Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pqr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 GLU 37.A O no hydrogen 2.216 N/A ILE 3.A N GLU 37.A O no hydrogen 2.809 N/A PHE 4.A N ILE 38.A O no hydrogen 3.331 N/A GLU 7.A N SER 5.A OG no hydrogen 2.987 N/A ALA 9.A N SER 5.A O no hydrogen 2.762 N/A LEU 12.A N LYS 8.A O no hydrogen 2.931 N/A LEU 13.A N ALA 9.A O no hydrogen 2.841 N/A LEU 14.A N LEU 10.A O no hydrogen 2.935 N/A SER 15.A N GLY 11.A O no hydrogen 2.868 N/A SER 15.A OG THR 436.A OG1 no hydrogen 2.506 N/A LEU 16.A N LEU 12.A O no hydrogen 3.233 N/A LYS 17.A N LEU 14.A O no hydrogen 3.183 N/A LEU 18.A N LEU 13.A O no hydrogen 3.082 N/A TYR 23.A N SER 19.A O no hydrogen 2.776 N/A TYR 23.A OH PRO 40.A O no hydrogen 2.926 N/A ILE 24.A N LYS 20.A O no hydrogen 2.942 N/A THR 25.A N TRP 21.A O no hydrogen 2.932 N/A THR 25.A OG1 TRP 21.A O no hydrogen 3.076 N/A LEU 26.A N GLN 22.A O no hydrogen 2.855 N/A ARG 27.A N TYR 23.A O no hydrogen 2.908 N/A ARG 27.A NE TYR 39.A O no hydrogen 3.134 N/A GLU 28.A N ILE 24.A O no hydrogen 2.898 N/A THR 29.A N THR 25.A O no hydrogen 2.870 N/A THR 29.A OG1 THR 25.A O no hydrogen 3.296 N/A ILE 31.A N ARG 27.A O no hydrogen 2.899 N/A ILE 31.A N GLU 28.A O no hydrogen 2.973 N/A ARG 32.A N GLU 28.A O no hydrogen 2.912 N/A GLU 33.A N THR 29.A O no hydrogen 3.150 N/A GLY 34.A N ILE 31.A O no hydrogen 2.930 N/A LYS 44.A N SER 41.A O no hydrogen 2.661 N/A VAL 45.A N SER 41.A O no hydrogen 3.344 N/A GLN 46.A N TYR 42.A O no hydrogen 2.930 N/A LYS 47.A N TYR 43.A O no hydrogen 2.958 N/A ALA 48.A N LYS 44.A O no hydrogen 2.789 N/A LYS 49.A N VAL 45.A O no hydrogen 2.919 N/A LEU 50.A N GLN 46.A O no hydrogen 2.941 N/A GLN 51.A N ALA 48.A O no hydrogen 3.387 N/A CYS 52.A N LYS 49.A O no hydrogen 2.917 N/A CYS 52.A SG ASP 430.A OD2 no hydrogen 3.391 N/A PHE 58.A N PRO 55.A O no hydrogen 3.160 N/A ALA 60.A N LYS 67.A O no hydrogen 2.913 N/A THR 62.A N SER 65.A O no hydrogen 2.666 N/A ALA 66.A N PHE 149.A O no hydrogen 2.890 N/A LYS 67.A N ALA 60.A O no hydrogen 2.931 N/A ILE 68.A N VAL 147.A O no hydrogen 2.876 N/A ALA 69.A N PHE 58.A O no hydrogen 2.783 N/A LEU 70.A N GLU 169.A OE2 no hydrogen 2.928 N/A GLN 71.A NE2 VAL 174.A O no hydrogen 3.373 N/A LEU 73.A N ALA 69.A O no hydrogen 2.949 N/A LEU 74.A N LEU 70.A O no hydrogen 2.938 N/A ASP 75.A N GLN 71.A O no hydrogen 2.932 N/A LEU 76.A N ALA 72.A O no hydrogen 2.888 N/A THR 77.A N LEU 73.A O no hydrogen 2.947 N/A THR 77.A OG1 LEU 73.A O no hydrogen 3.141 N/A VAL 78.A N LEU 74.A O no hydrogen 2.953 N/A ASN 79.A N ASP 75.A O no hydrogen 2.898 N/A ARG 80.A N LEU 76.A O no hydrogen 2.933 N/A ARG 80.A NH1 GLU 83.A OE2 no hydrogen 3.218 N/A ILE 81.A N THR 77.A O no hydrogen 3.012 N/A PHE 82.A N VAL 78.A O no hydrogen 2.958 N/A GLU 83.A N ASN 79.A O no hydrogen 2.843 N/A THR 84.A N ARG 80.A O no hydrogen 3.102 N/A THR 84.A OG1 ARG 80.A O no hydrogen 3.549 N/A ILE 85.A N ILE 81.A O no hydrogen 2.912 N/A SER 87.A OG SER 87.A O no hydrogen 2.327 N/A GLN 92.A NE2 ASP 89.A O no hydrogen 2.870 N/A LEU 96.A N GLN 95.A OE1 no hydrogen 2.541 N/A ILE 97.A N THR 126.A O no hydrogen 2.854 N/A LEU 98.A N SER 184.A O no hydrogen 2.893 N/A ILE 99.A N LYS 124.A O no hydrogen 2.682 N/A SER 100.A N LYS 186.A O no hydrogen 2.909 N/A SER 100.A OG LYS 101.A O no hydrogen 3.235 N/A SER 100.A OG VAL 121.A O no hydrogen 2.907 N/A LYS 101.A N VAL 121.A O no hydrogen 2.947 N/A LYS 101.A NZ PRO 138.A O no hydrogen 2.516 N/A TRP 102.A N MET 188.A O no hydrogen 2.906 N/A GLY 103.A N SER 119.A O no hydrogen 2.943 N/A PHE 104.A N MET 191.A O no hydrogen 3.140 N/A ASP 105.A N MET 117.A O no hydrogen 2.997 N/A ALA 107.A N ILE 115.A O no hydrogen 2.887 N/A ASP 112.A N ASP 112.A OD2 no hydrogen 2.573 N/A SER 113.A N GLY 111.A O no hydrogen 2.683 N/A SER 114.A OG ALA 107.A O no hydrogen 3.170 N/A SER 114.A OG SER 113.A O no hydrogen 2.678 N/A ILE 115.A N ALA 107.A O no hydrogen 2.903 N/A PHE 116.A N SER 150.A O no hydrogen 2.937 N/A MET 117.A N ASP 105.A O no hydrogen 3.200 N/A THR 118.A N GLN 148.A O no hydrogen 2.729 N/A THR 118.A OG1 GLU 162.A OE2 no hydrogen 2.380 N/A SER 119.A N GLY 103.A O no hydrogen 2.883 N/A LEU 120.A N ARG 145.A O no hydrogen 2.903 N/A VAL 121.A N LYS 101.A O no hydrogen 2.841 N/A LEU 123.A N ILE 99.A O no hydrogen 2.932 N/A LYS 124.A N ILE 99.A O no hydrogen 3.109 N/A LYS 124.A NZ THR 126.A OG1 no hydrogen 2.392 N/A LEU 125.A N TRP 133.A O no hydrogen 2.843 N/A THR 126.A N ILE 97.A O no hydrogen 2.739 N/A ALA 127.A N ASP 130.A O no hydrogen 2.466 N/A ASP 128.A N GLN 95.A O no hydrogen 2.440 N/A ASP 130.A N ALA 127.A O no hydrogen 2.764 N/A VAL 132.A N LEU 125.A O no hydrogen 2.993 N/A TRP 133.A N LEU 125.A O no hydrogen 3.001 N/A ASN 135.A N LEU 123.A O no hydrogen 2.807 N/A ASN 135.A ND2 PRO 122.A O no hydrogen 2.893 N/A CYS 139.A SG GLU 462.A OE1 no hydrogen 3.212 N/A CYS 139.A SG GLU 462.A OE2 no hydrogen 3.097 N/A SER 140.A N LYS 137.A O no hydrogen 3.088 N/A CYS 144.A N PRO 141.A O no hydrogen 3.218 N/A ARG 145.A N LEU 120.A O no hydrogen 2.837 N/A ARG 145.A NE SER 429.A OG no hydrogen 2.764 N/A VAL 147.A N THR 118.A O no hydrogen 2.895 N/A GLN 148.A NE2 SER 150.A OG no hydrogen 3.135 N/A PHE 149.A N ALA 66.A O no hydrogen 2.968 N/A PHE 151.A N SER 64.A O no hydrogen 2.970 N/A THR 155.A OG1 ASP 157.A OD1 no hydrogen 2.201 N/A LYS 156.A NZ GLU 202.A OE2 no hydrogen 2.536 N/A VAL 158.A N THR 155.A OG1 no hydrogen 3.262 N/A ILE 160.A N LYS 156.A O no hydrogen 3.390 N/A ASN 161.A N ASP 157.A O no hydrogen 2.931 N/A GLU 162.A N VAL 158.A O no hydrogen 2.890 N/A LYS 163.A N VAL 159.A O no hydrogen 2.864 N/A LYS 163.A NZ ASP 167.A OD2 no hydrogen 2.748 N/A THR 164.A N ILE 160.A O no hydrogen 2.961 N/A THR 164.A OG1 ILE 160.A O no hydrogen 3.410 N/A MET 166.A N GLU 162.A O no hydrogen 2.877 N/A ASP 167.A N LYS 163.A O no hydrogen 2.873 N/A ASP 168.A N THR 164.A O no hydrogen 2.915 N/A GLU 169.A N MET 166.A O no hydrogen 3.125 N/A ILE 170.A N MET 166.A O no hydrogen 2.891 N/A GLU 171.A N ASP 167.A O no hydrogen 3.071 N/A ALA 172.A N GLU 169.A O no hydrogen 3.028 N/A LEU 173.A N ILE 170.A O no hydrogen 3.446 N/A SER 176.A N ILE 183.A O no hydrogen 2.904 N/A SER 176.A OG HIS 185.A NE2 no hydrogen 2.564 N/A CYS 178.A N HIS 181.A O no hydrogen 2.968 N/A HIS 181.A N CYS 178.A O no hydrogen 2.897 N/A ILE 183.A N SER 176.A O no hydrogen 2.923 N/A SER 184.A N LEU 96.A O no hydrogen 2.973 N/A HIS 185.A NE2 SER 176.A OG no hydrogen 2.564 N/A LYS 186.A N LEU 98.A O no hydrogen 2.926 N/A MET 188.A N SER 100.A O no hydrogen 2.900 N/A THR 190.A N TRP 102.A O no hydrogen 2.901 N/A THR 190.A OG1 MET 188.A O no hydrogen 3.278 N/A MET 191.A N TRP 102.A O no hydrogen 2.631 N/A ILE 192.A N THR 190.A O no hydrogen 2.912 N/A GLY 194.A N ASP 193.A OD1 no hydrogen 2.587 N/A CYS 197.A N ASP 193.A O no hydrogen 3.183 N/A CYS 197.A SG THR 233.A OG1 no hydrogen 2.717 N/A THR 198.A N GLY 194.A O no hydrogen 2.997 N/A THR 198.A OG1 LYS 195.A O no hydrogen 2.579 N/A TYR 199.A N LYS 195.A O no hydrogen 2.869 N/A LEU 200.A N ILE 196.A O no hydrogen 2.928 N/A SER 201.A N THR 198.A O no hydrogen 3.033 N/A SER 201.A OG CYS 197.A O no hydrogen 2.241 N/A SER 201.A OG THR 198.A O no hydrogen 3.116 N/A ALA 203.A N SER 201.A O no hydrogen 2.773 N/A ALA 207.A N ASN 206.A OD1 no hydrogen 2.576 N/A CYS 209.A SG HIS 368.A NE2 no hydrogen 3.333 N/A CYS 212.A SG HIS 368.A NE2 no hydrogen 3.142 N/A CYS 212.A SG HIS 373.A NE2 no hydrogen 2.207 N/A LEU 213.A N CYS 209.A O no hydrogen 3.084 N/A LYS 220.A NZ THR 221.A O no hydrogen 3.565 N/A SER 224.A OG SER 223.A O no hydrogen 2.679 N/A PHE 229.A N GLY 225.A O no hydrogen 3.298 N/A GLY 230.A N VAL 226.A O no hydrogen 2.952 N/A LEU 231.A N TYR 227.A O no hydrogen 2.833 N/A SER 232.A N GLU 228.A O no hydrogen 2.911 N/A SER 232.A OG GLU 228.A O no hydrogen 3.430 N/A THR 233.A N PHE 229.A O no hydrogen 2.839 N/A GLU 241.A N ILE 237.A O no hydrogen 2.953 N/A CYS 242.A SG ASN 238.A O no hydrogen 3.815 N/A CYS 242.A SG GLU 241.A OE2 no hydrogen 3.079 N/A CYS 242.A SG TYR 361.A OH no hydrogen 2.686 N/A CYS 242.A SG SER 364.A OG no hydrogen 3.031 N/A LEU 243.A N VAL 239.A O no hydrogen 2.908 N/A LEU 244.A N MET 240.A O no hydrogen 2.906 N/A HIS 245.A N GLU 241.A O no hydrogen 2.889 N/A HIS 245.A ND1 GLU 241.A O no hydrogen 2.520 N/A ILE 246.A N CYS 242.A O no hydrogen 2.927 N/A ALA 247.A N LEU 243.A O no hydrogen 2.909 N/A TYR 248.A N HIS 245.A O no hydrogen 3.442 N/A ARG 249.A N HIS 245.A O no hydrogen 3.293 N/A PHE 252.A N ARG 249.A O no hydrogen 3.443 N/A LYS 253.A N ARG 249.A O no hydrogen 3.008 N/A LYS 254.A NZ SER 256.A O no hydrogen 2.695 N/A LYS 254.A NZ SER 256.A OG no hydrogen 2.228 N/A GLU 264.A N GLU 264.A OE2 no hydrogen 3.094 N/A LEU 266.A N HIS 262.A O no hydrogen 2.856 N/A HIS 267.A N GLN 263.A O no hydrogen 2.939 N/A SER 268.A N GLU 264.A O no hydrogen 2.899 N/A ARG 269.A N LEU 265.A O no hydrogen 2.891 N/A LYS 270.A N LEU 266.A O no hydrogen 2.887 N/A LYS 271.A N HIS 267.A O no hydrogen 2.879 N/A LEU 272.A N SER 268.A O no hydrogen 2.970 N/A ILE 273.A N ARG 269.A O no hydrogen 2.918 N/A GLN 274.A N LYS 270.A O no hydrogen 3.116 N/A ASP 275.A N LYS 271.A O no hydrogen 2.868 N/A ARG 276.A N LEU 272.A O no hydrogen 2.990 N/A PHE 277.A N ILE 273.A O no hydrogen 2.927 N/A LYS 278.A N GLN 274.A O no hydrogen 2.874 N/A ASP 279.A N ASP 275.A O no hydrogen 2.901 N/A ASP 280.A N ARG 276.A O no hydrogen 2.976 N/A LEU 281.A N PHE 277.A O no hydrogen 3.105 N/A THR 295.A OG1 ASN 296.A O no hydrogen 3.108 N/A ASN 296.A N THR 295.A OG1 no hydrogen 2.476 N/A THR 300.A N ASP 297.A O no hydrogen 3.115 N/A THR 300.A N ASP 297.A OD1 no hydrogen 2.674 N/A THR 300.A OG1 ASP 297.A OD1 no hydrogen 3.176 N/A ALA 301.A N ASP 297.A O no hydrogen 3.042 N/A ARG 302.A N GLY 298.A O no hydrogen 2.889 N/A PHE 304.A N THR 300.A O no hydrogen 2.896 N/A PHE 305.A N ALA 301.A O no hydrogen 3.202 N/A PHE 305.A N ARG 302.A O no hydrogen 3.089 N/A LYS 310.A N ASP 309.A OD2 no hydrogen 2.470 N/A THR 311.A N PHE 307.A O no hydrogen 3.481 N/A ALA 312.A N PRO 308.A O no hydrogen 3.119 N/A ALA 313.A N ASP 309.A O no hydrogen 2.908 N/A ILE 314.A N LYS 310.A O no hydrogen 2.920 N/A THR 315.A N THR 311.A O no hydrogen 2.853 N/A GLY 316.A N ALA 312.A O no hydrogen 3.116 N/A LEU 317.A N ALA 312.A O no hydrogen 3.098 N/A ASP 318.A N TYR 358.A OH no hydrogen 3.153 N/A LEU 321.A N ASP 318.A OD2 no hydrogen 2.248 N/A ARG 323.A N GLU 319.A O no hydrogen 2.850 N/A ARG 324.A N ASP 320.A O no hydrogen 2.849 N/A ARG 324.A NH1 ASP 320.A OD2 no hydrogen 2.469 N/A PHE 325.A N LEU 321.A O no hydrogen 2.906 N/A SER 326.A N ILE 322.A O no hydrogen 2.857 N/A SER 326.A OG ILE 322.A O no hydrogen 3.491 N/A SER 326.A OG ARG 323.A O no hydrogen 2.805 N/A VAL 327.A N ARG 323.A O no hydrogen 2.904 N/A ILE 328.A N ARG 324.A O no hydrogen 2.869 N/A LEU 329.A N PHE 325.A O no hydrogen 2.936 N/A GLN 330.A N SER 326.A O no hydrogen 3.183 N/A ALA 331.A N VAL 327.A O no hydrogen 2.925 N/A ILE 332.A N ILE 328.A O no hydrogen 3.163 N/A THR 333.A N LEU 329.A O no hydrogen 3.031 N/A THR 333.A OG1 LEU 329.A O no hydrogen 3.425 N/A ASP 339.A N LEU 455.A O no hydrogen 3.015 N/A LYS 342.A NZ GLU 345.A OE2 no hydrogen 2.591 N/A PHE 343.A N ASP 339.A O no hydrogen 3.013 N/A LYS 344.A N VAL 340.A O no hydrogen 2.874 N/A TYR 346.A N LYS 342.A O no hydrogen 2.977 N/A ALA 347.A N PHE 343.A O no hydrogen 2.875 N/A ARG 348.A N LYS 344.A O no hydrogen 2.936 N/A THR 349.A N GLU 345.A O no hydrogen 2.907 N/A THR 349.A OG1 GLU 345.A O no hydrogen 3.082 N/A THR 349.A OG1 TYR 346.A O no hydrogen 2.517 N/A THR 350.A N TYR 346.A O no hydrogen 2.916 N/A THR 350.A OG1 TYR 346.A O no hydrogen 3.060 N/A THR 350.A OG1 ALA 347.A O no hydrogen 2.480 N/A ALA 351.A N ALA 347.A O no hydrogen 2.876 N/A GLU 352.A N ARG 348.A O no hydrogen 2.931 N/A LYS 353.A N THR 349.A O no hydrogen 2.881 N/A TYR 354.A N THR 350.A O no hydrogen 2.917 N/A VAL 355.A N ALA 351.A O no hydrogen 2.909 N/A GLU 356.A N GLU 352.A O no hydrogen 2.842 N/A TYR 358.A N TYR 354.A O no hydrogen 2.612 N/A SER 364.A OG TYR 361.A OH no hydrogen 2.625 N/A SER 365.A OG ALA 207.A O no hydrogen 3.558 N/A SER 365.A OG ALA 208.A O no hydrogen 3.344 N/A THR 366.A OG1 ASN 238.A O no hydrogen 3.302 N/A HIS 368.A N SER 364.A O no hydrogen 2.624 N/A LYS 369.A N SER 365.A O no hydrogen 2.983 N/A LYS 369.A N THR 366.A O no hydrogen 3.200 N/A LEU 370.A N THR 366.A O no hydrogen 2.943 N/A ILE 372.A N HIS 368.A O no hydrogen 3.063 N/A HIS 373.A N LYS 369.A O no hydrogen 3.306 N/A HIS 373.A NE2 HIS 368.A NE2 no hydrogen 3.048 N/A ASP 376.A N HIS 373.A O no hydrogen 3.078 N/A ALA 379.A N ASP 376.A O no hydrogen 3.234 N/A GLU 380.A N ASP 376.A O no hydrogen 2.887 N/A ASN 381.A N ILE 377.A O no hydrogen 2.941 N/A SER 390.A N CYS 139.A O no hydrogen 3.317 N/A SER 390.A OG CYS 139.A O no hydrogen 2.607 N/A SER 394.A N SER 390.A O no hydrogen 2.697 N/A SER 394.A OG ASN 398.A OD1 no hydrogen 3.359 N/A GLU 395.A N GLU 391.A O no hydrogen 2.959 N/A ALA 396.A N GLU 392.A O no hydrogen 2.880 N/A ARG 397.A N ALA 393.A O no hydrogen 2.931 N/A ARG 397.A NH1 SER 428.A OG no hydrogen 3.118 N/A ASN 398.A N SER 394.A O no hydrogen 2.942 N/A LYS 399.A N GLU 395.A O no hydrogen 2.870 N/A ASP 400.A N ALA 396.A O no hydrogen 2.889 N/A PHE 401.A N ARG 397.A O no hydrogen 2.896 N/A ARG 402.A N ASN 398.A O no hydrogen 2.997 N/A ARG 402.A NH2 SER 108.A O no hydrogen 3.375 N/A ARG 403.A N LYS 399.A O no hydrogen 2.909 N/A PHE 404.A N ASP 400.A O no hydrogen 2.874 N/A ARG 405.A N PHE 401.A O no hydrogen 2.956 N/A GLU 406.A N ARG 402.A O no hydrogen 2.946 N/A HIS 407.A N ARG 403.A O no hydrogen 2.933 N/A SER 409.A OG SER 417.A O no hydrogen 3.073 N/A SER 409.A OG SER 417.A OG no hydrogen 2.795 N/A SER 409.A OG ASP 420.A OD1 no hydrogen 3.136 N/A ARG 410.A N ASP 420.A OD1 no hydrogen 2.324 N/A ARG 410.A NE ASP 420.A OD2 no hydrogen 2.948 N/A LYS 411.A NZ GLU 406.A O no hydrogen 3.405 N/A ARG 414.A NE ASP 63.A O no hydrogen 3.054 N/A SER 417.A N SER 413.A O no hydrogen 3.055 N/A SER 417.A OG SER 409.A OG no hydrogen 2.795 N/A ASN 418.A N ARG 414.A O no hydrogen 3.162 N/A ASN 418.A ND2 THR 62.A O no hydrogen 2.946 N/A ASN 418.A ND2 ASP 63.A O no hydrogen 3.365 N/A GLU 419.A N GLN 415.A O no hydrogen 2.893 N/A ASP 420.A N ALA 416.A O no hydrogen 2.877 N/A ILE 421.A N SER 417.A O no hydrogen 2.994 N/A LEU 422.A N ASN 418.A O no hydrogen 2.877 N/A ASN 423.A N GLU 419.A O no hydrogen 2.899 N/A MET 424.A N ASP 420.A O no hydrogen 2.912 N/A LEU 425.A N ILE 421.A O no hydrogen 2.901 N/A ILE 426.A N LEU 422.A O no hydrogen 2.933 N/A SER 428.A N MET 424.A O no hydrogen 2.902 N/A SER 429.A N ILE 426.A O no hydrogen 3.205 N/A SER 429.A OG LEU 425.A O no hydrogen 3.272 N/A SER 429.A OG ILE 426.A O no hydrogen 3.367 N/A ASP 430.A N ILE 427.A O no hydrogen 2.797 N/A LEU 432.A N ASP 430.A OD2 no hydrogen 3.407 N/A THR 436.A OG1 SER 15.A OG no hydrogen 2.506 N/A ARG 437.A NH1 ASP 400.A OD2 no hydrogen 3.505 N/A ARG 437.A NH2 ASP 400.A OD2 no hydrogen 3.025 N/A ARG 445.A NH2 LEU 458.A O no hydrogen 2.902 N/A TYR 448.A OH GLN 446.A OE1 no hydrogen 3.201 N/A THR 452.A N PHE 449.A O no hydrogen 2.864 N/A THR 452.A OG1 PHE 449.A O no hydrogen 2.736 N/A LEU 455.A N THR 452.A O no hydrogen 2.680 N/A LEU 456.A N THR 452.A O no hydrogen 2.878 N/A LEU 456.A N VAL 453.A O no hydrogen 3.255 N/A GLN 457.A N ILE 337.A O no hydrogen 3.178 N/A GLU 466.A N GLU 391.A OE1 no hydrogen 3.129 N/A