Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6hcf_k1.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N LEU 72.A O no hydrogen 2.735 N/A THR 3.A OG1 LEU 72.A O no hydrogen 3.453 N/A ILE 7.A N SER 68.A O no hydrogen 3.184 N/A ASN 9.A N ALA 66.A O no hydrogen 3.137 N/A LYS 17.A N LYS 14.A O no hydrogen 3.324 N/A CYS 18.A SG ARG 19.A O no hydrogen 3.205 N/A LYS 23.A NZ VAL 38.A O no hydrogen 2.401 N/A SER 25.A N CYS 22.A O no hydrogen 3.283 N/A ARG 30.A N CYS 26.A O no hydrogen 3.025 N/A MET 31.A N VAL 28.A O no hydrogen 3.269 N/A GLY 32.A N VAL 28.A O no hydrogen 3.360 N/A LYS 33.A N VAL 28.A O no hydrogen 3.315 N/A GLU 37.A N TRP 46.A O no hydrogen 3.168 N/A THR 39.A OG1 SER 42.A OG no hydrogen 2.629 N/A GLN 41.A N THR 39.A OG1 no hydrogen 3.377 N/A SER 42.A N THR 39.A O no hydrogen 3.477 N/A SER 42.A OG THR 39.A OG1 no hydrogen 2.629 N/A SER 48.A N CYS 35.A O no hydrogen 2.967 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.678 N/A GLY 65.A N CYS 62.A O no hydrogen 3.259 N/A SER 68.A N ILE 7.A O no hydrogen 3.275 N/A VAL 70.A N ILE 5.A O no hydrogen 3.395 N/A SER 74.A OG SER 74.A O no hydrogen 2.484 N/A GLU 79.A N LEU 76.A O no hydrogen 3.381 N/A THR 80.A OG1 LEU 128.A O no hydrogen 2.852 N/A THR 81.A N LEU 91.A O no hydrogen 3.260 N/A ARG 83.A N ASN 127.A OD1 no hydrogen 3.315 N/A ASN 87.A ND2 ILE 47.A O no hydrogen 3.349 N/A LEU 91.A N HIS 82.A O no hydrogen 3.107 N/A HIS 92.A ND1 GLU 79.A O no hydrogen 2.938 N/A GLY 100.A N ARG 264.A O no hydrogen 3.441 N/A GLU 101.A N ARG 98.A O no hydrogen 3.466 N/A LEU 103.A N ILE 266.A O no hydrogen 2.929 N/A GLY 104.A N PHE 282.A O no hydrogen 2.679 N/A LEU 105.A N VAL 268.A O no hydrogen 3.216 N/A ASN 109.A N ASP 473.A OD2 no hydrogen 2.829 N/A ALA 116.A N GLY 112.A O no hydrogen 3.374 N/A LYS 118.A N SER 114.A O no hydrogen 3.213 N/A LYS 118.A N THR 115.A O no hydrogen 3.075 N/A ILE 119.A N THR 115.A O no hydrogen 3.275 N/A GLY 122.A N ILE 119.A O no hydrogen 2.759 N/A GLN 124.A NE2 LYS 125.A O no hydrogen 3.596 N/A LYS 125.A NZ PRO 135.A O no hydrogen 2.756 N/A ASN 127.A ND2 ARG 83.A O no hydrogen 3.057 N/A LEU 128.A N THR 81.A O no hydrogen 3.025 N/A LYS 130.A N ASN 127.A O no hydrogen 2.858 N/A ILE 140.A N TRP 137.A O no hydrogen 3.306 N/A LEU 141.A N TRP 137.A O no hydrogen 3.074 N/A THR 142.A N GLN 138.A O no hydrogen 3.047 N/A THR 142.A OG1 GLN 138.A O no hydrogen 3.521 N/A THR 142.A OG1 GLU 139.A O no hydrogen 3.275 N/A TYR 143.A N ILE 140.A O no hydrogen 2.928 N/A TYR 152.A N LEU 149.A O no hydrogen 2.841 N/A TYR 152.A OH LEU 120.A O no hydrogen 2.674 N/A PHE 153.A N LEU 149.A O no hydrogen 2.739 N/A THR 154.A N GLN 150.A O no hydrogen 3.454 N/A THR 154.A OG1 GLN 150.A O no hydrogen 2.583 N/A LEU 157.A N PHE 153.A O no hydrogen 2.679 N/A GLU 158.A N THR 154.A O no hydrogen 3.121 N/A ASP 159.A N LYS 155.A O no hydrogen 2.812 N/A ILE 164.A N ILE 234.A O no hydrogen 3.516 N/A LYS 166.A N MET 236.A O no hydrogen 3.199 N/A LYS 166.A NZ PRO 167.A O no hydrogen 3.482 N/A LYS 166.A NZ GLN 220.A OE1 no hydrogen 2.936 N/A LYS 166.A NZ ASP 238.A O no hydrogen 3.434 N/A LYS 166.A NZ GLU 239.A O no hydrogen 2.802 N/A ALA 177.A N PRO 174.A O no hydrogen 3.135 N/A THR 180.A N SER 183.A OG no hydrogen 3.267 N/A THR 180.A OG1 SER 183.A OG no hydrogen 3.076 N/A SER 183.A OG THR 180.A O no hydrogen 2.917 N/A SER 183.A OG THR 180.A OG1 no hydrogen 3.076 N/A LEU 185.A N VAL 181.A O no hydrogen 3.009 N/A ARG 187.A N SER 183.A O no hydrogen 3.387 N/A THR 191.A OG1 THR 193.A OG1 no hydrogen 2.316 N/A THR 191.A OG1 ILE 229.A O no hydrogen 3.225 N/A THR 193.A OG1 THR 191.A OG1 no hydrogen 2.316 N/A THR 193.A OG1 THR 193.A O no hydrogen 2.627 N/A GLN 194.A NE2 ASP 189.A OD1 no hydrogen 2.944 N/A CYS 198.A N GLN 194.A O no hydrogen 2.610 N/A CYS 198.A SG GLN 194.A O no hydrogen 3.247 N/A GLN 199.A N ALA 195.A O no hydrogen 3.394 N/A LEU 203.A N CYS 198.A O no hydrogen 2.971 N/A ASN 210.A ND2 GLY 179.A O no hydrogen 2.869 N/A ASP 213.A N ASN 210.A O no hydrogen 3.238 N/A SER 215.A N GLU 218.A OE1 no hydrogen 3.087 N/A SER 215.A OG GLU 218.A OE1 no hydrogen 2.522 N/A GLU 218.A N SER 215.A O no hydrogen 3.101 N/A LEU 219.A N SER 215.A O no hydrogen 2.852 N/A GLN 220.A N GLY 216.A O no hydrogen 3.334 N/A GLN 220.A NE2 GLU 239.A O no hydrogen 3.620 N/A PHE 222.A N GLU 218.A O no hydrogen 2.570 N/A ALA 223.A N LEU 219.A O no hydrogen 2.442 N/A CYS 224.A N GLN 220.A O no hydrogen 3.259 N/A CYS 224.A SG GLN 220.A O no hydrogen 3.646 N/A ALA 225.A N PHE 222.A O no hydrogen 3.033 N/A VAL 226.A N PHE 222.A O no hydrogen 3.117 N/A CYS 228.A SG CYS 224.A O no hydrogen 3.288 N/A PHE 235.A N TYR 265.A O no hydrogen 2.927 N/A MET 236.A N ILE 164.A O no hydrogen 3.133 N/A PHE 237.A N ILE 267.A O no hydrogen 3.104 N/A GLU 239.A N VAL 269.A O no hydrogen 3.368 N/A SER 241.A OG GLU 270.A OE1 no hydrogen 3.396 N/A SER 242.A OG ALA 470.A O no hydrogen 3.335 N/A ASP 245.A N GLN 248.A OE1 no hydrogen 3.232 N/A VAL 246.A N ASP 245.A OD1 no hydrogen 2.529 N/A ARG 249.A N ASP 245.A O no hydrogen 2.835 N/A ARG 249.A N VAL 246.A O no hydrogen 3.287 N/A ARG 249.A NE ASP 245.A O no hydrogen 3.387 N/A ARG 249.A NH2 LEU 244.A O no hydrogen 2.467 N/A LEU 250.A N VAL 246.A O no hydrogen 2.816 N/A LYS 251.A N LYS 247.A O no hydrogen 3.169 N/A ALA 252.A N GLN 248.A O no hydrogen 3.313 N/A ILE 254.A N LEU 250.A O no hydrogen 3.189 N/A THR 255.A OG1 ALA 252.A O no hydrogen 2.384 N/A ILE 256.A N ALA 252.A O no hydrogen 3.387 N/A ARG 257.A N ALA 253.A O no hydrogen 2.933 N/A SER 258.A N THR 255.A O no hydrogen 3.351 N/A SER 258.A OG THR 255.A O no hydrogen 2.365 N/A LEU 259.A N ILE 256.A O no hydrogen 3.481 N/A ILE 267.A N PHE 235.A O no hydrogen 3.103 N/A VAL 268.A N LEU 103.A O no hydrogen 3.330 N/A VAL 269.A N PHE 237.A O no hydrogen 3.035 N/A HIS 271.A NE2 GLU 239.A OE2 no hydrogen 3.105 N/A LEU 273.A N ASP 272.A OD1 no hydrogen 2.669 N/A SER 274.A OG ASP 272.A OD2 no hydrogen 3.317 N/A TYR 278.A N VAL 275.A O no hydrogen 3.106 N/A LEU 279.A N VAL 275.A O no hydrogen 3.095 N/A SER 280.A N LEU 276.A O no hydrogen 2.954 N/A SER 280.A OG LEU 276.A O no hydrogen 3.306 N/A ASP 281.A N VAL 102.A O no hydrogen 3.473 N/A CYS 284.A N GLY 104.A O no hydrogen 3.205 N/A CYS 285.A N THR 297.A OG1 no hydrogen 3.378 N/A CYS 285.A SG GLY 305.A O no hydrogen 3.573 N/A TYR 287.A N VAL 295.A O no hydrogen 3.184 N/A SER 291.A N GLY 110.A O no hydrogen 3.119 N/A SER 291.A OG PRO 290.A O no hydrogen 2.613 N/A ALA 292.A N VAL 289.A O no hydrogen 3.192 N/A TYR 293.A N VAL 289.A O no hydrogen 3.456 N/A VAL 295.A N TYR 287.A O no hydrogen 3.021 N/A THR 297.A OG1 MET 298.A O no hydrogen 3.433 N/A PHE 300.A N ILE 283.A O no hydrogen 3.161 N/A GLY 305.A N SER 301.A O no hydrogen 2.914 N/A ILE 306.A N VAL 302.A O no hydrogen 3.244 N/A ASN 307.A ND2 ARG 303.A O no hydrogen 2.701 N/A ASN 307.A ND2 ASP 549.A OD2 no hydrogen 3.485 N/A ILE 308.A N GLU 304.A O no hydrogen 3.053 N/A PHE 309.A N GLY 305.A O no hydrogen 3.367 N/A LEU 310.A N ILE 306.A O no hydrogen 2.830 N/A ASP 311.A N ILE 308.A O no hydrogen 2.912 N/A GLY 312.A N ILE 308.A O no hydrogen 2.451 N/A VAL 314.A N LEU 319.A O no hydrogen 3.157 N/A THR 316.A OG1 GLU 317.A OE1 no hydrogen 2.388 N/A LEU 319.A N VAL 314.A O no hydrogen 3.511 N/A LEU 326.A N LEU 310.A O no hydrogen 3.322 N/A TYR 332.A N PHE 353.A O no hydrogen 2.669 N/A MET 341.A N PHE 344.A O no hydrogen 3.330 N/A GLU 343.A N GLU 343.A OE1 no hydrogen 3.014 N/A VAL 349.A N ALA 525.A O no hydrogen 2.789 N/A THR 354.A OG1 ASP 355.A O no hydrogen 3.116 N/A SER 356.A OG SER 356.A O no hydrogen 2.483 N/A MET 359.A N ALA 495.A O no hydrogen 3.186 N/A MET 361.A N VAL 497.A O no hydrogen 3.332 N/A LEU 362.A N ILE 513.A O no hydrogen 2.949 N/A GLU 364.A N GLU 364.A OE1 no hydrogen 2.851 N/A ASN 365.A ND2 GLN 248.A OE1 no hydrogen 2.417 N/A THR 367.A N GLU 364.A O no hydrogen 3.414 N/A THR 367.A OG1 GLU 364.A O no hydrogen 2.322 N/A ARG 379.A NH1 VAL 389.A O no hydrogen 3.061 N/A LEU 380.A N ARG 374.A O no hydrogen 3.376 N/A LYS 381.A N ARG 374.A O no hydrogen 3.231 N/A LYS 381.A NZ THR 371.A O no hydrogen 3.357 N/A LYS 381.A NZ THR 371.A OG1 no hydrogen 2.546 N/A SER 390.A OG CYS 455.A O no hydrogen 3.526 N/A LYS 392.A N LEU 464.A O no hydrogen 2.837 N/A LYS 392.A NZ GLN 448.A OE1 no hydrogen 2.571 N/A LYS 392.A NZ ASP 466.A O no hydrogen 3.258 N/A LYS 392.A NZ GLU 467.A O no hydrogen 2.978 N/A LYS 399.A N SER 397.A O no hydrogen 2.829 N/A VAL 404.A N GLN 437.A O no hydrogen 3.412 N/A ARG 405.A N ILE 435.A O no hydrogen 3.266 N/A LEU 407.A N VAL 404.A O no hydrogen 2.850 N/A LEU 408.A N VAL 404.A O no hydrogen 2.938 N/A GLU 410.A N LEU 407.A O no hydrogen 2.961 N/A LYS 411.A N LEU 408.A O no hydrogen 3.375 N/A ILE 412.A N LEU 408.A O no hydrogen 2.885 N/A VAL 422.A N HIS 418.A O no hydrogen 3.112 N/A VAL 425.A N PHE 421.A O no hydrogen 3.286 N/A LYS 427.A N VAL 422.A O no hydrogen 3.087 N/A LEU 429.A N VAL 425.A O no hydrogen 3.129 N/A GLN 437.A N ILE 434.A O no hydrogen 3.060 N/A LEU 442.A N VAL 439.A O no hydrogen 3.248 N/A SER 443.A N GLU 446.A OE1 no hydrogen 3.457 N/A GLY 444.A N TYR 169.A OH no hydrogen 3.132 N/A LEU 447.A N GLY 444.A O no hydrogen 2.946 N/A GLN 448.A N GLY 444.A O no hydrogen 2.963 N/A ALA 451.A N LEU 447.A O no hydrogen 3.124 N/A ALA 453.A N VAL 450.A O no hydrogen 2.888 N/A LEU 454.A N VAL 450.A O no hydrogen 3.089 N/A CYS 455.A SG TYR 391.A O no hydrogen 3.633 N/A CYS 455.A SG ALA 451.A O no hydrogen 3.287 N/A ALA 460.A N TYR 463.A OH no hydrogen 3.314 N/A TYR 463.A OH LYS 458.A O no hydrogen 3.099 N/A LEU 464.A N SER 390.A O no hydrogen 3.447 N/A ILE 465.A N PHE 496.A O no hydrogen 3.281 N/A GLU 467.A N VAL 498.A O no hydrogen 3.121 N/A SER 469.A OG SER 469.A O no hydrogen 2.485 N/A SER 469.A OG ASP 501.A OD2 no hydrogen 3.437 N/A ALA 470.A N PRO 468.A O no hydrogen 2.992 N/A GLN 476.A N ASP 473.A O no hydrogen 3.212 N/A ALA 480.A N GLN 476.A O no hydrogen 2.966 N/A ALA 481.A N ARG 477.A O no hydrogen 3.034 N/A ARG 482.A NE TYR 507.A OH no hydrogen 3.160 N/A VAL 484.A N ALA 481.A O no hydrogen 3.178 N/A LYS 485.A N ALA 481.A O no hydrogen 2.961 N/A ARG 486.A N ARG 482.A O no hydrogen 2.913 N/A PHE 487.A N VAL 484.A O no hydrogen 3.230 N/A ILE 488.A N LYS 485.A O no hydrogen 2.919 N/A LEU 489.A N LYS 485.A O no hydrogen 2.517 N/A HIS 490.A ND1 ARG 486.A O no hydrogen 2.411 N/A ALA 491.A N PHE 487.A O no hydrogen 3.135 N/A THR 494.A N ASP 461.A OD1 no hydrogen 2.635 N/A THR 494.A OG1 ASP 461.A O no hydrogen 2.272 N/A THR 494.A OG1 ASP 461.A OD1 no hydrogen 3.051 N/A PHE 496.A N TYR 463.A O no hydrogen 2.763 N/A VAL 498.A N ILE 465.A O no hydrogen 2.911 N/A ALA 505.A N PHE 502.A O no hydrogen 3.327 N/A TYR 507.A N MET 504.A O no hydrogen 3.280 N/A LEU 508.A N ALA 505.A O no hydrogen 3.375 N/A ARG 511.A NH2 GLU 352.A OE1 no hydrogen 3.424 N/A VAL 512.A N GLN 529.A O no hydrogen 2.957 N/A ILE 513.A N VAL 360.A O no hydrogen 2.987 N/A PHE 515.A N LEU 362.A O no hydrogen 3.096 N/A SER 520.A OG PRO 519.A O no hydrogen 2.598 N/A LYS 521.A N VAL 518.A O no hydrogen 3.177 N/A THR 523.A N GLU 345.A O no hydrogen 2.907 N/A THR 523.A OG1 GLU 345.A O no hydrogen 2.379 N/A VAL 524.A N ASP 516.A O no hydrogen 2.486 N/A ALA 525.A N ALA 347.A O no hydrogen 2.851 N/A ASN 526.A N VAL 514.A O no hydrogen 2.797 N/A GLN 529.A N VAL 512.A O no hydrogen 3.236 N/A GLN 529.A NE2 SER 527.A OG no hydrogen 3.302 N/A GLY 534.A N THR 530.A O no hydrogen 3.226 N/A LYS 537.A N GLY 534.A O no hydrogen 3.173 N/A PHE 538.A N MET 535.A O no hydrogen 3.282 N/A LEU 539.A N MET 535.A O no hydrogen 3.283 N/A SER 540.A OG ASN 536.A O no hydrogen 3.538 N/A LEU 542.A N LEU 539.A O no hydrogen 2.893 N/A GLU 543.A N LEU 539.A O no hydrogen 2.458 N/A THR 545.A OG1 ASP 565.A OD1 no hydrogen 2.351 N/A ARG 547.A NE ASN 558.A OD1 no hydrogen 3.043 N/A TYR 553.A N ASP 549.A O no hydrogen 2.949 N/A ARG 554.A NE ASN 307.A OD1 no hydrogen 3.404 N/A ARG 556.A N ARG 547.A O no hydrogen 3.265 N/A ARG 556.A NE ASP 277.A OD2 no hydrogen 2.492 N/A ARG 556.A NH2 ASP 277.A OD1 no hydrogen 3.477 N/A ASN 558.A N THR 545.A O no hydrogen 3.287 N/A ASN 558.A ND2 THR 545.A OG1 no hydrogen 3.186 N/A ASP 565.A N SER 562.A OG no hydrogen 3.132 N/A VAL 566.A N SER 562.A O no hydrogen 3.093 N/A GLU 567.A N ILE 563.A O no hydrogen 3.442 N/A GLN 568.A NE2 PHE 546.A O no hydrogen 3.125 N/A SER 571.A OG GLN 568.A O no hydrogen 3.428 N/A GLY 572.A N GLN 568.A O no hydrogen 2.949 N/A