Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6wwq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 3.A OE2 no hydrogen 2.336 N/A ARG 2.A NH1 SER 241.A O no hydrogen 3.536 N/A CYS 4.A N THR 51.A O no hydrogen 3.294 N/A CYS 4.A SG THR 51.A O no hydrogen 4.037 N/A SER 6.A N ARG 64.A O no hydrogen 3.240 N/A ILE 7.A N LEU 136.A O no hydrogen 2.864 N/A HIS 8.A N VAL 66.A O no hydrogen 2.959 N/A VAL 9.A N PHE 138.A O no hydrogen 2.909 N/A GLY 10.A N VAL 68.A O no hydrogen 2.711 N/A VAL 14.A N GLY 10.A O no hydrogen 2.959 N/A GLN 15.A N GLN 11.A O no hydrogen 2.905 N/A ILE 16.A N ALA 12.A O no hydrogen 2.940 N/A GLY 17.A N GLY 13.A O no hydrogen 2.846 N/A ASN 18.A N VAL 14.A O no hydrogen 2.916 N/A CYS 20.A N ILE 16.A O no hydrogen 2.885 N/A CYS 20.A SG ILE 16.A O no hydrogen 3.251 N/A TRP 21.A N GLY 17.A O no hydrogen 2.894 N/A GLU 22.A N ASN 18.A O no hydrogen 2.921 N/A LEU 23.A N CYS 20.A O no hydrogen 3.184 N/A TYR 24.A N CYS 20.A O no hydrogen 2.913 N/A TYR 24.A OH THR 239.A OG1 no hydrogen 3.064 N/A CYS 25.A N TRP 21.A O no hydrogen 2.896 N/A CYS 25.A SG TRP 21.A O no hydrogen 3.138 N/A GLU 27.A N LEU 23.A O no hydrogen 2.934 N/A GLY 29.A N CYS 25.A O no hydrogen 3.196 N/A GLN 31.A N GLN 35.A O no hydrogen 2.954 N/A GLN 31.A NE2 ASP 33.A OD1 no hydrogen 3.287 N/A GLY 34.A N GLN 31.A O no hydrogen 2.916 N/A THR 41.A N SER 38.A O no hydrogen 2.913 N/A THR 41.A OG1 SER 38.A O no hydrogen 2.420 N/A ILE 42.A N ASP 39.A O no hydrogen 3.053 N/A GLY 43.A N ASP 39.A O no hydrogen 2.940 N/A SER 48.A OG HIS 61.A NE2 no hydrogen 2.750 N/A THR 51.A OG1 ARG 2.A O no hydrogen 2.717 N/A SER 54.A N VAL 62.A O no hydrogen 2.536 N/A SER 54.A OG GLU 55.A O no hydrogen 3.242 N/A THR 56.A OG1 LYS 60.A O no hydrogen 2.759 N/A LYS 60.A NZ ASP 33.A O no hydrogen 2.589 N/A LYS 60.A NZ GLN 85.A O no hydrogen 2.552 N/A HIS 61.A N GLY 34.A O no hydrogen 3.078 N/A HIS 61.A ND1 GLY 59.A O no hydrogen 2.640 N/A VAL 62.A N SER 54.A O no hydrogen 3.347 N/A ARG 64.A N PHE 52.A O no hydrogen 2.652 N/A ARG 64.A NE THR 51.A O no hydrogen 3.459 N/A ARG 64.A NH2 ASN 50.A O no hydrogen 2.799 N/A VAL 66.A N SER 6.A O no hydrogen 2.925 N/A VAL 68.A N HIS 8.A O no hydrogen 3.049 N/A ASP 76.A N PRO 72.A O no hydrogen 3.003 N/A GLU 77.A N VAL 74.A O no hydrogen 3.007 N/A ARG 79.A N ILE 75.A O no hydrogen 2.972 N/A THR 80.A N ASP 76.A O no hydrogen 2.903 N/A THR 80.A OG1 ASP 76.A O no hydrogen 3.070 N/A GLY 81.A N VAL 78.A O no hydrogen 3.170 N/A ARG 84.A NH1 GLY 81.A O no hydrogen 3.464 N/A GLU 90.A N HIS 88.A O no hydrogen 2.561 N/A LEU 92.A N PHE 67.A O no hydrogen 2.599 N/A LYS 96.A N THR 94.A O no hydrogen 2.840 N/A ASP 98.A N GLU 97.A OE1 no hydrogen 2.983 N/A ASN 102.A N ALA 99.A O no hydrogen 3.007 N/A TYR 103.A N ASN 186.A OD1 no hydrogen 3.101 N/A ARG 105.A N ASN 102.A OD1 no hydrogen 3.046 N/A ARG 105.A NE ASP 98.A O no hydrogen 2.916 N/A ARG 105.A NH1 GLU 411.A OE1 no hydrogen 2.457 N/A ARG 105.A NH2 ASP 98.A O no hydrogen 3.224 N/A HIS 107.A N TYR 103.A O no hydrogen 3.278 N/A TYR 108.A N ALA 104.A O no hydrogen 3.087 N/A THR 109.A OG1 ARG 105.A O no hydrogen 3.522 N/A ILE 110.A N ARG 105.A O no hydrogen 2.703 N/A GLY 111.A N ARG 105.A O no hydrogen 2.850 N/A LYS 112.A N TYR 108.A O no hydrogen 3.459 N/A ILE 114.A N GLY 111.A O no hydrogen 3.239 N/A LEU 119.A N ILE 115.A O no hydrogen 2.982 N/A ASP 120.A N ASP 116.A O no hydrogen 2.903 N/A ARG 121.A N LEU 117.A O no hydrogen 2.932 N/A ARG 121.A NH2 GLU 90.A OE1 no hydrogen 3.446 N/A ILE 122.A N VAL 118.A O no hydrogen 2.938 N/A ARG 123.A N LEU 119.A O no hydrogen 2.912 N/A LYS 124.A N ASP 120.A O no hydrogen 2.883 N/A LEU 125.A N ARG 121.A O no hydrogen 2.917 N/A ALA 126.A N ILE 122.A O no hydrogen 2.904 N/A ALA 126.A N ARG 123.A O no hydrogen 3.214 N/A ASP 127.A N ARG 123.A O no hydrogen 3.066 N/A CYS 129.A N ALA 126.A O no hydrogen 2.864 N/A CYS 129.A SG LEU 125.A O no hydrogen 3.513 N/A THR 130.A N GLU 3.A OE1 no hydrogen 2.998 N/A GLN 133.A N GLU 3.A O no hydrogen 2.906 N/A PHE 135.A N SER 165.A O no hydrogen 2.923 N/A LEU 136.A N ILE 5.A O no hydrogen 2.884 N/A VAL 137.A N LEU 167.A O no hydrogen 2.905 N/A PHE 138.A N ILE 7.A O no hydrogen 2.896 N/A GLY 142.A N SER 147.A OG no hydrogen 3.334 N/A THR 145.A OG1 ASP 69.A O no hydrogen 3.348 N/A SER 147.A OG GLY 143.A O no hydrogen 2.507 N/A GLY 148.A N GLY 144.A O no hydrogen 2.804 N/A THR 150.A N THR 145.A O no hydrogen 3.347 N/A THR 150.A OG1 GLY 146.A O no hydrogen 2.337 N/A SER 151.A OG SER 147.A O no hydrogen 2.842 N/A LEU 152.A N GLY 148.A O no hydrogen 2.935 N/A LEU 153.A N PHE 149.A O no hydrogen 2.875 N/A MET 154.A N THR 150.A O no hydrogen 2.903 N/A GLU 155.A N SER 151.A O no hydrogen 2.899 N/A ARG 156.A N LEU 152.A O no hydrogen 2.959 N/A LEU 157.A N LEU 153.A O no hydrogen 2.855 N/A SER 158.A N MET 154.A O no hydrogen 2.937 N/A SER 158.A OG MET 154.A O no hydrogen 3.523 N/A SER 158.A OG GLU 155.A O no hydrogen 3.478 N/A SER 158.A OG HIS 197.A ND1 no hydrogen 2.574 N/A VAL 159.A N ARG 156.A O no hydrogen 3.296 N/A ASP 160.A N ARG 156.A O no hydrogen 2.917 N/A TYR 161.A N LEU 157.A O no hydrogen 2.727 N/A GLY 162.A N LEU 157.A O no hydrogen 3.342 N/A LYS 164.A N GLY 162.A O no hydrogen 2.646 N/A LYS 166.A NZ LYS 164.A O no hydrogen 2.902 N/A GLU 168.A N CYS 200.A O no hydrogen 2.994 N/A PHE 169.A N VAL 137.A O no hydrogen 2.894 N/A SER 170.A N PHE 202.A O no hydrogen 3.152 N/A SER 170.A OG PHE 202.A O no hydrogen 2.692 N/A TYR 172.A N VAL 204.A O no hydrogen 2.601 N/A SER 178.A OG VAL 177.A O no hydrogen 2.324 N/A SER 178.A OG GLU 183.A OE1 no hydrogen 3.323 N/A TYR 185.A OH ALA 403.A O no hydrogen 3.415 N/A ASN 186.A ND2 ASN 101.A O no hydrogen 2.710 N/A ASN 186.A ND2 GLY 142.A O no hydrogen 3.048 N/A SER 187.A N GLU 183.A O no hydrogen 2.911 N/A ILE 188.A N PRO 184.A O no hydrogen 2.944 N/A LEU 189.A N TYR 185.A O no hydrogen 3.476 N/A THR 190.A N ASN 186.A O no hydrogen 2.892 N/A THR 190.A OG1 SER 147.A O no hydrogen 3.296 N/A THR 190.A OG1 ASN 186.A O no hydrogen 2.555 N/A THR 191.A N SER 187.A O no hydrogen 2.931 N/A THR 191.A OG1 SER 187.A O no hydrogen 2.987 N/A HIS 192.A N ILE 188.A O no hydrogen 2.952 N/A HIS 192.A NE2 GLU 420.A OE2 no hydrogen 3.084 N/A THR 193.A N THR 190.A O no hydrogen 3.264 N/A THR 193.A OG1 TYR 103.A OH no hydrogen 3.282 N/A THR 193.A OG1 LEU 189.A O no hydrogen 3.250 N/A THR 194.A N THR 190.A O no hydrogen 2.917 N/A THR 194.A OG1 THR 190.A O no hydrogen 2.578 N/A THR 194.A OG1 THR 191.A O no hydrogen 3.386 N/A LEU 195.A N THR 191.A O no hydrogen 2.729 N/A HIS 197.A ND1 SER 158.A OG no hydrogen 2.574 N/A SER 198.A N THR 194.A O no hydrogen 3.141 N/A SER 198.A OG THR 194.A O no hydrogen 2.574 N/A SER 198.A OG HIS 266.A NE2 no hydrogen 2.400 N/A ALA 201.A N HIS 266.A O no hydrogen 2.864 N/A PHE 202.A N GLU 168.A O no hydrogen 2.773 N/A VAL 204.A N SER 170.A O no hydrogen 2.962 N/A GLU 207.A N ASP 205.A OD2 no hydrogen 3.335 N/A TYR 210.A N ASN 206.A O no hydrogen 3.249 N/A ASP 211.A N GLU 207.A O no hydrogen 2.997 N/A ILE 212.A N ALA 208.A O no hydrogen 2.902 N/A CYS 213.A N ILE 209.A O no hydrogen 2.840 N/A CYS 213.A SG ILE 209.A O no hydrogen 3.043 N/A ARG 214.A N TYR 210.A O no hydrogen 3.014 N/A ARG 215.A N ASP 211.A O no hydrogen 2.937 N/A ARG 215.A NE ALA 299.A O no hydrogen 3.433 N/A ARG 215.A NH2 ALA 299.A O no hydrogen 3.258 N/A ASN 216.A N ILE 212.A O no hydrogen 2.685 N/A ASN 216.A ND2 ASN 300.A OD1 no hydrogen 3.693 N/A ILE 219.A N CYS 213.A O no hydrogen 2.576 N/A THR 223.A N ASN 226.A OD1 no hydrogen 3.191 N/A THR 223.A OG1 ASN 226.A OD1 no hydrogen 3.513 N/A THR 225.A N THR 223.A OG1 no hydrogen 3.036 N/A THR 225.A OG1 THR 223.A OG1 no hydrogen 2.181 N/A LEU 227.A N TYR 224.A O no hydrogen 3.136 N/A ASN 228.A N TYR 224.A O no hydrogen 2.937 N/A ASN 228.A ND2 GLN 15.A O no hydrogen 2.620 N/A ARG 229.A N THR 225.A O no hydrogen 2.915 N/A ARG 229.A NH2 GLU 22.A OE2 no hydrogen 3.290 N/A LEU 230.A N LEU 227.A O no hydrogen 3.104 N/A ILE 231.A N LEU 227.A O no hydrogen 2.956 N/A SER 232.A N ASN 228.A O no hydrogen 2.913 N/A SER 232.A OG ASN 228.A O no hydrogen 3.263 N/A SER 232.A OG ARG 229.A O no hydrogen 3.061 N/A GLN 233.A NE2 THR 361.A O no hydrogen 3.291 N/A VAL 235.A N ILE 231.A O no hydrogen 3.017 N/A SER 236.A N SER 232.A O no hydrogen 2.879 N/A SER 236.A OG GLU 27.A OE2 no hydrogen 2.914 N/A SER 237.A N GLN 233.A O no hydrogen 2.884 N/A SER 237.A OG GLN 233.A O no hydrogen 2.956 N/A ILE 238.A N ILE 234.A O no hydrogen 2.968 N/A THR 239.A N VAL 235.A O no hydrogen 2.936 N/A THR 239.A OG1 TYR 24.A OH no hydrogen 3.064 N/A THR 239.A OG1 VAL 235.A O no hydrogen 3.053 N/A THR 239.A OG1 SER 236.A O no hydrogen 3.496 N/A SER 241.A OG VAL 250.A O no hydrogen 3.014 N/A LEU 242.A N THR 239.A O no hydrogen 3.196 N/A ARG 243.A N THR 239.A O no hydrogen 3.370 N/A ARG 243.A NE THR 239.A O no hydrogen 3.222 N/A ARG 243.A NH1 SER 236.A OG no hydrogen 3.041 N/A ARG 243.A NH2 SER 236.A OG no hydrogen 2.574 N/A PHE 244.A N ALA 240.A O no hydrogen 2.945 N/A VAL 250.A N SER 241.A OG no hydrogen 3.193 N/A LEU 252.A N GLN 133.A OE1 no hydrogen 3.098 N/A THR 257.A OG1 THR 253.A O no hydrogen 3.226 N/A ASN 258.A N PHE 255.A O no hydrogen 3.194 N/A ASN 258.A ND2 GLU 254.A O no hydrogen 2.944 N/A LEU 259.A N PHE 255.A O no hydrogen 2.985 N/A ARG 264.A NH2 ASP 424.A O no hydrogen 2.895 N/A ILE 265.A N TYR 262.A O no hydrogen 3.328 N/A HIS 266.A ND1 PRO 263.A O no hydrogen 2.680 N/A LEU 269.A N SER 379.A O no hydrogen 2.780 N/A THR 271.A OG1 ASN 300.A O no hydrogen 2.420 N/A LYS 280.A NZ ASN 216.A O no hydrogen 3.068 N/A LYS 280.A NZ ASP 218.A OD2 no hydrogen 2.764 N/A GLU 290.A N SER 287.A O no hydrogen 3.273 N/A ILE 291.A N SER 287.A O no hydrogen 3.254 N/A THR 292.A N VAL 288.A O no hydrogen 2.926 N/A THR 292.A OG1 VAL 288.A O no hydrogen 3.061 N/A THR 292.A OG1 TYR 319.A OH no hydrogen 2.709 N/A ALA 294.A N GLU 290.A O no hydrogen 2.922 N/A CYS 295.A N ILE 291.A O no hydrogen 2.887 N/A CYS 295.A SG ILE 291.A O no hydrogen 3.092 N/A GLU 297.A N ASN 293.A O no hydrogen 2.605 N/A ARG 308.A NE ASP 306.A OD1 no hydrogen 2.969 N/A ARG 308.A NH2 ASP 306.A OD1 no hydrogen 3.441 N/A ARG 308.A NH2 ASP 306.A OD2 no hydrogen 3.071 N/A HIS 309.A N ASP 306.A O no hydrogen 3.039 N/A GLY 310.A N PRO 307.A O no hydrogen 2.744 N/A LYS 311.A N THR 382.A OG1 no hydrogen 2.604 N/A LYS 311.A NZ GLY 436.A O no hydrogen 3.239 N/A MET 313.A N ASN 380.A O no hydrogen 2.900 N/A CYS 315.A SG GLY 350.A O no hydrogen 3.108 N/A CYS 316.A N LEU 378.A O no hydrogen 3.028 N/A CYS 316.A SG LYS 352.A O no hydrogen 3.982 N/A LEU 317.A N LYS 352.A O no hydrogen 2.988 N/A LEU 318.A N CYS 376.A O no hydrogen 2.940 N/A TYR 319.A N GLY 354.A O no hydrogen 2.712 N/A TYR 319.A OH THR 292.A OG1 no hydrogen 2.709 N/A ARG 320.A N ALA 374.A O no hydrogen 3.039 N/A ARG 320.A NH1 SER 237.A OG no hydrogen 3.119 N/A ARG 320.A NH2 SER 236.A OG no hydrogen 3.308 N/A GLY 321.A N ASN 356.A O no hydrogen 2.950 N/A ASP 322.A N GLN 372.A O no hydrogen 3.163 N/A VAL 323.A N GLY 321.A O no hydrogen 2.732 N/A ASP 327.A N VAL 324.A O no hydrogen 3.269 N/A ASN 329.A N PRO 325.A O no hydrogen 2.957 N/A ALA 330.A N LYS 326.A O no hydrogen 2.936 N/A ALA 331.A N ASP 327.A O no hydrogen 2.912 N/A ILE 332.A N VAL 328.A O no hydrogen 2.900 N/A ALA 333.A N ASN 329.A O no hydrogen 2.918 N/A THR 334.A N ALA 330.A O no hydrogen 2.922 N/A THR 334.A OG1 ALA 330.A O no hydrogen 2.579 N/A ILE 335.A N ALA 331.A O no hydrogen 2.924 N/A LYS 336.A N ILE 332.A O no hydrogen 2.902 N/A LYS 336.A NZ PRO 348.A O no hydrogen 3.357 N/A LYS 336.A NZ THR 349.A O no hydrogen 3.335 N/A THR 337.A N ALA 333.A O no hydrogen 2.931 N/A THR 337.A N THR 334.A O no hydrogen 3.143 N/A THR 337.A OG1 ALA 333.A O no hydrogen 2.957 N/A PHE 343.A N GLN 342.A OE1 no hydrogen 3.270 N/A TRP 346.A NE1 VAL 435.A O no hydrogen 2.917 N/A CYS 347.A N VAL 344.A O no hydrogen 3.346 N/A CYS 347.A SG MET 313.A O no hydrogen 3.443 N/A PHE 351.A N THR 349.A O no hydrogen 2.912 N/A LYS 352.A N CYS 315.A O no hydrogen 2.893 N/A LYS 352.A NZ GLU 254.A OE1 no hydrogen 3.139 N/A GLY 354.A N LEU 317.A O no hydrogen 3.021 N/A ILE 355.A N LEU 248.A O no hydrogen 3.308 N/A ASN 356.A ND2 ALA 240.A O no hydrogen 3.007 N/A GLN 358.A N ASN 356.A OD1 no hydrogen 2.988 N/A VAL 362.A N THR 361.A OG1 no hydrogen 2.865 N/A ARG 373.A NE ASP 322.A O no hydrogen 2.999 N/A ARG 373.A NH2 ASP 322.A O no hydrogen 3.280 N/A ALA 374.A N ARG 320.A O no hydrogen 2.959 N/A CYS 376.A N LEU 318.A O no hydrogen 3.215 N/A MET 377.A N THR 271.A O no hydrogen 3.267 N/A LEU 378.A N CYS 316.A O no hydrogen 2.902 N/A ASN 380.A ND2 LEU 259.A O no hydrogen 2.611 N/A ASN 380.A ND2 ILE 265.A O no hydrogen 2.857 N/A THR 382.A N LYS 311.A O no hydrogen 3.376 N/A ALA 383.A N THR 381.A OG1 no hydrogen 3.215 N/A GLU 386.A N ALA 383.A O no hydrogen 3.002 N/A ALA 387.A N ILE 384.A O no hydrogen 3.139 N/A TRP 388.A N ILE 384.A O no hydrogen 3.293 N/A ALA 389.A N ALA 385.A O no hydrogen 2.895 N/A ARG 390.A N GLU 386.A O no hydrogen 2.912 N/A LEU 391.A N ALA 387.A O no hydrogen 2.945 N/A ASP 392.A N TRP 388.A O no hydrogen 2.897 N/A HIS 393.A N ALA 389.A O no hydrogen 2.926 N/A LYS 394.A N ARG 390.A O no hydrogen 2.987 N/A LYS 394.A NZ PRO 175.A O no hydrogen 3.123 N/A PHE 395.A N LEU 391.A O no hydrogen 2.909 N/A ASP 396.A N ASP 392.A O no hydrogen 2.881 N/A LEU 397.A N HIS 393.A O no hydrogen 2.921 N/A MET 398.A N LYS 394.A O no hydrogen 2.993 N/A TYR 399.A N PHE 395.A O no hydrogen 2.827 N/A TYR 399.A OH SER 419.A OG no hydrogen 2.759 N/A ALA 400.A N ASP 396.A O no hydrogen 2.934 N/A ARG 402.A N TYR 399.A O no hydrogen 3.090 N/A ARG 402.A NE GLU 415.A OE1 no hydrogen 2.941 N/A ARG 402.A NH1 TYR 399.A O no hydrogen 3.509 N/A ALA 403.A N MET 398.A O no hydrogen 3.177 N/A TYR 408.A N VAL 405.A O no hydrogen 2.880 N/A TYR 408.A OH ASN 186.A OD1 no hydrogen 3.196 N/A VAL 409.A N VAL 405.A O no hydrogen 2.971 N/A GLY 410.A N HIS 406.A O no hydrogen 2.938 N/A GLU 411.A N TYR 408.A O no hydrogen 2.960 N/A GLY 416.A N GLU 414.A OE2 no hydrogen 3.145 N/A GLU 417.A N GLU 414.A O no hydrogen 2.664 N/A SER 419.A N GLU 415.A O no hydrogen 3.070 N/A SER 419.A OG TYR 399.A OH no hydrogen 2.759 N/A GLU 420.A N GLY 416.A O no hydrogen 2.856 N/A ALA 421.A N GLU 417.A O no hydrogen 2.875 N/A ARG 422.A N PHE 418.A O no hydrogen 2.928 N/A ARG 422.A NE ASP 396.A OD1 no hydrogen 2.843 N/A ARG 422.A NE ASP 396.A OD2 no hydrogen 3.420 N/A ARG 422.A NH2 ASP 396.A OD2 no hydrogen 2.854 N/A GLU 423.A N SER 419.A O no hydrogen 2.983 N/A ASP 424.A N GLU 420.A O no hydrogen 3.374 N/A MET 425.A N ARG 422.A O no hydrogen 2.865 N/A ALA 426.A N ARG 422.A O no hydrogen 3.134 N/A ALA 427.A N GLU 423.A O no hydrogen 2.938 N/A GLU 429.A N MET 425.A O no hydrogen 2.890 N/A LYS 430.A N ALA 426.A O no hydrogen 2.919 N/A LYS 430.A N ALA 427.A O no hydrogen 3.256 N/A LYS 430.A NZ GLU 434.A OE2 no hydrogen 3.362 N/A ASP 431.A N ALA 427.A O no hydrogen 2.877 N/A TYR 432.A N LEU 428.A O no hydrogen 2.925 N/A GLU 434.A N LYS 430.A O no hydrogen 2.865 N/A VAL 435.A N ASP 431.A O no hydrogen 2.924 N/A VAL 437.A N GLU 434.A O no hydrogen 3.429 N/A SER 439.A N ASP 345.A OD2 no hydrogen 2.611 N/A SER 439.A OG ASP 345.A OD2 no hydrogen 2.685 N/A