Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ikx_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 7.A OG1 GLU 122.A OE2 no hydrogen 3.214 N/A LYS 13.A N ARG 83.A O no hydrogen 2.961 N/A VAL 21.A N ASN 57.A O no hydrogen 2.966 N/A GLN 23.A NE2 TRP 24.A O no hydrogen 3.095 N/A GLN 23.A NE2 VAL 60.A O no hydrogen 2.832 N/A LYS 30.A N THR 27.A O no hydrogen 2.995 N/A LYS 30.A NZ THR 27.A OG1 no hydrogen 3.005 N/A LYS 30.A NZ GLU 404.A OE1 no hydrogen 3.175 N/A ILE 31.A N THR 27.A O no hydrogen 3.049 N/A LYS 32.A N GLU 28.A O no hydrogen 2.954 N/A LYS 32.A NZ GLU 28.A OE1 no hydrogen 2.610 N/A ALA 33.A N GLU 29.A O no hydrogen 3.190 N/A LEU 34.A N LYS 30.A O no hydrogen 2.983 N/A VAL 35.A N ILE 31.A O no hydrogen 3.017 N/A GLU 36.A N LYS 32.A O no hydrogen 3.121 N/A ILE 37.A N ALA 33.A O no hydrogen 3.087 N/A CYS 38.A N LEU 34.A O no hydrogen 2.744 N/A THR 39.A N VAL 35.A O no hydrogen 2.761 N/A THR 39.A OG1 VAL 35.A O no hydrogen 2.768 N/A GLU 40.A N GLU 36.A O no hydrogen 2.993 N/A MET 41.A N ILE 37.A O no hydrogen 3.024 N/A GLU 42.A N CYS 38.A O no hydrogen 3.074 N/A LYS 43.A N THR 39.A O no hydrogen 3.187 N/A GLU 44.A N GLU 40.A O no hydrogen 3.042 N/A GLY 45.A N GLU 42.A O no hydrogen 2.832 N/A LYS 46.A N MET 41.A O no hydrogen 2.752 N/A LYS 46.A NZ GLU 44.A OE1 no hydrogen 2.860 N/A SER 48.A N GLN 145.A O no hydrogen 2.972 N/A ILE 50.A N ARG 143.A O no hydrogen 3.399 N/A GLU 53.A N GLU 53.A OE1 no hydrogen 2.540 N/A ASN 54.A N GLY 51.A O no hydrogen 3.268 N/A ASN 54.A ND2 LYS 126.A O no hydrogen 3.042 N/A ASN 54.A ND2 GLN 145.A OE1 no hydrogen 3.419 N/A TYR 56.A N ASN 54.A OD1 no hydrogen 2.853 N/A TYR 56.A OH ASP 17.A OD1 no hydrogen 2.723 N/A TYR 56.A OH ASP 17.A OD2 no hydrogen 2.833 N/A ASN 57.A N PRO 19.A O no hydrogen 2.927 N/A ASN 57.A ND2 VAL 21.A O no hydrogen 2.646 N/A THR 58.A N ALA 129.A O no hydrogen 2.791 N/A VAL 60.A N GLN 23.A OE1 no hydrogen 2.730 N/A PHE 61.A N LEU 74.A O no hydrogen 2.656 N/A ILE 63.A N ARG 72.A O no hydrogen 3.067 N/A ARG 72.A N ILE 63.A O no hydrogen 2.812 N/A ARG 72.A NE LYS 73.A O no hydrogen 3.266 N/A ARG 72.A NH1 ASP 110.A OD2 no hydrogen 3.542 N/A ARG 72.A NH2 GLN 151.A OE1 no hydrogen 2.840 N/A LYS 73.A NZ TYR 146.A OH no hydrogen 2.621 N/A LEU 74.A N PHE 61.A O no hydrogen 2.907 N/A ASP 76.A N PRO 59.A O no hydrogen 2.872 N/A ARG 78.A N ASP 76.A OD1 no hydrogen 3.268 N/A ARG 78.A NE ASP 76.A OD1 no hydrogen 2.848 N/A ARG 78.A NH1 PRO 412.A O no hydrogen 2.780 N/A ARG 78.A NH2 ASP 76.A OD2 no hydrogen 3.157 N/A ASN 81.A N PHE 77.A O no hydrogen 2.789 N/A ASN 81.A ND2 GLY 152.A O no hydrogen 3.405 N/A LYS 82.A N ARG 78.A O no hydrogen 3.183 N/A LYS 82.A N GLU 79.A O no hydrogen 2.833 N/A LYS 82.A NZ GLU 79.A OE2 no hydrogen 3.356 N/A LYS 82.A NZ GLU 413.A OE1 no hydrogen 3.264 N/A LYS 82.A NZ GLU 413.A OE2 no hydrogen 3.452 N/A ARG 83.A N GLU 79.A O no hydrogen 3.098 N/A ARG 83.A N LEU 80.A O no hydrogen 2.998 N/A ARG 83.A NE GLU 79.A OE1 no hydrogen 2.918 N/A ARG 83.A NH1 ASP 17.A O no hydrogen 2.553 N/A TRP 88.A NE1 ASN 81.A O no hydrogen 2.753 N/A GLU 89.A N GLN 85.A O no hydrogen 2.789 N/A VAL 90.A N ASP 86.A O no hydrogen 3.061 N/A GLN 91.A N ASP 86.A O no hydrogen 3.267 N/A LEU 92.A N PHE 87.A O no hydrogen 2.881 N/A GLY 93.A N VAL 90.A O no hydrogen 3.444 N/A HIS 96.A NE2 VAL 381.A O no hydrogen 2.664 N/A LYS 101.A NZ ALA 98.A O no hydrogen 2.954 N/A LYS 102.A N GLY 99.A O no hydrogen 2.818 N/A ASN 103.A N LEU 100.A O no hydrogen 3.186 N/A ASN 103.A ND2 LEU 100.A O no hydrogen 3.605 N/A LYS 104.A NZ ASP 192.A O no hydrogen 3.370 N/A SER 105.A N SER 191.A O no hydrogen 3.241 N/A SER 105.A OG HIS 235.A ND1 no hydrogen 3.394 N/A VAL 106.A N LEU 234.A O no hydrogen 2.772 N/A THR 107.A N VAL 189.A O no hydrogen 2.727 N/A THR 107.A OG1 HIS 198.A NE2 no hydrogen 2.776 N/A VAL 108.A N TYR 232.A O no hydrogen 3.441 N/A LEU 109.A N LEU 187.A O no hydrogen 2.908 N/A ASP 110.A N ASP 218.A OD1 no hydrogen 2.995 N/A ASP 110.A N ASP 218.A OD2 no hydrogen 3.139 N/A VAL 111.A N ASP 185.A O no hydrogen 2.793 N/A GLY 112.A N ASP 110.A OD1 no hydrogen 2.857 N/A ALA 114.A N VAL 111.A O no hydrogen 3.196 N/A TYR 115.A N GLY 112.A O no hydrogen 2.937 N/A PHE 116.A N ASP 113.A O no hydrogen 3.381 N/A SER 117.A N ALA 114.A O no hydrogen 3.363 N/A SER 117.A OG ALA 114.A O no hydrogen 2.741 N/A LEU 120.A N ASN 147.A O no hydrogen 2.836 N/A PHE 124.A N ASP 121.A O no hydrogen 2.867 N/A ARG 125.A NE LEU 120.A O no hydrogen 2.922 N/A ARG 125.A NH2 LEU 120.A O no hydrogen 3.189 N/A LYS 126.A NZ ASP 123.A O no hydrogen 2.887 N/A TYR 127.A N PHE 124.A O no hydrogen 3.149 N/A THR 128.A N ARG 125.A O no hydrogen 2.924 N/A THR 128.A OG1 ARG 125.A O no hydrogen 2.854 N/A PHE 130.A N TYR 144.A O no hydrogen 2.985 N/A THR 131.A OG1 ASN 57.A OD1 no hydrogen 2.485 N/A ILE 132.A N ILE 142.A O no hydrogen 2.779 N/A SER 134.A OG THR 139.A O no hydrogen 2.910 N/A SER 134.A OG THR 139.A OG1 no hydrogen 3.311 N/A ASN 137.A N SER 134.A O no hydrogen 3.239 N/A GLU 138.A N ILE 135.A O no hydrogen 3.309 N/A THR 139.A N SER 134.A OG no hydrogen 3.288 N/A THR 139.A OG1 SER 134.A OG no hydrogen 3.311 N/A ARG 143.A NH1 TYR 56.A O no hydrogen 2.897 N/A ARG 143.A NH1 THR 131.A OG1 no hydrogen 2.745 N/A ARG 143.A NH2 TYR 56.A O no hydrogen 2.868 N/A TYR 144.A N PHE 130.A O no hydrogen 3.169 N/A GLN 145.A N SER 48.A O no hydrogen 3.109 N/A TYR 146.A N THR 128.A OG1 no hydrogen 3.023 N/A ASN 147.A N LYS 46.A O no hydrogen 2.680 N/A ASN 147.A ND2 GLY 45.A O no hydrogen 2.963 N/A ASN 147.A ND2 SER 48.A OG no hydrogen 2.695 N/A LEU 149.A N VAL 118.A O no hydrogen 3.305 N/A GLN 151.A NE2 ASP 113.A OD2 no hydrogen 3.095 N/A LYS 154.A N ASN 81.A OD1 no hydrogen 2.703 N/A SER 156.A N TRP 153.A O no hydrogen 3.044 N/A SER 156.A OG PRO 150.A O no hydrogen 2.634 N/A ILE 159.A N GLY 155.A O no hydrogen 3.119 N/A PHE 160.A N SER 156.A O no hydrogen 3.006 N/A GLN 161.A N ALA 158.A O no hydrogen 3.293 N/A GLN 161.A NE2 LEU 92.A O no hydrogen 3.240 N/A GLN 161.A NE2 ALA 158.A O no hydrogen 3.157 N/A MET 164.A N PHE 160.A O no hydrogen 3.042 N/A THR 165.A N GLN 161.A O no hydrogen 3.185 N/A THR 165.A OG1 GLN 161.A O no hydrogen 3.124 N/A ILE 167.A N SER 163.A O no hydrogen 3.006 N/A LEU 168.A N MET 164.A O no hydrogen 3.019 N/A GLU 169.A N THR 165.A O no hydrogen 3.008 N/A LYS 172.A N LEU 168.A O no hydrogen 2.715 N/A LYS 173.A N GLU 169.A O no hydrogen 2.895 N/A GLN 174.A N PRO 170.A O no hydrogen 3.079 N/A ASN 175.A N LYS 172.A O no hydrogen 2.966 N/A ASN 175.A ND2 PHE 171.A O no hydrogen 2.894 N/A VAL 179.A N GLY 190.A O no hydrogen 2.852 N/A TYR 181.A N TYR 188.A O no hydrogen 2.770 N/A TYR 183.A N ASP 186.A O no hydrogen 3.195 N/A ASP 185.A N TYR 115.A OH no hydrogen 3.208 N/A ASP 186.A N TYR 183.A O no hydrogen 3.150 N/A LEU 187.A N LEU 109.A O no hydrogen 2.760 N/A TYR 188.A N TYR 181.A O no hydrogen 2.576 N/A VAL 189.A N THR 107.A O no hydrogen 3.001 N/A GLY 190.A N VAL 179.A O no hydrogen 2.823 N/A SER 191.A N SER 105.A O no hydrogen 3.022 N/A SER 191.A OG HIS 198.A ND1 no hydrogen 2.609 N/A HIS 198.A N GLU 194.A O no hydrogen 2.864 N/A HIS 198.A ND1 SER 191.A OG no hydrogen 2.609 N/A HIS 198.A NE2 THR 107.A OG1 no hydrogen 2.776 N/A ARG 199.A N ILE 195.A O no hydrogen 2.858 N/A THR 200.A N GLY 196.A O no hydrogen 3.107 N/A THR 200.A OG1 GLY 196.A O no hydrogen 2.824 N/A LYS 201.A N GLN 197.A O no hydrogen 2.944 N/A LYS 201.A NZ ASN 175.A OD1 no hydrogen 2.693 N/A LYS 201.A NZ GLU 204.A OE1 no hydrogen 3.189 N/A LYS 201.A NZ GLU 204.A OE2 no hydrogen 3.372 N/A ILE 202.A N HIS 198.A O no hydrogen 3.008 N/A ILE 202.A N ARG 199.A O no hydrogen 3.234 N/A GLU 203.A N ARG 199.A O no hydrogen 3.236 N/A GLU 204.A N THR 200.A O no hydrogen 3.202 N/A LEU 205.A N LYS 201.A O no hydrogen 3.041 N/A ARG 206.A N ILE 202.A O no hydrogen 3.002 N/A ARG 206.A NE THR 216.A O no hydrogen 3.143 N/A GLN 207.A N GLU 203.A O no hydrogen 3.215 N/A GLN 207.A NE2 GLU 203.A OE2 no hydrogen 2.531 N/A LEU 209.A N LEU 205.A O no hydrogen 3.126 N/A LEU 210.A N ARG 206.A O no hydrogen 2.708 N/A ARG 211.A N HIS 208.A O no hydrogen 3.179 N/A ARG 211.A NH1 GLN 207.A O no hydrogen 3.009 N/A ARG 211.A NH1 GLN 207.A OE1 no hydrogen 2.925 N/A TRP 212.A N LEU 209.A O no hydrogen 2.668 N/A GLY 213.A N LEU 210.A O no hydrogen 3.128 N/A LYS 220.A NZ GLN 407.A O no hydrogen 3.487 N/A GLN 222.A NE2 MET 230.A O no hydrogen 3.136 N/A LYS 223.A NZ SER 68.A OG no hydrogen 2.994 N/A LEU 234.A N VAL 106.A O no hydrogen 2.674 N/A HIS 235.A ND1 LYS 104.A O no hydrogen 2.985 N/A ASP 237.A N ASN 103.A O no hydrogen 3.207 N/A LYS 238.A N HIS 235.A O no hydrogen 3.123 N/A TRP 239.A N PRO 236.A O no hydrogen 2.722 N/A GLN 242.A N THR 351.A O no hydrogen 3.408 N/A GLN 242.A NE2 PRO 243.A O no hydrogen 3.517 N/A THR 253.A N ASP 256.A OD2 no hydrogen 2.710 N/A THR 253.A OG1 ASP 256.A OD2 no hydrogen 2.487 N/A VAL 254.A N GLU 291.A O no hydrogen 3.350 N/A ASN 255.A N LEU 289.A O no hydrogen 3.192 N/A ASP 256.A N THR 253.A OG1 no hydrogen 2.962 N/A ILE 257.A N THR 253.A O no hydrogen 3.066 N/A GLN 258.A N VAL 254.A O no hydrogen 2.864 N/A LYS 259.A N ASN 255.A O no hydrogen 2.951 N/A LEU 260.A N ASP 256.A O no hydrogen 2.992 N/A VAL 261.A N ILE 257.A O no hydrogen 2.779 N/A GLY 262.A N GLN 258.A O no hydrogen 3.005 N/A LYS 263.A N LYS 259.A O no hydrogen 3.126 N/A LYS 263.A NZ VAL 245.A O no hydrogen 2.879 N/A LYS 263.A NZ LYS 424.A O no hydrogen 3.246 N/A LEU 264.A N LEU 260.A O no hydrogen 3.107 N/A ASN 265.A N VAL 261.A O no hydrogen 2.991 N/A TRP 266.A N GLY 262.A O no hydrogen 3.117 N/A ALA 267.A N LYS 263.A O no hydrogen 2.991 N/A SER 268.A N ASN 265.A O no hydrogen 3.168 N/A SER 268.A OG LEU 264.A O no hydrogen 3.121 N/A SER 268.A OG ASN 265.A O no hydrogen 3.094 N/A GLN 269.A N TRP 266.A O no hydrogen 3.272 N/A LYS 275.A N ASN 306.A OD1 no hydrogen 2.859 N/A LEU 279.A N VAL 276.A O no hydrogen 2.712 N/A CYS 280.A N ARG 277.A O no hydrogen 3.322 N/A LYS 281.A NZ PRO 294.A O no hydrogen 3.536 N/A THR 286.A OG1 GLY 285.A O no hydrogen 2.662 N/A LYS 287.A NZ LEU 282.A O no hydrogen 3.417 N/A ILE 293.A N TRP 252.A O no hydrogen 2.965 N/A GLU 297.A N GLU 297.A OE1 no hydrogen 2.524 N/A GLU 300.A N THR 296.A O no hydrogen 3.485 N/A LEU 301.A N GLU 297.A O no hydrogen 3.320 N/A GLU 302.A N GLU 298.A O no hydrogen 2.627 N/A LEU 303.A N ALA 299.A O no hydrogen 2.770 N/A ALA 304.A N GLU 300.A O no hydrogen 3.010 N/A GLU 305.A N LEU 301.A O no hydrogen 2.714 N/A ASN 306.A N GLU 302.A O no hydrogen 2.897 N/A ASN 306.A ND2 LYS 275.A O no hydrogen 2.886 N/A ARG 307.A N LEU 303.A O no hydrogen 3.162 N/A ARG 307.A NH1 GLU 248.A OE2 no hydrogen 3.054 N/A ARG 307.A NH2 PRO 247.A O no hydrogen 2.926 N/A GLU 308.A N GLU 305.A O no hydrogen 3.107 N/A ILE 309.A N GLU 305.A O no hydrogen 3.315 N/A LEU 310.A N ASN 306.A O no hydrogen 2.926 N/A VAL 317.A N VAL 314.A O no hydrogen 3.206 N/A ASP 320.A N GLN 343.A OE1 no hydrogen 2.602 N/A SER 322.A N ASP 320.A OD1 no hydrogen 2.896 N/A SER 322.A OG ASP 320.A OD1 no hydrogen 2.660 N/A LYS 323.A N ASP 320.A O no hydrogen 3.074 N/A ILE 326.A N TYR 342.A O no hydrogen 2.760 N/A ALA 327.A N LYS 388.A O no hydrogen 2.954 N/A GLU 328.A N GLN 340.A O no hydrogen 3.054 N/A GLN 330.A N THR 338.A O no hydrogen 2.755 N/A GLN 330.A NE2 GLN 340.A OE1 no hydrogen 2.741 N/A LYS 331.A NZ ASP 364.A OD2 no hydrogen 2.875 N/A GLN 332.A N GLN 336.A O no hydrogen 2.856 N/A GLN 332.A NE2 THR 338.A OG1 no hydrogen 3.143 N/A GLN 332.A NE2 VAL 423.A O no hydrogen 3.639 N/A GLN 336.A N GLY 333.A O no hydrogen 2.883 N/A TRP 337.A N TYR 354.A O no hydrogen 3.005 N/A TRP 337.A NE1 GLN 367.A OE1 no hydrogen 3.094 N/A THR 338.A N GLN 330.A O no hydrogen 3.090 N/A THR 338.A OG1 GLN 330.A OE1 no hydrogen 2.823 N/A THR 338.A OG1 TRP 426.A O no hydrogen 3.473 N/A TYR 339.A N GLY 352.A O no hydrogen 3.291 N/A GLN 340.A N GLU 328.A O no hydrogen 2.963 N/A GLN 340.A NE2 GLN 330.A OE1 no hydrogen 2.834 N/A ILE 341.A N LYS 350.A O no hydrogen 2.700 N/A TYR 342.A N ILE 326.A O no hydrogen 2.880 N/A TYR 342.A OH GLU 328.A OE1 no hydrogen 2.412 N/A GLN 343.A NE2 ASP 320.A O no hydrogen 2.788 N/A GLN 343.A NE2 LYS 323.A O no hydrogen 2.812 N/A GLN 343.A NE2 ASP 324.A O no hydrogen 3.554 N/A LYS 347.A N GLU 344.A O no hydrogen 2.928 N/A LEU 349.A N ILE 341.A O no hydrogen 2.811 N/A LYS 350.A N ILE 341.A O no hydrogen 3.303 N/A LYS 350.A NZ THR 351.A O no hydrogen 3.252 N/A THR 351.A OG1 GLN 242.A O no hydrogen 2.554 N/A GLY 352.A N TYR 339.A O no hydrogen 2.859 N/A LYS 353.A NZ GLN 242.A OE1 no hydrogen 2.755 N/A ARG 356.A N GLY 335.A O no hydrogen 3.065 N/A GLY 359.A N ARG 356.A O no hydrogen 2.981 N/A VAL 365.A N ASN 363.A OD1 no hydrogen 3.173 N/A GLN 367.A N ASN 363.A O no hydrogen 3.164 N/A LEU 368.A N ASP 364.A O no hydrogen 2.787 N/A THR 369.A N VAL 365.A O no hydrogen 2.926 N/A THR 369.A OG1 VAL 365.A O no hydrogen 3.545 N/A THR 369.A OG1 LYS 366.A O no hydrogen 2.882 N/A GLU 370.A N LYS 366.A O no hydrogen 3.035 N/A ALA 371.A N GLN 367.A O no hydrogen 2.792 N/A VAL 372.A N LEU 368.A O no hydrogen 2.949 N/A GLN 373.A N THR 369.A O no hydrogen 3.136 N/A GLN 373.A NE2 THR 369.A O no hydrogen 3.233 N/A GLN 373.A NE2 TYR 405.A O no hydrogen 3.573 N/A LYS 374.A N GLU 370.A O no hydrogen 3.001 N/A LYS 374.A NZ GLU 378.A OE2 no hydrogen 3.164 N/A ILE 375.A N ALA 371.A O no hydrogen 2.785 N/A THR 376.A N VAL 372.A O no hydrogen 2.822 N/A THR 376.A OG1 VAL 372.A O no hydrogen 2.528 N/A THR 377.A N GLN 373.A O no hydrogen 2.909 N/A THR 377.A OG1 GLN 373.A O no hydrogen 2.792 N/A GLU 378.A N LYS 374.A O no hydrogen 2.981 N/A SER 379.A N ILE 375.A O no hydrogen 2.934 N/A SER 379.A OG LYS 385.A O no hydrogen 2.855 N/A ILE 380.A N THR 376.A O no hydrogen 2.840 N/A VAL 381.A N THR 377.A O no hydrogen 3.089 N/A ILE 382.A N GLU 378.A O no hydrogen 2.969 N/A TRP 383.A N SER 379.A O no hydrogen 2.901 N/A GLY 384.A N ILE 380.A O no hydrogen 3.017 N/A LYS 385.A NZ PRO 321.A O no hydrogen 3.301 N/A LYS 385.A NZ LYS 323.A O no hydrogen 3.242 N/A LYS 388.A N LEU 325.A O no hydrogen 2.711 N/A PHE 389.A N GLU 413.A O no hydrogen 2.733 N/A LYS 390.A N ALA 327.A O no hydrogen 2.921 N/A LYS 390.A NZ TYR 342.A OH no hydrogen 3.115 N/A LEU 391.A N GLU 415.A O no hydrogen 2.986 N/A ILE 393.A N LEU 391.A O no hydrogen 2.969 N/A GLN 394.A NE2 GLU 396.A OE1 no hydrogen 3.406 N/A TRP 398.A N GLN 394.A O no hydrogen 2.964 N/A GLU 399.A N LYS 395.A O no hydrogen 2.911 N/A THR 400.A N GLU 396.A O no hydrogen 3.047 N/A THR 400.A OG1 GLU 396.A O no hydrogen 2.862 N/A TRP 401.A N THR 397.A O no hydrogen 3.181 N/A TRP 401.A N TRP 398.A O no hydrogen 3.093 N/A TRP 402.A N TRP 398.A O no hydrogen 2.888 N/A GLU 404.A N TRP 401.A O no hydrogen 2.860 N/A TYR 405.A N TRP 402.A O no hydrogen 3.083 N/A TRP 406.A NE1 TRP 410.A O no hydrogen 3.098 N/A GLN 407.A N GLN 373.A OE1 no hydrogen 2.838 N/A GLN 407.A NE2 LYS 65.A O no hydrogen 3.258 N/A GLU 415.A N PHE 389.A O no hydrogen 2.720 N/A VAL 417.A N LEU 391.A O no hydrogen 3.209 N/A LEU 425.A N LEU 422.A O no hydrogen 2.772 N/A