Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ekm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 7.A N LEU 3.A O no hydrogen 3.239 N/A SER 7.A OG LEU 3.A O no hydrogen 3.464 N/A TYR 9.A N LEU 6.A O no hydrogen 3.100 N/A LEU 10.A N SER 7.A O no hydrogen 3.432 N/A LEU 18.A N SER 15.A O no hydrogen 2.774 N/A LEU 23.A N LEU 20.A O no hydrogen 3.265 N/A ILE 24.A N LEU 20.A O no hydrogen 3.165 N/A CYS 25.A N VAL 21.A O no hydrogen 2.890 N/A CYS 25.A SG VAL 21.A O no hydrogen 3.288 N/A GLY 27.A N ILE 24.A O no hydrogen 2.956 N/A LEU 28.A N ILE 24.A O no hydrogen 2.930 N/A ARG 33.A NH1 ASN 36.A OD1 no hydrogen 3.373 N/A ALA 34.A N LEU 31.A O no hydrogen 3.307 N/A ASN 36.A ND2 GLN 73.A OE1 no hydrogen 3.602 N/A PHE 42.A N LEU 38.A O no hydrogen 2.791 N/A TYR 43.A N VAL 39.A O no hydrogen 3.005 N/A ARG 44.A N PRO 40.A O no hydrogen 3.209 N/A ASN 45.A N ILE 41.A O no hydrogen 3.214 N/A ILE 46.A N PHE 42.A O no hydrogen 3.140 N/A VAL 47.A N TYR 43.A O no hydrogen 3.257 N/A ASN 48.A N ARG 44.A O no hydrogen 3.046 N/A LEU 49.A N ASN 45.A O no hydrogen 3.010 N/A LEU 50.A N ILE 46.A O no hydrogen 3.071 N/A THR 51.A N VAL 47.A O no hydrogen 3.115 N/A THR 51.A OG1 VAL 47.A O no hydrogen 2.896 N/A GLU 52.A N ASN 48.A O no hydrogen 3.049 N/A LYS 53.A N LEU 50.A O no hydrogen 3.329 N/A ALA 54.A N LEU 49.A O no hydrogen 3.280 N/A SER 58.A N PRO 55.A O no hydrogen 3.347 N/A SER 58.A OG SER 58.A O no hydrogen 2.527 N/A LEU 59.A N TRP 56.A O no hydrogen 3.292 N/A ALA 60.A N TRP 56.A O no hydrogen 3.328 N/A THR 62.A N LEU 59.A O no hydrogen 3.378 N/A THR 64.A OG1 ALA 60.A O no hydrogen 3.059 N/A TYR 66.A N VAL 63.A O no hydrogen 3.026 N/A VAL 67.A N VAL 63.A O no hydrogen 3.043 N/A LYS 70.A N VAL 67.A O no hydrogen 3.091 N/A PHE 71.A N VAL 67.A O no hydrogen 2.909 N/A LEU 72.A N PHE 68.A O no hydrogen 2.956 N/A GLN 73.A N LEU 69.A O no hydrogen 3.312 N/A GLY 75.A N SER 79.A O no hydrogen 3.091 N/A VAL 83.A N LEU 72.A O no hydrogen 3.314 N/A ASN 85.A ND2 THR 80.A O no hydrogen 3.303 N/A LEU 86.A N VAL 83.A O no hydrogen 3.366 N/A VAL 94.A N TRP 91.A O no hydrogen 3.250 N/A GLN 95.A N TRP 91.A O no hydrogen 3.262 N/A GLN 96.A N ILE 92.A O no hydrogen 2.979 N/A THR 98.A OG1 VAL 94.A O no hydrogen 3.259 N/A SER 99.A OG GLN 95.A O no hydrogen 3.341 N/A LEU 105.A N VAL 102.A O no hydrogen 2.950 N/A HIS 109.A N ILE 106.A O no hydrogen 2.969 N/A LEU 110.A N ILE 106.A O no hydrogen 2.927 N/A HIS 111.A ND1 PHE 107.A O no hydrogen 3.096 N/A GLU 112.A N HIS 109.A O no hydrogen 3.453 N/A LEU 119.A N ARG 116.A O no hydrogen 2.776 N/A GLU 125.A N ARG 122.A O no hydrogen 3.456 N/A LEU 127.A N THR 123.A O no hydrogen 3.354 N/A ARG 132.A N ARG 128.A O no hydrogen 3.265 N/A THR 134.A OG1 ALA 130.A O no hydrogen 2.924 N/A SER 135.A OG ASP 131.A O no hydrogen 3.490 N/A SER 136.A OG ARG 132.A O no hydrogen 3.542 N/A SER 136.A OG GLY 133.A O no hydrogen 3.085 N/A THR 138.A OG1 THR 134.A O no hydrogen 3.470 N/A LEU 140.A N SER 136.A O no hydrogen 2.853 N/A LEU 141.A N VAL 137.A O no hydrogen 3.076 N/A SER 142.A N THR 138.A O no hydrogen 3.127 N/A TYR 143.A N GLY 139.A O no hydrogen 3.116 N/A LEU 144.A N LEU 140.A O no hydrogen 3.245 N/A VAL 145.A N LEU 141.A O no hydrogen 3.135 N/A PHE 146.A N SER 142.A O no hydrogen 3.005 N/A ASN 147.A N TYR 143.A O no hydrogen 2.905 N/A VAL 148.A N TYR 143.A O no hydrogen 2.905 N/A ILE 149.A N LEU 144.A O no hydrogen 3.171 N/A THR 151.A OG1 ASN 147.A O no hydrogen 2.749 N/A LEU 152.A N VAL 148.A O no hydrogen 3.040 N/A ALA 153.A N PRO 150.A O no hydrogen 3.127 N/A ASP 154.A N THR 151.A O no hydrogen 3.266 N/A GLY 158.A N ILE 155.A O no hydrogen 2.945 N/A ILE 160.A N ILE 156.A O no hydrogen 3.363 N/A SER 163.A OG ILE 159.A O no hydrogen 2.881 N/A MET 164.A N ILE 160.A O no hydrogen 3.028 N/A ILE 173.A N TRP 169.A O no hydrogen 3.288 N/A VAL 174.A N PHE 170.A O no hydrogen 3.056 N/A PHE 175.A N GLY 171.A O no hydrogen 2.994 N/A LEU 176.A N LEU 172.A O no hydrogen 2.906 N/A CYS 177.A N ILE 173.A O no hydrogen 2.976 N/A CYS 177.A SG VAL 261.A O no hydrogen 3.606 N/A MET 178.A N VAL 174.A O no hydrogen 2.995 N/A SER 179.A N PHE 175.A O no hydrogen 3.135 N/A LEU 180.A N LEU 176.A O no hydrogen 3.238 N/A TYR 181.A N CYS 177.A O no hydrogen 2.898 N/A LEU 182.A N SER 179.A O no hydrogen 3.067 N/A THR 183.A N SER 179.A O no hydrogen 2.984 N/A THR 183.A OG1 SER 179.A O no hydrogen 3.409 N/A LEU 184.A N LEU 180.A O no hydrogen 3.020 N/A THR 185.A N LEU 182.A O no hydrogen 3.271 N/A THR 185.A OG1 TYR 181.A O no hydrogen 2.684 N/A ILE 186.A N LEU 182.A O no hydrogen 3.254 N/A THR 189.A N THR 185.A O no hydrogen 3.287 N/A THR 189.A OG1 THR 185.A O no hydrogen 2.509 N/A GLU 190.A N ILE 186.A O no hydrogen 3.390 N/A TRP 191.A N VAL 188.A O no hydrogen 3.348 N/A ARG 192.A N THR 189.A O no hydrogen 3.033 N/A PHE 195.A N ARG 192.A O no hydrogen 3.066 N/A MET 199.A N ARG 196.A O no hydrogen 2.955 N/A ASN 200.A N ARG 196.A O no hydrogen 3.034 N/A THR 201.A OG1 ARG 197.A O no hydrogen 3.028 N/A GLU 203.A N MET 199.A O no hydrogen 3.395 N/A THR 206.A OG1 GLN 202.A O no hydrogen 3.080 N/A THR 206.A OG1 ALA 236.A O no hydrogen 3.015 N/A ARG 207.A N GLU 203.A O no hydrogen 3.271 N/A ARG 207.A NH1 GLU 203.A OE1 no hydrogen 3.430 N/A ARG 209.A N THR 206.A O no hydrogen 3.087 N/A ARG 209.A NH2 GLU 229.A OE2 no hydrogen 3.220 N/A SER 213.A N ARG 209.A O no hydrogen 3.292 N/A SER 213.A OG SER 213.A O no hydrogen 2.508 N/A SER 213.A OG GLU 229.A OE1 no hydrogen 3.142 N/A LEU 214.A N VAL 211.A O no hydrogen 2.912 N/A LEU 215.A N VAL 211.A O no hydrogen 2.693 N/A TYR 222.A N THR 219.A O no hydrogen 3.452 N/A TYR 222.A OH GLU 218.A OE2 no hydrogen 2.960 N/A ALA 225.A N VAL 220.A O no hydrogen 3.372 N/A VAL 230.A N SER 227.A O no hydrogen 3.189 N/A GLU 231.A N SER 227.A O no hydrogen 3.031 N/A TYR 233.A N VAL 230.A O no hydrogen 3.357 N/A ARG 234.A N VAL 230.A O no hydrogen 3.177 N/A ARG 234.A NH1 GLU 231.A OE2 no hydrogen 3.279 N/A ILE 237.A N ARG 234.A O no hydrogen 3.137 N/A ILE 238.A N ARG 234.A O no hydrogen 3.143 N/A GLN 241.A N ILE 237.A O no hydrogen 3.284 N/A LEU 243.A N TYR 240.A O no hydrogen 3.163 N/A SER 247.A N GLU 244.A O no hydrogen 3.317 N/A SER 248.A OG GLU 244.A O no hydrogen 3.282 N/A ALA 249.A N TRP 245.A O no hydrogen 3.189 N/A ASN 255.A N LEU 251.A O no hydrogen 3.176 N/A ASN 255.A N VAL 252.A O no hydrogen 3.236 N/A GLN 256.A N LEU 253.A O no hydrogen 3.465 N/A THR 257.A OG1 LEU 253.A O no hydrogen 3.147 N/A GLN 258.A N LEU 254.A O no hydrogen 3.298 N/A GLN 258.A NE2 THR 185.A OG1 no hydrogen 3.147 N/A LEU 264.A N VAL 261.A O no hydrogen 3.262 N/A GLY 265.A N VAL 261.A O no hydrogen 3.111 N/A LEU 267.A N LEU 264.A O no hydrogen 3.322 N/A ALA 268.A N LEU 264.A O no hydrogen 3.001 N/A SER 270.A OG TYR 287.A OH no hydrogen 3.154 N/A LEU 271.A N LEU 267.A O no hydrogen 3.347 N/A CYS 273.A N GLY 269.A O no hydrogen 3.007 N/A CYS 273.A SG ASP 286.A O no hydrogen 3.352 N/A ALA 274.A N SER 270.A O no hydrogen 3.019 N/A TYR 275.A N LEU 271.A O no hydrogen 3.216 N/A PHE 276.A N LEU 272.A O no hydrogen 3.196 N/A VAL 277.A N CYS 273.A O no hydrogen 3.206 N/A THR 278.A N ALA 274.A O no hydrogen 3.203 N/A THR 278.A OG1 ALA 274.A O no hydrogen 2.988 N/A GLU 279.A N TYR 275.A O no hydrogen 3.111 N/A GLN 280.A N VAL 277.A O no hydrogen 2.984 N/A LYS 281.A N PHE 276.A O no hydrogen 3.181 N/A ASP 286.A N GLN 283.A O no hydrogen 3.246 N/A TYR 287.A OH SER 270.A OG no hydrogen 3.154 N/A THR 292.A OG1 VAL 288.A O no hydrogen 3.029 N/A GLN 296.A NE2 ASN 36.A O no hydrogen 3.217 N/A LEU 297.A N ILE 294.A O no hydrogen 2.851 N/A LEU 301.A N TYR 298.A O no hydrogen 2.936 N/A ASN 302.A N MET 299.A O no hydrogen 3.349 N/A ARG 309.A N THR 306.A O no hydrogen 3.340 N/A MET 310.A N THR 306.A O no hydrogen 3.488 N/A THR 313.A N ARG 309.A O no hydrogen 2.810 N/A THR 313.A OG1 ARG 309.A O no hydrogen 2.737 N/A ASN 314.A N ILE 311.A O no hydrogen 3.172 N/A ASP 317.A N THR 313.A O no hydrogen 3.088 N/A MET 321.A N MET 318.A O no hydrogen 3.333 N/A LEU 325.A N MET 321.A O no hydrogen 3.131 N/A LYS 326.A N ASP 323.A O no hydrogen 3.066 N/A LYS 326.A NZ PHE 322.A O no hydrogen 2.902 N/A LYS 326.A NZ ASP 323.A OD1 no hydrogen 3.249 N/A VAL 331.A N THR 329.A O no hydrogen 2.758 N/A LEU 337.A N SER 415.A OG no hydrogen 2.931 N/A ARG 338.A N GLN 406.A OE1 no hydrogen 3.258 N/A GLN 340.A N ASP 404.A OD2 no hydrogen 3.112 N/A LYS 341.A N ASP 404.A OD2 no hydrogen 3.032 N/A GLY 342.A N ASP 404.A OD1 no hydrogen 2.775 N/A GLY 342.A N ASP 404.A OD2 no hydrogen 2.920 N/A ARG 343.A N ASP 404.A OD1 no hydrogen 2.697 N/A ILE 344.A N VAL 367.A O no hydrogen 3.243 N/A GLU 345.A N ARG 402.A O no hydrogen 2.928 N/A PHE 346.A N PHE 365.A O no hydrogen 3.077 N/A GLU 347.A N CYS 400.A O no hydrogen 2.976 N/A ASN 348.A N SER 364.A OG no hydrogen 2.751 N/A ASN 348.A ND2 ASP 362.A OD1 no hydrogen 2.396 N/A VAL 349.A N VAL 363.A O no hydrogen 3.244 N/A PHE 351.A N LEU 360.A O no hydrogen 3.266 N/A SER 352.A OG ARG 357.A O no hydrogen 3.031 N/A TYR 353.A OH THR 385.A OG1 no hydrogen 2.891 N/A THR 359.A N PHE 351.A O no hydrogen 2.849 N/A LEU 360.A N PHE 351.A O no hydrogen 3.382 N/A GLN 361.A N GLY 554.A O no hydrogen 2.965 N/A VAL 363.A N VAL 349.A O no hydrogen 3.432 N/A VAL 367.A N ILE 344.A O no hydrogen 2.784 N/A LEU 373.A N THR 532.A O no hydrogen 2.967 N/A ALA 374.A N GLN 547.A O no hydrogen 2.793 N/A LEU 375.A N VAL 534.A O no hydrogen 2.965 N/A VAL 376.A N LEU 549.A O no hydrogen 2.851 N/A LYS 383.A NZ GLY 377.A O no hydrogen 2.845 N/A LYS 383.A NZ HIS 537.A NE2 no hydrogen 3.082 N/A THR 385.A OG1 TYR 353.A OH no hydrogen 2.891 N/A ARG 388.A N THR 385.A O no hydrogen 3.110 N/A LEU 389.A N THR 385.A O no hydrogen 3.182 N/A LEU 390.A N ILE 386.A O no hydrogen 3.241 N/A ARG 392.A N LEU 389.A O no hydrogen 3.225 N/A PHE 393.A N ARG 388.A O no hydrogen 3.140 N/A SER 397.A N HIS 350.A O no hydrogen 3.185 N/A SER 397.A OG HIS 350.A O no hydrogen 2.747 N/A CYS 400.A N GLU 347.A O no hydrogen 3.232 N/A ARG 402.A N GLU 345.A O no hydrogen 2.864 N/A ILE 403.A N GLN 406.A O no hydrogen 2.872 N/A ASP 404.A N ARG 343.A O no hydrogen 2.904 N/A GLN 406.A N ILE 403.A O no hydrogen 3.141 N/A ILE 408.A N ILE 401.A O no hydrogen 3.286 N/A SER 409.A N ASP 407.A OD1 no hydrogen 3.295 N/A THR 412.A N GLY 335.A O no hydrogen 3.189 N/A THR 412.A OG1 SER 415.A OG no hydrogen 2.629 N/A SER 415.A N THR 412.A O no hydrogen 3.333 N/A SER 415.A OG THR 412.A O no hydrogen 3.096 N/A SER 415.A OG THR 412.A OG1 no hydrogen 2.629 N/A LEU 416.A N THR 412.A O no hydrogen 3.143 N/A ARG 417.A NE GLN 413.A O no hydrogen 3.193 N/A SER 418.A OG SER 415.A O no hydrogen 2.878 N/A GLY 421.A N ILE 501.A O no hydrogen 2.832 N/A VAL 423.A N LEU 503.A O no hydrogen 3.195 N/A THR 427.A OG1 LYS 486.A O no hydrogen 3.453 N/A ILE 434.A N THR 472.A O no hydrogen 3.328 N/A ASP 436.A N THR 433.A O no hydrogen 3.151 N/A ASN 437.A N THR 433.A O no hydrogen 3.275 N/A ASN 437.A ND2 PHE 430.A O no hydrogen 3.561 N/A ILE 438.A N ILE 434.A O no hydrogen 3.228 N/A ARG 439.A NE ALA 435.A O no hydrogen 3.026 N/A ALA 445.A N ARG 442.A O no hydrogen 3.339 N/A GLU 449.A N GLY 446.A O no hydrogen 3.244 N/A VAL 450.A N GLY 446.A O no hydrogen 3.283 N/A GLU 451.A N ASN 447.A O no hydrogen 3.456 N/A ALA 453.A N GLU 449.A O no hydrogen 3.216 N/A ALA 454.A N VAL 450.A O no hydrogen 3.053 N/A GLN 455.A N ALA 452.A O no hydrogen 3.365 N/A GLY 458.A N GLN 455.A O no hydrogen 3.258 N/A ALA 462.A N ILE 459.A O no hydrogen 2.833 N/A ILE 463.A N ILE 459.A O no hydrogen 3.185 N/A PHE 466.A N ILE 463.A O no hydrogen 2.973 N/A ARG 471.A NH1 GLU 468.A O no hydrogen 3.382 N/A LEU 479.A N GLU 476.A O no hydrogen 3.476 N/A LYS 480.A N VAL 474.A O no hydrogen 2.874 N/A LEU 481.A N GLY 478.A O no hydrogen 3.396 N/A GLY 484.A N SER 482.A OG no hydrogen 2.997 N/A LYS 486.A NZ GLY 478.A O no hydrogen 2.807 N/A LYS 486.A NZ SER 482.A O no hydrogen 2.872 N/A GLN 487.A N GLY 484.A O no hydrogen 3.245 N/A GLN 487.A NE2 GLU 506.A O no hydrogen 3.355 N/A GLN 487.A NE2 SER 509.A OG no hydrogen 3.233 N/A ARG 488.A N GLY 484.A O no hydrogen 3.195 N/A ALA 490.A N GLN 487.A O no hydrogen 2.892 N/A ILE 491.A N GLN 487.A O no hydrogen 3.287 N/A ALA 492.A N ARG 488.A O no hydrogen 3.326 N/A ARG 493.A N VAL 489.A O no hydrogen 2.971 N/A THR 494.A OG1 ALA 490.A O no hydrogen 3.094 N/A ILE 495.A N ILE 491.A O no hydrogen 3.368 N/A ILE 495.A N ALA 492.A O no hydrogen 3.216 N/A LEU 496.A N ALA 492.A O no hydrogen 3.380 N/A LYS 497.A N ARG 493.A O no hydrogen 3.383 N/A LYS 497.A NZ ARG 417.A O no hydrogen 2.890 N/A LYS 497.A NZ ILE 420.A O no hydrogen 2.664 N/A ALA 498.A N THR 494.A O no hydrogen 3.230 N/A ILE 501.A N HIS 419.A O no hydrogen 2.750 N/A ILE 502.A N THR 531.A O no hydrogen 2.764 N/A LEU 503.A N GLY 421.A O no hydrogen 2.915 N/A LEU 504.A N ILE 533.A O no hydrogen 3.018 N/A SER 509.A OG GLU 506.A OE1 no hydrogen 3.290 N/A ALA 510.A N GLN 487.A OE1 no hydrogen 3.207 N/A LEU 511.A N THR 508.A O no hydrogen 3.324 N/A THR 513.A OG1 GLU 516.A OE2 no hydrogen 3.366 N/A ASN 515.A N ASP 512.A O no hydrogen 3.440 N/A ILE 519.A N GLU 516.A O no hydrogen 2.851 N/A GLN 520.A N GLU 516.A O no hydrogen 2.447 N/A ALA 521.A N ARG 517.A O no hydrogen 3.419 N/A SER 522.A OG ALA 456.A O no hydrogen 3.357 N/A LEU 523.A N ILE 519.A O no hydrogen 2.488 N/A LYS 525.A NZ ALA 521.A O no hydrogen 3.099 N/A VAL 526.A N LEU 523.A O no hydrogen 2.959 N/A CYS 527.A N LEU 523.A O no hydrogen 2.554 N/A CYS 527.A SG LEU 523.A O no hydrogen 3.401 N/A CYS 527.A SG THR 532.A OG1 no hydrogen 3.062 N/A THR 531.A OG1 GLY 342.A O no hydrogen 2.696 N/A THR 532.A N GLN 371.A O no hydrogen 3.413 N/A THR 532.A OG1 ARG 530.A O no hydrogen 3.355 N/A ILE 533.A N ILE 502.A O no hydrogen 2.966 N/A VAL 534.A N LEU 373.A O no hydrogen 2.869 N/A VAL 535.A N LEU 504.A O no hydrogen 3.360 N/A ARG 538.A NH1 GLU 516.A OE1 no hydrogen 2.540 N/A ARG 538.A NH2 LEU 511.A O no hydrogen 3.485 N/A THR 541.A OG1 ARG 538.A O no hydrogen 3.512 N/A ASP 546.A N THR 372.A O no hydrogen 2.983 N/A ILE 548.A N GLY 560.A O no hydrogen 2.607 N/A LEU 549.A N ALA 374.A O no hydrogen 2.606 N/A VAL 550.A N GLU 558.A O no hydrogen 3.323 N/A ILE 551.A N VAL 376.A O no hydrogen 2.939 N/A LYS 552.A N CYS 555.A O no hydrogen 3.488 N/A CYS 555.A SG ILE 556.A O no hydrogen 3.793 N/A VAL 557.A N VAL 550.A O no hydrogen 3.307 N/A ARG 559.A NH1 SER 364.A O no hydrogen 2.847 N/A ARG 559.A NH2 SER 364.A O no hydrogen 2.757 N/A GLY 560.A N ILE 548.A O no hydrogen 3.237 N/A ARG 561.A NE GLU 563.A OE2 no hydrogen 3.448 N/A HIS 562.A ND1 TYR 572.A OH no hydrogen 2.947 N/A GLU 563.A N GLU 563.A OE1 no hydrogen 2.733 N/A SER 567.A OG GLU 563.A O no hydrogen 3.348 N/A ARG 568.A NH1 ARG 559.A O no hydrogen 3.447 N/A TYR 572.A N GLU 558.A OE2 no hydrogen 2.777 N/A TYR 572.A OH HIS 562.A ND1 no hydrogen 2.947 N/A ASP 574.A N GLY 570.A O no hydrogen 3.420 N/A MET 575.A N VAL 571.A O no hydrogen 3.100 N/A TRP 576.A N TYR 572.A O no hydrogen 2.838 N/A GLN 577.A N ALA 573.A O no hydrogen 2.961 N/A LEU 578.A N ASP 574.A O no hydrogen 3.304 N/A GLN 579.A N TRP 576.A O no hydrogen 3.281 N/A GLN 580.A N TRP 576.A O no hydrogen 3.363 N/A