Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ikw_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLU 118.A OE2 no hydrogen 3.002 N/A LYS 9.A N ARG 79.A O no hydrogen 3.173 N/A LYS 9.A NZ GLN 81.A OE1 no hydrogen 3.457 N/A MET 12.A N LYS 9.A O no hydrogen 2.970 N/A VAL 17.A N ASN 53.A O no hydrogen 3.175 N/A GLN 19.A NE2 TRP 20.A O no hydrogen 3.302 N/A GLN 19.A NE2 VAL 56.A O no hydrogen 2.738 N/A LYS 26.A N THR 23.A O no hydrogen 3.040 N/A LYS 26.A NZ GLU 382.A OE1 no hydrogen 3.295 N/A ILE 27.A N THR 23.A O no hydrogen 3.178 N/A LYS 28.A N GLU 24.A O no hydrogen 2.953 N/A ALA 29.A N GLU 25.A O no hydrogen 3.098 N/A LEU 30.A N LYS 26.A O no hydrogen 2.810 N/A VAL 31.A N ILE 27.A O no hydrogen 2.897 N/A GLU 32.A N LYS 28.A O no hydrogen 3.259 N/A ILE 33.A N ALA 29.A O no hydrogen 3.216 N/A CYS 34.A N LEU 30.A O no hydrogen 2.783 N/A THR 35.A N VAL 31.A O no hydrogen 2.921 N/A THR 35.A OG1 VAL 31.A O no hydrogen 3.022 N/A GLU 36.A N GLU 32.A O no hydrogen 3.062 N/A MET 37.A N ILE 33.A O no hydrogen 2.895 N/A GLU 38.A N CYS 34.A O no hydrogen 3.186 N/A LYS 39.A N THR 35.A O no hydrogen 3.437 N/A GLU 40.A N GLU 36.A O no hydrogen 3.298 N/A GLY 41.A N GLU 38.A O no hydrogen 2.652 N/A LYS 42.A N MET 37.A O no hydrogen 2.846 N/A LYS 42.A NZ GLU 40.A OE1 no hydrogen 3.320 N/A SER 44.A N GLN 141.A O no hydrogen 3.140 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.505 N/A ASN 50.A N GLY 47.A O no hydrogen 3.032 N/A ASN 50.A ND2 LYS 122.A O no hydrogen 3.300 N/A TYR 52.A N ASN 50.A OD1 no hydrogen 2.974 N/A TYR 52.A OH ASP 13.A OD1 no hydrogen 2.742 N/A ASN 53.A N PRO 15.A O no hydrogen 2.916 N/A ASN 53.A ND2 VAL 17.A O no hydrogen 2.614 N/A THR 54.A N ALA 125.A O no hydrogen 2.849 N/A VAL 56.A N GLN 19.A OE1 no hydrogen 2.667 N/A PHE 57.A N LEU 70.A O no hydrogen 2.860 N/A ILE 59.A N ARG 68.A O no hydrogen 3.086 N/A LYS 60.A NZ THR 65.A O no hydrogen 2.538 N/A LYS 61.A N LYS 66.A O no hydrogen 3.383 N/A LYS 62.A NZ GLY 214.A O no hydrogen 2.671 N/A ARG 68.A N ILE 59.A O no hydrogen 2.873 N/A ARG 68.A NH1 ASP 106.A OD2 no hydrogen 3.403 N/A ARG 68.A NH2 ASP 106.A OD2 no hydrogen 3.470 N/A ARG 68.A NH2 GLN 147.A OE1 no hydrogen 2.665 N/A LYS 69.A NZ TYR 142.A OH no hydrogen 2.725 N/A LEU 70.A N PHE 57.A O no hydrogen 2.800 N/A ASP 72.A N PRO 55.A O no hydrogen 2.945 N/A PHE 73.A N VAL 71.A O no hydrogen 3.010 N/A ARG 74.A N ASP 72.A OD1 no hydrogen 3.113 N/A ARG 74.A NE ASP 72.A OD1 no hydrogen 2.596 N/A ARG 74.A NE ASP 72.A OD2 no hydrogen 3.227 N/A ARG 74.A NH1 PRO 390.A O no hydrogen 2.876 N/A ARG 74.A NH2 ASP 72.A OD2 no hydrogen 2.753 N/A ASN 77.A N PHE 73.A O no hydrogen 2.924 N/A ASN 77.A ND2 GLY 148.A O no hydrogen 3.577 N/A LYS 78.A N GLU 75.A O no hydrogen 2.664 N/A LYS 78.A NZ GLU 75.A OE1 no hydrogen 3.243 N/A LYS 78.A NZ GLU 75.A OE2 no hydrogen 3.139 N/A ARG 79.A N GLU 75.A O no hydrogen 3.028 N/A THR 80.A N ASN 77.A O no hydrogen 3.247 N/A THR 80.A OG1 LEU 76.A O no hydrogen 2.927 N/A PHE 83.A N THR 80.A O no hydrogen 2.614 N/A TRP 84.A NE1 ASN 77.A O no hydrogen 2.826 N/A GLU 85.A N GLN 81.A O no hydrogen 2.957 N/A VAL 86.A N ASP 82.A O no hydrogen 3.398 N/A GLN 87.A N ASP 82.A O no hydrogen 3.239 N/A LEU 88.A N PHE 83.A O no hydrogen 2.927 N/A HIS 92.A NE2 VAL 359.A O no hydrogen 3.082 N/A LEU 96.A N PRO 93.A O no hydrogen 3.324 N/A LYS 97.A NZ ALA 94.A O no hydrogen 3.244 N/A LYS 98.A N GLY 95.A O no hydrogen 2.912 N/A LYS 98.A NZ ALA 94.A O no hydrogen 3.476 N/A LYS 99.A N LEU 96.A O no hydrogen 3.056 N/A LYS 99.A NZ ASP 188.A OD2 no hydrogen 3.191 N/A LYS 100.A N ASP 188.A OD1 no hydrogen 2.920 N/A SER 101.A N SER 187.A O no hydrogen 3.227 N/A SER 101.A OG HIS 218.A ND1 no hydrogen 3.332 N/A VAL 102.A N LEU 217.A O no hydrogen 2.680 N/A THR 103.A N VAL 185.A O no hydrogen 2.739 N/A THR 103.A OG1 HIS 194.A NE2 no hydrogen 3.003 N/A VAL 104.A N TYR 215.A O no hydrogen 3.309 N/A LEU 105.A N LEU 183.A O no hydrogen 2.849 N/A GLY 108.A N ASP 106.A OD1 no hydrogen 3.166 N/A ALA 110.A N VAL 107.A O no hydrogen 3.362 N/A TYR 111.A N GLY 108.A O no hydrogen 2.974 N/A TYR 111.A OH GLN 178.A OE1 no hydrogen 3.221 N/A SER 113.A OG ALA 110.A O no hydrogen 3.537 N/A VAL 114.A N TYR 111.A O no hydrogen 3.073 N/A LEU 116.A N ASN 143.A O no hydrogen 2.586 N/A PHE 120.A N ASP 117.A O no hydrogen 2.682 N/A ARG 121.A N ASP 117.A O no hydrogen 3.250 N/A ARG 121.A NE LEU 116.A O no hydrogen 2.807 N/A ARG 121.A NH1 ASN 143.A OD1 no hydrogen 2.722 N/A ARG 121.A NH2 LEU 116.A O no hydrogen 3.016 N/A LYS 122.A NZ ASP 119.A O no hydrogen 2.708 N/A LYS 122.A NZ TYR 123.A OH no hydrogen 3.367 N/A TYR 123.A N PHE 120.A O no hydrogen 2.918 N/A THR 124.A N ARG 121.A O no hydrogen 2.870 N/A THR 124.A OG1 ARG 121.A O no hydrogen 2.851 N/A ALA 125.A N LYS 122.A O no hydrogen 3.329 N/A PHE 126.A N TYR 140.A O no hydrogen 3.031 N/A THR 127.A OG1 ASN 53.A OD1 no hydrogen 2.688 N/A ILE 128.A N ILE 138.A O no hydrogen 2.837 N/A SER 130.A OG THR 135.A O no hydrogen 2.958 N/A ASN 132.A ND2 GLU 134.A OE2 no hydrogen 2.973 N/A ASN 133.A N SER 130.A O no hydrogen 3.212 N/A GLU 134.A N ILE 131.A O no hydrogen 3.218 N/A THR 135.A OG1 GLU 134.A O no hydrogen 3.145 N/A ARG 139.A NH1 TYR 52.A O no hydrogen 2.979 N/A ARG 139.A NH1 THR 127.A OG1 no hydrogen 2.796 N/A ARG 139.A NH2 TYR 52.A O no hydrogen 2.775 N/A TYR 140.A N PHE 126.A O no hydrogen 3.132 N/A GLN 141.A N SER 44.A O no hydrogen 3.200 N/A TYR 142.A N THR 124.A OG1 no hydrogen 2.822 N/A ASN 143.A N LYS 42.A O no hydrogen 2.732 N/A ASN 143.A ND2 GLY 41.A O no hydrogen 3.476 N/A ASN 143.A ND2 SER 44.A OG no hydrogen 2.584 N/A LEU 145.A N VAL 114.A O no hydrogen 3.262 N/A GLN 147.A NE2 ASP 109.A OD2 no hydrogen 3.382 N/A LYS 150.A N ASN 77.A OD1 no hydrogen 2.890 N/A SER 152.A N TRP 149.A O no hydrogen 3.002 N/A SER 152.A OG PRO 146.A O no hydrogen 2.461 N/A SER 152.A OG TRP 149.A O no hydrogen 3.518 N/A ILE 155.A N GLY 151.A O no hydrogen 3.208 N/A PHE 156.A N SER 152.A O no hydrogen 3.044 N/A GLN 157.A N ALA 154.A O no hydrogen 3.343 N/A GLN 157.A NE2 LEU 88.A O no hydrogen 3.229 N/A GLN 157.A NE2 GLY 89.A O no hydrogen 3.424 N/A GLN 157.A NE2 ALA 154.A O no hydrogen 3.478 N/A MET 160.A N PHE 156.A O no hydrogen 2.981 N/A THR 161.A N GLN 157.A O no hydrogen 3.299 N/A THR 161.A OG1 GLN 157.A O no hydrogen 2.852 N/A ILE 163.A N SER 159.A O no hydrogen 2.984 N/A LEU 164.A N MET 160.A O no hydrogen 2.927 N/A GLU 165.A N THR 161.A O no hydrogen 2.914 N/A LYS 168.A N LEU 164.A O no hydrogen 2.896 N/A LYS 169.A N GLU 165.A O no hydrogen 2.918 N/A GLN 170.A N PRO 166.A O no hydrogen 3.019 N/A ASN 171.A N LYS 168.A O no hydrogen 3.082 N/A ASN 171.A ND2 PHE 167.A O no hydrogen 3.038 N/A ILE 174.A N ASN 171.A O no hydrogen 3.206 N/A VAL 175.A N GLY 186.A O no hydrogen 2.960 N/A TYR 177.A N TYR 184.A O no hydrogen 2.766 N/A TYR 179.A N ASP 182.A O no hydrogen 2.917 N/A ASP 181.A N TYR 111.A OH no hydrogen 3.315 N/A ASP 182.A N TYR 179.A O no hydrogen 3.245 N/A LEU 183.A N LEU 105.A O no hydrogen 2.782 N/A TYR 184.A N TYR 177.A O no hydrogen 2.561 N/A VAL 185.A N THR 103.A O no hydrogen 2.886 N/A GLY 186.A N VAL 175.A O no hydrogen 2.928 N/A SER 187.A N SER 101.A O no hydrogen 3.082 N/A SER 187.A OG HIS 194.A ND1 no hydrogen 2.631 N/A LEU 189.A N SER 187.A OG no hydrogen 3.389 N/A HIS 194.A N GLU 190.A O no hydrogen 2.870 N/A HIS 194.A ND1 SER 187.A OG no hydrogen 2.631 N/A HIS 194.A NE2 THR 103.A OG1 no hydrogen 3.003 N/A ARG 195.A N ILE 191.A O no hydrogen 2.966 N/A ARG 195.A NE GLU 216.A OE1 no hydrogen 3.135 N/A ARG 195.A NE GLU 216.A OE2 no hydrogen 3.396 N/A ARG 195.A NH2 GLU 216.A OE1 no hydrogen 3.306 N/A THR 196.A N GLY 192.A O no hydrogen 2.912 N/A THR 196.A OG1 GLY 192.A O no hydrogen 2.680 N/A LYS 197.A N GLN 193.A O no hydrogen 2.745 N/A LYS 197.A NZ ASN 171.A OD1 no hydrogen 2.617 N/A LYS 197.A NZ GLU 200.A OE2 no hydrogen 2.867 N/A ILE 198.A N HIS 194.A O no hydrogen 2.952 N/A GLU 199.A N ARG 195.A O no hydrogen 3.312 N/A GLU 200.A N THR 196.A O no hydrogen 3.128 N/A LEU 201.A N LYS 197.A O no hydrogen 3.053 N/A ARG 202.A N ILE 198.A O no hydrogen 2.950 N/A ARG 202.A NE THR 212.A OG1 no hydrogen 2.780 N/A GLN 203.A N GLU 199.A O no hydrogen 3.093 N/A GLN 203.A N GLU 200.A O no hydrogen 3.147 N/A GLN 203.A NE2 GLU 199.A OE2 no hydrogen 2.764 N/A HIS 204.A N GLU 200.A O no hydrogen 3.405 N/A LEU 205.A N LEU 201.A O no hydrogen 2.987 N/A LEU 206.A N ARG 202.A O no hydrogen 2.673 N/A ARG 207.A N GLN 203.A O no hydrogen 3.328 N/A ARG 207.A N HIS 204.A O no hydrogen 2.952 N/A ARG 207.A NH1 GLN 203.A O no hydrogen 3.228 N/A ARG 207.A NH1 GLN 203.A OE1 no hydrogen 2.533 N/A TRP 208.A N LEU 205.A O no hydrogen 2.710 N/A GLY 209.A N LEU 206.A O no hydrogen 3.308 N/A LEU 217.A N VAL 102.A O no hydrogen 2.676 N/A HIS 218.A ND1 LYS 100.A O no hydrogen 2.929 N/A LYS 221.A N HIS 218.A O no hydrogen 3.191 N/A TRP 222.A N PRO 219.A O no hydrogen 2.804 N/A GLN 225.A NE2 PRO 226.A O no hydrogen 3.230 N/A THR 236.A N ASP 239.A OD2 no hydrogen 2.798 N/A VAL 237.A N GLU 274.A O no hydrogen 3.204 N/A ASN 238.A N LEU 272.A O no hydrogen 3.149 N/A ASP 239.A N THR 236.A OG1 no hydrogen 3.132 N/A ILE 240.A N THR 236.A O no hydrogen 2.939 N/A GLN 241.A N VAL 237.A O no hydrogen 2.759 N/A LYS 242.A N ASN 238.A O no hydrogen 2.967 N/A LEU 243.A N ASP 239.A O no hydrogen 3.182 N/A VAL 244.A N ILE 240.A O no hydrogen 3.150 N/A VAL 244.A N GLN 241.A O no hydrogen 3.149 N/A GLY 245.A N GLN 241.A O no hydrogen 3.062 N/A LYS 246.A N LYS 242.A O no hydrogen 2.969 N/A LYS 246.A NZ VAL 228.A O no hydrogen 2.960 N/A LEU 247.A N LEU 243.A O no hydrogen 3.359 N/A ASN 248.A N VAL 244.A O no hydrogen 2.994 N/A TRP 249.A N GLY 245.A O no hydrogen 3.296 N/A ALA 250.A N LYS 246.A O no hydrogen 3.102 N/A SER 251.A N ASN 248.A O no hydrogen 3.100 N/A SER 251.A N TRP 249.A O no hydrogen 2.403 N/A SER 251.A OG LEU 247.A O no hydrogen 3.485 N/A SER 251.A OG ASN 248.A O no hydrogen 2.810 N/A GLN 252.A N TRP 249.A O no hydrogen 2.980 N/A GLN 261.A N GLU 285.A OE2 no hydrogen 3.038 N/A LEU 262.A N GLU 285.A OE1 no hydrogen 2.551 N/A CYS 263.A N VAL 259.A O no hydrogen 3.155 N/A THR 269.A OG1 GLY 268.A O no hydrogen 2.535 N/A ILE 276.A N TRP 235.A O no hydrogen 3.353 N/A GLU 280.A N GLU 280.A OE1 no hydrogen 2.577 N/A GLU 281.A N GLU 280.A OE1 no hydrogen 3.236 N/A GLU 283.A N THR 279.A O no hydrogen 3.335 N/A LEU 284.A N GLU 280.A O no hydrogen 3.379 N/A GLU 285.A N GLU 281.A O no hydrogen 2.589 N/A LEU 286.A N ALA 282.A O no hydrogen 2.668 N/A ALA 287.A N GLU 283.A O no hydrogen 3.068 N/A GLU 288.A N LEU 284.A O no hydrogen 2.707 N/A ASN 289.A N GLU 285.A O no hydrogen 2.587 N/A ARG 290.A N LEU 286.A O no hydrogen 2.739 N/A ARG 290.A NH2 LEU 229.A O no hydrogen 3.478 N/A GLU 291.A N ALA 287.A O no hydrogen 2.655 N/A ILE 292.A N GLU 288.A O no hydrogen 2.950 N/A LEU 293.A N ASN 289.A O no hydrogen 2.929 N/A LYS 294.A N GLU 291.A O no hydrogen 3.375 N/A ASP 303.A N GLN 326.A OE1 no hydrogen 2.759 N/A SER 305.A N ASP 303.A OD1 no hydrogen 3.372 N/A SER 305.A OG ASP 303.A OD1 no hydrogen 2.604 N/A SER 305.A OG ASP 303.A OD2 no hydrogen 2.642 N/A LYS 306.A N ASP 303.A O no hydrogen 2.896 N/A LYS 306.A NZ GLU 327.A OE2 no hydrogen 2.638 N/A ILE 309.A N TYR 325.A O no hydrogen 2.848 N/A ALA 310.A N LYS 366.A O no hydrogen 2.850 N/A GLU 311.A N GLN 323.A O no hydrogen 2.953 N/A GLN 313.A N THR 321.A O no hydrogen 2.825 N/A GLN 313.A NE2 THR 321.A OG1 no hydrogen 2.491 N/A GLN 313.A NE2 GLN 323.A OE1 no hydrogen 2.963 N/A LYS 314.A NZ ASP 342.A OD2 no hydrogen 2.687 N/A GLN 315.A N GLN 319.A O no hydrogen 2.955 N/A GLN 315.A NE2 THR 321.A OG1 no hydrogen 3.037 N/A GLN 315.A NE2 VAL 401.A O no hydrogen 3.628 N/A GLN 319.A N GLY 316.A O no hydrogen 3.229 N/A TRP 320.A N TYR 337.A O no hydrogen 2.767 N/A TRP 320.A NE1 GLN 345.A OE1 no hydrogen 2.685 N/A THR 321.A N GLN 313.A O no hydrogen 3.131 N/A THR 321.A OG1 TRP 404.A O no hydrogen 3.354 N/A TYR 322.A N GLY 335.A O no hydrogen 3.038 N/A GLN 323.A N GLU 311.A O no hydrogen 2.905 N/A GLN 323.A NE2 GLN 313.A OE1 no hydrogen 2.716 N/A ILE 324.A N LYS 333.A O no hydrogen 2.630 N/A TYR 325.A N ILE 309.A O no hydrogen 2.723 N/A TYR 325.A OH GLU 311.A OE1 no hydrogen 2.751 N/A GLN 326.A NE2 ASP 303.A O no hydrogen 2.952 N/A GLN 326.A NE2 LYS 306.A O no hydrogen 2.596 N/A GLN 326.A NE2 ASP 307.A O no hydrogen 3.167 N/A LYS 330.A N GLU 327.A O no hydrogen 2.678 N/A LEU 332.A N ILE 324.A O no hydrogen 2.939 N/A LYS 333.A N ILE 324.A O no hydrogen 3.260 N/A LYS 333.A NZ THR 334.A O no hydrogen 3.345 N/A THR 334.A OG1 GLN 225.A O no hydrogen 2.994 N/A GLY 335.A N TYR 322.A O no hydrogen 2.824 N/A TYR 337.A N TRP 320.A O no hydrogen 2.695 N/A TYR 337.A OH GLU 348.A OE1 no hydrogen 2.773 N/A GLN 345.A N ASN 341.A O no hydrogen 3.011 N/A LEU 346.A N ASP 342.A O no hydrogen 2.941 N/A THR 347.A N VAL 343.A O no hydrogen 2.965 N/A THR 347.A OG1 VAL 343.A O no hydrogen 3.392 N/A THR 347.A OG1 LYS 344.A O no hydrogen 2.697 N/A GLU 348.A N LYS 344.A O no hydrogen 3.274 N/A ALA 349.A N GLN 345.A O no hydrogen 2.841 N/A VAL 350.A N LEU 346.A O no hydrogen 2.970 N/A GLN 351.A N THR 347.A O no hydrogen 3.145 N/A GLN 351.A NE2 THR 347.A O no hydrogen 3.484 N/A LYS 352.A N GLU 348.A O no hydrogen 2.970 N/A LYS 352.A NZ GLU 356.A OE1 no hydrogen 3.562 N/A LYS 352.A NZ GLU 356.A OE2 no hydrogen 3.168 N/A ILE 353.A N ALA 349.A O no hydrogen 2.838 N/A THR 354.A N VAL 350.A O no hydrogen 2.768 N/A THR 354.A OG1 VAL 350.A O no hydrogen 2.609 N/A THR 355.A N GLN 351.A O no hydrogen 2.902 N/A THR 355.A OG1 GLN 351.A O no hydrogen 3.082 N/A GLU 356.A N LYS 352.A O no hydrogen 2.912 N/A SER 357.A N ILE 353.A O no hydrogen 2.781 N/A SER 357.A OG LYS 363.A O no hydrogen 3.230 N/A ILE 358.A N THR 354.A O no hydrogen 2.820 N/A VAL 359.A N THR 355.A O no hydrogen 2.969 N/A ILE 360.A N GLU 356.A O no hydrogen 3.004 N/A TRP 361.A N SER 357.A O no hydrogen 2.808 N/A LYS 363.A NZ TYR 302.A OH no hydrogen 3.516 N/A LYS 363.A NZ PRO 304.A O no hydrogen 3.454 N/A LYS 363.A NZ LYS 306.A O no hydrogen 3.214 N/A LYS 366.A N LEU 308.A O no hydrogen 2.868 N/A LYS 366.A NZ GLU 393.A OE1 no hydrogen 2.986 N/A PHE 367.A N GLU 391.A O no hydrogen 2.707 N/A LYS 368.A N ALA 310.A O no hydrogen 2.896 N/A LYS 368.A NZ GLU 393.A OE2 no hydrogen 2.872 N/A LEU 369.A N GLU 393.A O no hydrogen 2.966 N/A ILE 371.A N LEU 369.A O no hydrogen 2.837 N/A GLN 372.A NE2 GLU 374.A OE1 no hydrogen 3.009 N/A TRP 376.A N GLN 372.A O no hydrogen 3.044 N/A GLU 377.A N LYS 373.A O no hydrogen 2.929 N/A THR 378.A N GLU 374.A O no hydrogen 2.964 N/A THR 378.A OG1 GLU 374.A O no hydrogen 2.757 N/A TRP 379.A N THR 375.A O no hydrogen 3.284 N/A TRP 379.A N TRP 376.A O no hydrogen 3.040 N/A TRP 380.A N TRP 376.A O no hydrogen 2.865 N/A GLU 382.A N TRP 379.A O no hydrogen 2.791 N/A TYR 383.A N TRP 380.A O no hydrogen 3.002 N/A TRP 384.A N TRP 380.A O no hydrogen 3.076 N/A TRP 384.A NE1 TRP 388.A O no hydrogen 3.159 N/A GLN 385.A N GLN 351.A OE1 no hydrogen 2.953 N/A GLN 385.A NE2 LYS 61.A O no hydrogen 3.080 N/A ALA 386.A N GLN 351.A OE1 no hydrogen 3.108 N/A GLU 393.A N PHE 367.A O no hydrogen 2.796 N/A VAL 395.A N LEU 369.A O no hydrogen 3.134 N/A LEU 403.A N LEU 400.A O no hydrogen 3.060 N/A