU 550.A N PHE 546.A O no hydrogen 2.840 N/A ALA 551.A N HIS 547.A O no hydrogen 2.806 N/A LYS 552.A N GLU 548.A O no hydrogen 2.909 N/A ASN 553.A N ASN 549.A O no hydrogen 3.217 N/A VAL 555.A N ALA 551.A O no hydrogen 3.187 N/A