Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6knb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG SER 5.A O no hydrogen 2.666 N/A VAL 8.A N ASP 6.A O no hydrogen 2.809 N/A PHE 15.A N LYS 12.A O no hydrogen 3.408 N/A TYR 17.A OH GLU 13.A OE1 no hydrogen 3.416 N/A TYR 17.A OH GLU 13.A OE2 no hydrogen 2.991 N/A ARG 18.A NH1 GLU 179.A OE2 no hydrogen 2.754 N/A LYS 20.A NZ GLU 21.A O no hydrogen 2.411 N/A ASP 24.A N ASP 24.A OD1 no hydrogen 2.380 N/A LEU 28.A N VAL 313.A O no hydrogen 2.865 N/A VAL 32.A N ALA 29.A O no hydrogen 3.151 N/A LYS 33.A N ALA 29.A O no hydrogen 2.835 N/A ASN 34.A N PHE 30.A O no hydrogen 3.201 N/A VAL 35.A N PHE 30.A O no hydrogen 3.237 N/A LYS 36.A NZ LYS 33.A O no hydrogen 2.393 N/A VAL 42.A N ASN 44.A OD1 no hydrogen 2.906 N/A LYS 43.A NZ ALA 45.A O no hydrogen 2.681 N/A LYS 43.A NZ GLN 55.A OE1 no hydrogen 3.561 N/A ASN 44.A ND2 PRO 40.A O no hydrogen 3.134 N/A GLN 46.A NE2 GLN 55.A OE1 no hydrogen 3.486 N/A LYS 48.A N SER 47.A OG no hydrogen 2.680 N/A GLN 55.A NE2 GLU 51.A O no hydrogen 2.442 N/A ALA 56.A N VAL 52.A O no hydrogen 2.921 N/A TYR 57.A N ILE 53.A O no hydrogen 2.880 N/A SER 58.A N ILE 54.A O no hydrogen 2.918 N/A SER 59.A N GLN 55.A O no hydrogen 2.910 N/A SER 59.A OG GLN 55.A O no hydrogen 3.189 N/A SER 59.A OG ALA 56.A O no hydrogen 2.682 N/A TYR 60.A N ALA 56.A O no hydrogen 2.892 N/A TYR 60.A OH ASP 373.A OD1 no hydrogen 3.247 N/A PHE 61.A N TYR 57.A O no hydrogen 2.924 N/A LYS 62.A N SER 58.A O no hydrogen 2.906 N/A LYS 62.A NZ SER 58.A OG no hydrogen 3.012 N/A SER 63.A N SER 59.A O no hydrogen 2.899 N/A SER 63.A OG SER 59.A O no hydrogen 3.050 N/A SER 63.A OG TYR 60.A O no hydrogen 2.732 N/A SER 63.A OG PRO 371.A O no hydrogen 2.645 N/A ARG 64.A N TYR 60.A O no hydrogen 2.916 N/A ARG 64.A NE TYR 60.A OH no hydrogen 3.312 N/A ARG 64.A NH2 TYR 60.A OH no hydrogen 2.909 N/A LEU 65.A N PHE 61.A O no hydrogen 2.915 N/A LYS 66.A N LYS 62.A O no hydrogen 2.896 N/A LYS 67.A N SER 63.A O no hydrogen 2.912 N/A MET 68.A N ARG 64.A O no hydrogen 2.923 N/A ARG 69.A N LEU 65.A O no hydrogen 2.895 N/A ARG 70.A N LYS 66.A O no hydrogen 2.896 N/A ILE 71.A N LYS 67.A O no hydrogen 2.920 N/A PHE 72.A N MET 68.A O no hydrogen 2.918 N/A ARG 73.A N ARG 69.A O no hydrogen 2.885 N/A GLU 74.A N ARG 70.A O no hydrogen 2.887 N/A ASN 75.A N ILE 71.A O no hydrogen 2.933 N/A THR 80.A OG1 GLY 79.A O no hydrogen 2.557 N/A LYS 86.A NZ ASP 83.A OD2 no hydrogen 3.135 N/A LEU 87.A N ILE 84.A O no hydrogen 2.902 N/A SER 88.A N ALA 85.A O no hydrogen 2.935 N/A TYR 89.A N LYS 86.A O no hydrogen 2.892 N/A VAL 90.A N LYS 86.A O no hydrogen 2.970 N/A VAL 95.A N GLY 150.A O no hydrogen 3.000 N/A THR 96.A OG1 PHE 148.A O no hydrogen 3.477 N/A ILE 97.A N PHE 148.A O no hydrogen 2.910 N/A GLY 99.A N VAL 146.A O no hydrogen 2.954 N/A ASN 102.A N GLU 114.A O no hydrogen 2.560 N/A GLU 103.A N GLU 114.A O no hydrogen 2.889 N/A ARG 105.A N LEU 112.A O no hydrogen 2.892 N/A ARG 105.A NH1 GLU 114.A OE1 no hydrogen 3.353 N/A THR 107.A OG1 GLY 110.A O no hydrogen 3.400 N/A TYR 111.A N ILE 126.A O no hydrogen 2.974 N/A LEU 112.A N ARG 105.A O no hydrogen 2.910 N/A PHE 113.A N VAL 124.A O no hydrogen 2.978 N/A GLU 114.A N GLU 103.A O no hydrogen 2.928 N/A GLU 116.A N VAL 101.A O no hydrogen 2.978 N/A ALA 118.A N ASP 117.A OD1 no hydrogen 2.724 N/A ILE 122.A N ILE 115.A O no hydrogen 2.988 N/A PHE 125.A N ALA 159.A O no hydrogen 3.042 N/A ILE 126.A N TYR 111.A O no hydrogen 2.913 N/A ASP 129.A N ASP 129.A OD1 no hydrogen 2.640 N/A GLU 135.A N ASN 134.A OD1 no hydrogen 3.049 N/A ALA 136.A N GLY 132.A O no hydrogen 2.910 N/A TYR 137.A N ALA 133.A O no hydrogen 2.923 N/A SER 138.A N ASN 134.A O no hydrogen 2.885 N/A SER 138.A N GLU 135.A O no hydrogen 3.139 N/A SER 138.A OG ASN 134.A O no hydrogen 2.868 N/A SER 138.A OG GLU 135.A O no hydrogen 2.863 N/A SER 138.A OG GLU 350.A OE2 no hydrogen 2.717 N/A THR 139.A N GLU 135.A O no hydrogen 2.933 N/A THR 139.A OG1 GLU 135.A O no hydrogen 3.471 N/A THR 139.A OG1 ALA 136.A O no hydrogen 2.704 N/A SER 144.A OG ILE 140.A O no hydrogen 3.021 N/A SER 144.A OG ASP 143.A O no hydrogen 2.797 N/A VAL 146.A N GLY 99.A O no hydrogen 2.928 N/A ALA 147.A N PHE 163.A O no hydrogen 3.047 N/A PHE 148.A N ILE 97.A O no hydrogen 2.889 N/A ARG 149.A N ARG 161.A O no hydrogen 3.146 N/A GLY 150.A N VAL 95.A O no hydrogen 2.885 N/A THR 151.A OG1 PHE 158.A O no hydrogen 2.994 N/A THR 151.A OG1 ALA 159.A O no hydrogen 3.395 N/A PHE 157.A N ARG 121.A O no hydrogen 3.007 N/A ALA 159.A N LYS 123.A O no hydrogen 3.053 N/A ASP 166.A N LEU 164.A O no hydrogen 3.103 N/A LYS 171.A NZ ARG 172.A O no hydrogen 2.626 N/A SER 173.A OG LYS 174.A O no hydrogen 3.286 N/A LYS 174.A NZ GLY 318.A O no hydrogen 2.425 N/A LYS 174.A NZ ASP 320.A OD2 no hydrogen 3.188 N/A LYS 174.A NZ ASP 382.A OD2 no hydrogen 2.443 N/A LYS 180.A NZ GLU 433.A OE1 no hydrogen 2.695 N/A TYR 182.A N TYR 226.A O no hydrogen 2.922 N/A ALA 183.A N ILE 430.A O no hydrogen 2.923 N/A ILE 184.A N ILE 228.A O no hydrogen 2.883 N/A LEU 185.A N PRO 428.A O no hydrogen 2.912 N/A SER 187.A OG ASP 188.A OD2 no hydrogen 3.454 N/A ILE 189.A N ASP 232.A O no hydrogen 2.469 N/A HIS 190.A N ASP 232.A O no hydrogen 3.446 N/A VAL 191.A N VAL 233.A O no hydrogen 2.612 N/A ASN 194.A N GLU 246.A O no hydrogen 3.349 N/A LYS 195.A N SER 193.A OG no hydrogen 3.176 N/A LYS 195.A NZ ASN 194.A OD1 no hydrogen 3.219 N/A LYS 195.A NZ GLU 246.A OE2 no hydrogen 3.274 N/A PHE 196.A N SER 193.A O no hydrogen 3.412 N/A CYS 197.A SG TRP 408.A O no hydrogen 3.452 N/A PHE 201.A N CYS 197.A O no hydrogen 3.155 N/A ILE 202.A N GLU 198.A O no hydrogen 2.914 N/A LYS 203.A N GLU 199.A O no hydrogen 2.918 N/A LYS 203.A NZ GLU 206.A OE1 no hydrogen 2.798 N/A PHE 204.A N ALA 200.A O no hydrogen 2.899 N/A LEU 205.A N PHE 201.A O no hydrogen 2.894 N/A GLU 206.A N ILE 202.A O no hydrogen 2.907 N/A TRP 207.A N LYS 203.A O no hydrogen 2.900 N/A LEU 208.A N PHE 204.A O no hydrogen 2.890 N/A ASN 209.A N LEU 205.A O no hydrogen 2.910 N/A GLY 210.A N TRP 207.A O no hydrogen 3.292 N/A GLU 211.A N GLU 206.A O no hydrogen 3.433 N/A SER 214.A OG THR 216.A OG1 no hydrogen 2.913 N/A THR 216.A N SER 214.A OG no hydrogen 3.238 N/A THR 216.A OG1 SER 214.A OG no hydrogen 2.913 N/A GLU 218.A N SER 214.A O no hydrogen 2.906 N/A GLU 219.A N ARG 215.A O no hydrogen 2.900 N/A LEU 220.A N THR 216.A O no hydrogen 2.897 N/A VAL 221.A N GLU 217.A O no hydrogen 2.902 N/A ARG 223.A NE GLU 179.A OE2 no hydrogen 2.794 N/A LYS 225.A NZ ARG 18.A O no hydrogen 3.434 N/A LYS 225.A NZ ILE 224.A O no hydrogen 3.140 N/A TYR 226.A OH PRO 23.A O no hydrogen 2.536 N/A TYR 226.A OH HIS 317.A NE2 no hydrogen 3.259 N/A ILE 227.A N THR 271.A O no hydrogen 2.901 N/A ILE 228.A N TYR 182.A O no hydrogen 2.965 N/A ILE 229.A N PHE 273.A O no hydrogen 2.925 N/A GLY 230.A N LEU 186.A O no hydrogen 3.348 N/A GLY 231.A N LEU 186.A O no hydrogen 3.492 N/A TYR 240.A OH GLU 246.A OE1 no hydrogen 2.975 N/A GLN 243.A N TYR 240.A O no hydrogen 2.901 N/A GLN 243.A NE2 ASP 235.A OD2 no hydrogen 3.212 N/A GLN 243.A NE2 GLY 236.A O no hydrogen 2.426 N/A TYR 244.A N PRO 241.A O no hydrogen 2.926 N/A GLU 246.A N GLY 242.A O no hydrogen 3.243 N/A LEU 247.A N GLN 243.A O no hydrogen 3.077 N/A ALA 248.A N GLY 192.A O no hydrogen 3.246 N/A ASP 254.A N ASP 251.A OD2 no hydrogen 3.001 N/A GLN 255.A NE2 ILE 249.A O no hydrogen 3.414 N/A TYR 256.A N ILE 252.A O no hydrogen 2.922 N/A GLU 257.A N PHE 253.A O no hydrogen 2.908 N/A ALA 258.A N ASP 254.A O no hydrogen 2.880 N/A LEU 259.A N GLN 255.A O no hydrogen 2.906 N/A ALA 260.A N TYR 256.A O no hydrogen 2.925 N/A ASN 261.A N GLU 257.A O no hydrogen 2.895 N/A LEU 262.A N ALA 258.A O no hydrogen 2.896 N/A LEU 263.A N LEU 259.A O no hydrogen 2.913 N/A LYS 264.A NZ ASN 261.A OD1 no hydrogen 3.491 N/A THR 271.A N LYS 225.A O no hydrogen 2.897 N/A THR 271.A OG1 LYS 225.A O no hydrogen 3.483 N/A PHE 273.A N ILE 227.A O no hydrogen 2.893 N/A ILE 274.A N VAL 306.A O no hydrogen 2.914 N/A LEU 286.A N PRO 366.A O no hydrogen 3.223 N/A GLN 288.A NE2 GLY 290.A O no hydrogen 2.314 N/A LYS 297.A N GLU 294.A O no hydrogen 3.518 N/A TYR 300.A N ALA 296.A O no hydrogen 2.893 N/A LYS 301.A N LYS 297.A O no hydrogen 2.897 N/A LEU 302.A N PRO 298.A O no hydrogen 2.913 N/A LYS 303.A NZ LYS 301.A O no hydrogen 2.426 N/A VAL 306.A N MET 272.A O no hydrogen 2.898 N/A ILE 308.A N ILE 274.A O no hydrogen 2.629 N/A SER 309.A OG GLN 288.A O no hydrogen 2.748 N/A SER 309.A OG PRO 289.A O no hydrogen 3.479 N/A ASN 310.A ND2 PRO 276.A O no hydrogen 2.373 N/A ALA 312.A N VAL 323.A O no hydrogen 2.914 N/A ILE 314.A N PHE 321.A O no hydrogen 2.881 N/A LEU 316.A N ARG 319.A O no hydrogen 2.896 N/A HIS 317.A N GLU 25.A OE2 no hydrogen 3.284 N/A HIS 317.A NE2 TYR 226.A OH no hydrogen 3.259 N/A ARG 319.A N LEU 316.A O no hydrogen 2.908 N/A ARG 319.A NE VAL 432.A O no hydrogen 3.057 N/A ARG 319.A NE GLU 433.A O no hydrogen 3.236 N/A ARG 319.A NH1 PRO 175.A O no hydrogen 2.825 N/A ARG 319.A NH1 HIS 317.A O no hydrogen 2.363 N/A ARG 319.A NH2 PRO 175.A O no hydrogen 2.764 N/A ARG 319.A NH2 GLU 433.A O no hydrogen 2.369 N/A ASP 320.A N ASP 382.A OD2 no hydrogen 2.901 N/A PHE 321.A N ILE 314.A O no hydrogen 2.914 N/A LEU 322.A N LEU 383.A O no hydrogen 2.924 N/A VAL 323.A N ALA 312.A O no hydrogen 2.902 N/A GLU 330.A N ARG 327.A O no hydrogen 3.392 N/A VAL 332.A N GLY 328.A O no hydrogen 2.913 N/A VAL 333.A N ILE 329.A O no hydrogen 2.891 N/A ASP 334.A N GLU 330.A O no hydrogen 2.913 N/A PHE 335.A N ASP 331.A O no hydrogen 2.875 N/A PHE 335.A N VAL 332.A O no hydrogen 3.026 N/A VAL 336.A N VAL 332.A O no hydrogen 2.935 N/A ARG 339.A NH1 ASN 338.A O no hydrogen 3.027 N/A HIS 342.A N SER 340.A OG no hydrogen 3.012 N/A ARG 343.A N SER 340.A O no hydrogen 3.076 N/A ALA 347.A N ARG 343.A O no hydrogen 2.970 N/A MET 348.A N PRO 344.A O no hydrogen 2.842 N/A VAL 349.A N ALA 345.A O no hydrogen 2.905 N/A GLU 350.A N GLU 346.A O no hydrogen 2.920 N/A LEU 351.A N ALA 347.A O no hydrogen 2.939 N/A LEU 352.A N MET 348.A O no hydrogen 2.856 N/A LYS 353.A N VAL 349.A O no hydrogen 2.935 N/A LYS 353.A NZ GLU 135.A O no hydrogen 3.470 N/A LYS 353.A NZ GLU 135.A OE1 no hydrogen 2.908 N/A LYS 353.A NZ GLU 350.A OE2 no hydrogen 3.358 N/A ARG 355.A N LEU 352.A O no hydrogen 3.219 N/A PHE 361.A N ASP 143.A OD2 no hydrogen 3.211 N/A ASN 363.A ND2 THR 360.A O no hydrogen 3.193 N/A ASN 363.A ND2 THR 360.A OG1 no hydrogen 2.985 N/A GLU 372.A N ASP 370.A OD1 no hydrogen 3.120 N/A SER 379.A OG GLU 378.A OE2 no hydrogen 3.548 N/A ASP 382.A N ASP 320.A O no hydrogen 2.406 N/A PHE 384.A N PHE 401.A O no hydrogen 2.929 N/A HIS 388.A N ASP 188.A OD2 no hydrogen 2.555 N/A HIS 388.A ND1 ASP 188.A OD1 no hydrogen 2.586 N/A TYR 394.A OH THR 396.A OG1 no hydrogen 2.859 N/A THR 396.A OG1 TYR 394.A OH no hydrogen 2.859 N/A TYR 397.A N VAL 400.A O no hydrogen 2.902 N/A VAL 400.A N TYR 397.A O no hydrogen 2.897 N/A VAL 402.A N LYS 395.A O no hydrogen 2.908 N/A ASN 404.A N GLN 393.A O no hydrogen 3.290 N/A ASN 404.A ND2 VAL 391.A O no hydrogen 2.390 N/A THR 405.A OG1 LEU 185.A O no hydrogen 2.731 N/A THR 407.A N THR 423.A O no hydrogen 3.310 N/A TRP 408.A NE1 ARG 426.A O no hydrogen 2.729 N/A ALA 410.A N LYS 195.A O no hydrogen 2.954 N/A GLN 415.A N THR 412.A OG1 no hydrogen 3.348 N/A LYS 416.A N THR 412.A O no hydrogen 2.909 N/A LYS 416.A NZ GLN 411.A O no hydrogen 2.425 N/A MET 417.A N GLU 413.A O no hydrogen 2.887 N/A VAL 418.A N PHE 414.A O no hydrogen 2.916 N/A ILE 420.A N GLN 415.A O no hydrogen 3.257 N/A THR 423.A N HIS 390.A O no hydrogen 3.089 N/A THR 423.A OG1 HIS 390.A O no hydrogen 3.099 N/A THR 423.A OG1 THR 423.A O no hydrogen 2.470 N/A ARG 426.A NH1 PRO 424.A O no hydrogen 3.294 N/A VAL 427.A N VAL 441.A O no hydrogen 2.904 N/A ILE 429.A N ALA 439.A O no hydrogen 2.936 N/A ILE 430.A N ALA 183.A O no hydrogen 2.899 N/A GLU 433.A N ASP 431.A OD1 no hydrogen 3.176 N/A GLU 433.A N ASP 431.A OD2 no hydrogen 3.347 N/A ARG 436.A NH1 ALA 435.A O no hydrogen 2.874 N/A ARG 438.A N ILE 429.A O no hydrogen 3.083 N/A ALA 439.A N ILE 429.A O no hydrogen 2.893 N/A VAL 441.A N VAL 427.A O no hydrogen 2.891 N/A ARG 442.A NH2 ASP 444.A OD2 no hydrogen 3.210 N/A GLN 445.A N GLN 445.A OE1 no hydrogen 2.904 N/A PHE 446.A N PHE 443.A O no hydrogen 2.913 N/A CYS 447.A N ASP 444.A O no hydrogen 2.920 N/A CYS 447.A SG GLU 199.A OE2 no hydrogen 3.665 N/A GLU 448.A N GLU 448.A OE1 no hydrogen 2.925 N/A