Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8x06_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH VAL 216.A O no hydrogen 2.795 N/A CYS 6.A N VAL 25.A O no hydrogen 2.890 N/A CYS 6.A SG GLU 19.A O no hydrogen 3.315 N/A ILE 11.A N GLN 31.A O no hydrogen 2.710 N/A ARG 16.A NH2 ASN 13.A OD1 no hydrogen 2.414 N/A GLU 19.A N GLU 19.A OE2 no hydrogen 2.711 N/A LEU 20.A N LEU 17.A O no hydrogen 2.918 N/A GLU 21.A N HIS 18.A O no hydrogen 3.271 N/A CYS 23.A SG GLU 19.A O no hydrogen 3.299 N/A SER 24.A N GLU 4.A O no hydrogen 3.169 N/A SER 24.A OG PRO 2.A O no hydrogen 2.410 N/A SER 24.A OG LYS 50.A O no hydrogen 3.500 N/A GLU 27.A N CYS 6.A O no hydrogen 2.584 N/A LEU 30.A N TYR 57.A O no hydrogen 3.441 N/A LEU 34.A N PHE 61.A O no hydrogen 3.449 N/A THR 38.A OG1 TYR 64.A O no hydrogen 2.262 N/A ASP 42.A N ARG 39.A O no hydrogen 3.342 N/A PHE 43.A N PRO 40.A O no hydrogen 3.353 N/A ARG 44.A NH1 SER 68.A O no hydrogen 3.405 N/A ARG 44.A NH2 SER 68.A O no hydrogen 3.460 N/A LYS 50.A NZ GLU 21.A O no hydrogen 3.436 N/A ILE 52.A N SER 24.A O no hydrogen 3.328 N/A THR 55.A OG1 ILE 26.A O no hydrogen 2.261 N/A ASP 56.A N GLY 28.A O no hydrogen 2.999 N/A LEU 58.A N ALA 89.A O no hydrogen 3.264 N/A LEU 59.A N LEU 30.A O no hydrogen 3.411 N/A LEU 60.A N VAL 91.A O no hydrogen 2.884 N/A TYR 64.A N MET 35.A O no hydrogen 2.883 N/A SER 68.A OG GLU 100.A O no hydrogen 3.248 N/A LEU 72.A N LEU 69.A O no hydrogen 3.295 N/A PHE 73.A N LEU 69.A O no hydrogen 3.216 N/A LEU 76.A N PHE 73.A O no hydrogen 3.472 N/A THR 77.A N ILE 52.A O no hydrogen 3.297 N/A THR 77.A OG1 ASN 75.A O no hydrogen 3.039 N/A ARG 80.A N ILE 54.A O no hydrogen 3.179 N/A ARG 80.A NH1 ASP 239.A OD1 no hydrogen 3.378 N/A ARG 80.A NH2 ASP 239.A OD1 no hydrogen 2.922 N/A SER 82.A N THR 55.A O no hydrogen 3.188 N/A PHE 85.A N TYR 88.A O no hydrogen 3.019 N/A ASN 87.A ND2 ASN 87.A O no hydrogen 2.540 N/A ALA 89.A N SER 113.A O no hydrogen 2.495 N/A LEU 90.A N SER 113.A O no hydrogen 3.092 N/A VAL 91.A N LEU 58.A O no hydrogen 2.921 N/A ILE 92.A N ARG 115.A O no hydrogen 2.915 N/A PHE 93.A N LEU 60.A O no hydrogen 2.919 N/A GLU 94.A N GLU 117.A O no hydrogen 3.124 N/A LYS 99.A N GLU 67.A O no hydrogen 3.101 N/A ASN 105.A ND2 PRO 74.A O no hydrogen 2.590 N/A MET 107.A N THR 77.A O no hydrogen 3.094 N/A ILE 109.A N ILE 133.A O no hydrogen 2.580 N/A THR 110.A N ILE 79.A O no hydrogen 3.172 N/A THR 110.A OG1 ILE 79.A O no hydrogen 3.243 N/A ARG 111.A NE GLU 335.A OE2 no hydrogen 3.203 N/A ARG 111.A NH1 GLY 81.A O no hydrogen 3.480 N/A ARG 111.A NH2 GLN 310.A OE1 no hydrogen 3.426 N/A ARG 111.A NH2 GLU 335.A OE1 no hydrogen 2.701 N/A SER 113.A OG ASN 140.A OD1 no hydrogen 3.526 N/A ARG 115.A N LEU 90.A O no hydrogen 2.900 N/A ARG 115.A NE TYR 88.A OH no hydrogen 3.326 N/A GLU 117.A N ILE 92.A O no hydrogen 2.896 N/A ASN 119.A N LEU 144.A O no hydrogen 3.229 N/A ASN 119.A ND2 GLU 117.A O no hydrogen 3.022 N/A TYR 124.A OH ILE 155.A O no hydrogen 2.866 N/A TYR 124.A OH THR 174.A O no hydrogen 3.223 N/A THR 127.A OG1 CYS 172.A O no hydrogen 3.410 N/A ASP 129.A N GLN 179.A OE1 no hydrogen 2.748 N/A SER 136.A OG SER 113.A OG no hydrogen 2.782 N/A VAL 137.A N GLU 138.A OE2 no hydrogen 3.304 N/A GLU 138.A N GLU 138.A OE2 no hydrogen 2.395 N/A ASN 140.A N VAL 137.A O no hydrogen 3.472 N/A ASN 145.A ND2 ILE 116.A O no hydrogen 3.410 N/A LYS 146.A NZ GLU 150.A OE1 no hydrogen 3.326 N/A ASP 148.A N ASP 148.A OD2 no hydrogen 2.407 N/A GLU 150.A N LYS 146.A O no hydrogen 2.956 N/A CYS 152.A SG CYS 123.A O no hydrogen 3.337 N/A CYS 152.A SG GLY 153.A O no hydrogen 3.905 N/A CYS 156.A SG ASP 154.A O no hydrogen 3.541 N/A CYS 159.A SG ARG 171.A O no hydrogen 3.971 N/A CYS 159.A SG GLN 179.A O no hydrogen 3.794 N/A THR 162.A N VAL 169.A O no hydrogen 3.262 N/A CYS 172.A N THR 127.A O no hydrogen 2.926 N/A CYS 172.A SG TYR 124.A OH no hydrogen 3.132 N/A CYS 172.A SG THR 127.A OG1 no hydrogen 3.281 N/A CYS 172.A SG ILE 155.A O no hydrogen 3.933 N/A THR 174.A N HIS 177.A O no hydrogen 3.328 N/A THR 174.A OG1 GLU 100.A OE2 no hydrogen 2.576 N/A HIS 175.A N THR 174.A OG1 no hydrogen 2.643 N/A CYS 178.A SG GLN 179.A O no hydrogen 3.352 N/A GLN 179.A N ARG 171.A O no hydrogen 3.423 N/A LYS 180.A NZ THR 192.A O no hydrogen 2.714 N/A CYS 186.A SG HIS 189.A NE2 no hydrogen 4.008 N/A CYS 186.A SG GLY 190.A O no hydrogen 3.201 N/A LYS 187.A N ILE 185.A O no hydrogen 2.768 N/A LYS 187.A NZ ILE 185.A O no hydrogen 2.454 N/A CYS 191.A SG VAL 181.A O no hydrogen 3.411 N/A THR 192.A OG1 CYS 206.A O no hydrogen 3.439 N/A ALA 193.A N THR 192.A OG1 no hydrogen 2.484 N/A GLY 195.A N THR 192.A O no hydrogen 3.140 N/A CYS 197.A SG HIS 189.A NE2 no hydrogen 3.265 N/A CYS 198.A SG HIS 189.A O no hydrogen 3.376 N/A CYS 198.A SG GLY 190.A O no hydrogen 3.927 N/A CYS 202.A SG PRO 212.A O no hydrogen 3.234 N/A LEU 203.A N ALA 217.A O no hydrogen 3.250 N/A LYS 214.A N ASP 211.A O no hydrogen 3.160 N/A CYS 215.A SG PRO 212.A O no hydrogen 3.344 N/A CYS 215.A SG ALA 217.A O no hydrogen 3.432 N/A CYS 218.A SG PHE 221.A O no hydrogen 3.286 N/A CYS 218.A SG ARG 226.A O no hydrogen 3.448 N/A ARG 219.A N GLU 201.A O no hydrogen 2.951 N/A LEU 223.A N ARG 226.A O no hydrogen 2.901 N/A ARG 226.A N LEU 223.A O no hydrogen 2.903 N/A CYS 227.A SG GLU 201.A O no hydrogen 3.280 N/A CYS 227.A SG ALA 217.A O no hydrogen 3.533 N/A VAL 228.A N PHE 221.A O no hydrogen 2.900 N/A CYS 231.A SG TYR 235.A O no hydrogen 3.769 N/A CYS 231.A SG HIS 237.A ND1 no hydrogen 3.550 N/A TYR 235.A N PRO 232.A O no hydrogen 2.800 N/A TYR 236.A N VAL 242.A O no hydrogen 2.816 N/A VAL 242.A N TYR 236.A O no hydrogen 3.033 N/A CYS 247.A SG ASN 243.A O no hydrogen 3.989 N/A GLN 248.A N PHE 244.A O no hydrogen 2.901 N/A ASP 249.A N SER 245.A O no hydrogen 2.895 N/A LEU 250.A N PHE 246.A O no hydrogen 2.913 N/A HIS 251.A N CYS 247.A O no hydrogen 2.896 N/A HIS 252.A N GLN 248.A O no hydrogen 2.902 N/A LYS 253.A N ASP 249.A O no hydrogen 3.043 N/A CYS 254.A N HIS 251.A O no hydrogen 3.261 N/A CYS 254.A SG CYS 259.A O no hydrogen 3.604 N/A ARG 258.A N SER 257.A OG no hydrogen 2.623 N/A CYS 259.A SG CYS 254.A O no hydrogen 3.230 N/A VAL 263.A N ILE 268.A O no hydrogen 3.392 N/A ILE 264.A N LEU 281.A O no hydrogen 3.142 N/A HIS 265.A N LYS 266.A O no hydrogen 2.987 N/A CYS 267.A SG VAL 263.A O no hydrogen 3.659 N/A THR 276.A N THR 284.A O no hydrogen 2.963 N/A THR 276.A OG1 MET 277.A O no hydrogen 3.432 N/A CYS 283.A N ILE 264.A O no hydrogen 3.069 N/A CYS 283.A SG ILE 264.A O no hydrogen 3.362 N/A THR 284.A OG1 THR 276.A O no hydrogen 2.739 N/A CYS 286.A N GLY 274.A O no hydrogen 3.268 N/A CYS 286.A SG GLY 288.A O no hydrogen 3.396 N/A CYS 290.A SG CYS 290.A O no hydrogen 2.868 N/A LYS 292.A NZ GLU 270.A OE2 no hydrogen 2.738 N/A CYS 294.A N VAL 317.A O no hydrogen 3.123 N/A CYS 294.A SG LYS 292.A O no hydrogen 3.783 N/A LYS 301.A NZ SER 308.A O no hydrogen 2.785 N/A ILE 303.A N ILE 323.A O no hydrogen 3.082 N/A ASP 304.A N SER 308.A OG no hydrogen 3.308 N/A SER 305.A N SER 308.A OG no hydrogen 3.061 N/A SER 305.A OG SER 308.A OG no hydrogen 3.007 N/A THR 307.A OG1 LEU 84.A O no hydrogen 3.216 N/A SER 308.A N SER 305.A O no hydrogen 3.271 N/A SER 308.A OG ASP 304.A OD2 no hydrogen 2.399 N/A SER 308.A OG SER 305.A O no hydrogen 3.407 N/A SER 308.A OG SER 305.A OG no hydrogen 3.007 N/A GLN 310.A N THR 307.A O no hydrogen 3.406 N/A GLN 310.A NE2 SER 82.A O no hydrogen 2.749 N/A CYS 315.A N LEU 312.A O no hydrogen 3.350 N/A CYS 315.A SG LEU 312.A O no hydrogen 3.424 N/A THR 316.A N LYS 292.A O no hydrogen 2.981 N/A ILE 318.A N GLU 345.A O no hydrogen 3.220 N/A ASN 319.A ND2 HIS 295.A ND1 no hydrogen 3.505 N/A ILE 324.A N LYS 351.A O no hydrogen 3.036 N/A ASN 325.A N ILE 303.A O no hydrogen 2.892 N/A ILE 326.A N SER 355.A OG no hydrogen 3.064 N/A LEU 336.A N LEU 332.A O no hydrogen 3.402 N/A ALA 338.A N ALA 334.A O no hydrogen 3.015 N/A ASN 339.A N GLU 335.A O no hydrogen 2.903 N/A LEU 340.A N LEU 336.A O no hydrogen 2.639 N/A GLU 344.A N THR 316.A O no hydrogen 3.182 N/A GLU 345.A N THR 316.A O no hydrogen 2.877 N/A SER 347.A N ILE 318.A O no hydrogen 3.144 N/A SER 347.A OG ILE 318.A O no hydrogen 2.306 N/A SER 347.A OG ASN 319.A OD1 no hydrogen 3.217 N/A TYR 349.A OH GLU 300.A OE2 no hydrogen 3.086 N/A LEU 350.A N SER 381.A O no hydrogen 2.902 N/A ILE 352.A N TYR 383.A O no hydrogen 2.897 N/A ARG 353.A N ILE 324.A O no hydrogen 3.039 N/A SER 355.A OG ILE 326.A O no hydrogen 3.132 N/A VAL 359.A N ALA 357.A O no hydrogen 2.887 N/A SER 360.A OG SER 362.A OG no hydrogen 3.154 N/A SER 362.A OG SER 360.A OG no hydrogen 3.154 N/A PHE 363.A N LEU 361.A O no hydrogen 2.890 N/A LYS 366.A NZ GLU 344.A OE2 no hydrogen 2.604 N/A LEU 367.A N PHE 364.A O no hydrogen 3.447 N/A ARG 368.A N GLU 344.A O no hydrogen 3.168 N/A ARG 368.A NH2 GLU 344.A OE1 no hydrogen 2.543 N/A ARG 371.A N ILE 346.A O no hydrogen 2.598 N/A ARG 371.A NE GLU 345.A OE1 no hydrogen 3.489 N/A THR 374.A OG1 SER 347.A O no hydrogen 3.522 N/A TYR 380.A OH ASP 438.A OD2 no hydrogen 2.611 N/A SER 381.A N LYS 407.A O no hydrogen 2.795 N/A TYR 383.A N LEU 350.A O no hydrogen 2.898 N/A LEU 385.A N ILE 352.A O no hydrogen 3.175 N/A ASN 387.A N TYR 412.A O no hydrogen 3.082 N/A GLN 388.A NE2 ASP 386.A OD2 no hydrogen 2.629 N/A ASN 389.A ND2 TYR 356.A O no hydrogen 3.452 N/A ARG 391.A NH2 ASN 389.A OD1 no hydrogen 2.859 N/A LYS 398.A N ASP 395.A O no hydrogen 3.401 N/A HIS 399.A N ASP 395.A O no hydrogen 2.972 N/A HIS 399.A NE2 ARG 365.A O no hydrogen 2.489 N/A ILE 403.A N SER 428.A O no hydrogen 3.321 N/A LYS 407.A NZ GLY 378.A O no hydrogen 3.472 N/A LEU 408.A N ASN 437.A OD1 no hydrogen 2.941 N/A PHE 409.A N PHE 382.A O no hydrogen 2.443 N/A PHE 410.A N ASP 438.A O no hydrogen 2.913 N/A HIS 411.A N ALA 384.A O no hydrogen 3.487 N/A ASN 413.A N ASN 444.A OD1 no hydrogen 2.773 N/A LEU 416.A N ASN 413.A O no hydrogen 3.181 N/A CYS 417.A SG SER 419.A OG no hydrogen 2.974 N/A HIS 422.A N LEU 418.A O no hydrogen 2.905 N/A LYS 423.A N SER 419.A O no hydrogen 2.904 N/A MET 424.A N GLU 420.A O no hydrogen 2.902 N/A GLU 425.A N ILE 421.A O no hydrogen 2.905 N/A GLU 426.A N HIS 422.A O no hydrogen 2.901 N/A VAL 427.A N LYS 423.A O no hydrogen 2.908 N/A SER 428.A N MET 424.A O no hydrogen 2.898 N/A SER 428.A OG MET 424.A O no hydrogen 3.390 N/A SER 428.A OG GLU 425.A O no hydrogen 3.338 N/A GLY 429.A N GLU 425.A O no hydrogen 2.866 N/A THR 430.A N SER 428.A OG no hydrogen 3.314 N/A THR 430.A OG1 SER 428.A OG no hydrogen 3.124 N/A GLY 432.A N GLY 429.A O no hydrogen 3.186 N/A ARG 433.A N THR 430.A O no hydrogen 2.907 N/A ARG 433.A NH1 ILE 403.A O no hydrogen 2.425 N/A ARG 433.A NH2 ILE 403.A O no hydrogen 3.064 N/A ARG 433.A NH2 GLN 405.A O no hydrogen 2.678 N/A ALA 440.A N PHE 410.A O no hydrogen 3.289 N/A ASN 444.A ND2 PHE 410.A O no hydrogen 3.278 N/A GLN 447.A N PRO 414.A O no hydrogen 3.177 N/A GLN 447.A N ASP 446.A OD1 no hydrogen 2.730 N/A ALA 448.A N GLY 445.A O no hydrogen 3.395 N/A ASN 452.A ND2 ASN 452.A O no hydrogen 2.538 N/A LEU 455.A N LYS 531.A O no hydrogen 3.184 N/A THR 462.A OG1 SER 463.A O no hydrogen 3.262 N/A THR 462.A OG1 LYS 466.A O no hydrogen 3.471 N/A SER 463.A N THR 462.A OG1 no hydrogen 2.471 N/A SER 463.A N LYS 466.A O no hydrogen 3.225 N/A TYR 474.A N GLU 472.A O no hydrogen 2.958 N/A ARG 480.A NH1 PHE 479.A O no hydrogen 3.009 N/A PHE 485.A N ILE 502.A O no hydrogen 2.909 N/A MET 486.A N LYS 525.A O no hydrogen 3.085 N/A LEU 487.A N VAL 500.A O no hydrogen 2.917 N/A VAL 500.A N LEU 487.A O no hydrogen 2.912 N/A ILE 502.A N PHE 485.A O no hydrogen 2.889 N/A HIS 506.A ND1 TRP 471.A O no hydrogen 3.249 N/A TRP 509.A N LEU 469.A O no hydrogen 3.316 N/A THR 518.A OG1 LYS 515.A O no hydrogen 2.362 N/A LYS 525.A N MET 486.A O no hydrogen 3.021 N/A SER 532.A OG LEU 455.A O no hydrogen 2.460 N/A