Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s58_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 8.A OG MET 6.A O no hydrogen 2.715 N/A GLY 10.A N THR 21.A O no hydrogen 2.633 N/A THR 12.A N THR 19.A O no hydrogen 2.996 N/A THR 12.A OG1 THR 19.A OG1 no hydrogen 2.969 N/A SER 14.A OG SER 17.A O no hydrogen 2.317 N/A SER 17.A N SER 14.A O no hydrogen 2.541 N/A VAL 18.A N PHE 461.A O no hydrogen 3.160 N/A THR 19.A N THR 12.A O no hydrogen 3.176 N/A THR 19.A OG1 THR 12.A OG1 no hydrogen 2.969 N/A CYS 20.A N MET 459.A O no hydrogen 2.589 N/A THR 21.A N GLY 10.A O no hydrogen 3.038 N/A THR 21.A OG1 VAL 457.A O no hydrogen 2.892 N/A THR 21.A OG1 THR 458.A OG1 no hydrogen 2.990 N/A PHE 22.A N VAL 457.A O no hydrogen 3.075 N/A ARG 24.A N MET 455.A O no hydrogen 3.123 N/A GLN 25.A N GLN 25.A OE1 no hydrogen 2.770 N/A LEU 27.A N TYR 161.A O no hydrogen 2.885 N/A ILE 28.A N ALA 451.A O no hydrogen 2.617 N/A TYR 30.A OH THR 446.A O no hydrogen 2.270 N/A GLU 33.A N ASP 31.A OD2 no hydrogen 2.770 N/A HIS 35.A ND1 HIS 35.A O no hydrogen 2.664 N/A LYS 37.A NZ GLU 33.A OE1 no hydrogen 2.903 N/A SER 40.A OG SER 40.A O no hydrogen 2.671 N/A SER 45.A OG ASN 48.A O no hydrogen 2.997 N/A CYS 46.A N SER 45.A OG no hydrogen 2.428 N/A ASN 48.A ND2 GLY 181.A O no hydrogen 2.590 N/A SER 50.A OG ASN 48.A OD1 no hydrogen 3.181 N/A LYS 55.A NZ GLU 53.A OE1 no hydrogen 3.211 N/A THR 60.A N THR 58.A O no hydrogen 2.727 N/A TYR 65.A N TYR 168.A O no hydrogen 3.249 N/A SER 66.A N TYR 36.A O no hydrogen 2.586 N/A SER 66.A OG TYR 36.A O no hydrogen 3.403 N/A TRP 69.A NE1 GLU 197.A OE1 no hydrogen 3.022 N/A TRP 69.A NE1 GLU 197.A OE2 no hydrogen 2.202 N/A ASP 73.A N TYR 161.A OH no hydrogen 2.938 N/A PHE 74.A N ASP 73.A OD2 no hydrogen 2.522 N/A ASN 75.A N ASP 73.A OD2 no hydrogen 2.551 N/A ASN 75.A ND2 TRP 396.A O no hydrogen 2.600 N/A ALA 76.A N PHE 74.A O no hydrogen 2.171 N/A LEU 77.A N SER 393.A O no hydrogen 3.064 N/A GLU 85.A N SER 82.A O no hydrogen 2.723 N/A GLN 87.A N PRO 83.A O no hydrogen 2.487 N/A HIS 88.A N LEU 84.A O no hydrogen 3.143 N/A LEU 89.A N GLU 85.A O no hydrogen 3.170 N/A ILE 90.A N PHE 86.A O no hydrogen 2.939 N/A GLU 91.A N GLN 87.A O no hydrogen 2.920 N/A GLU 91.A N HIS 88.A O no hydrogen 2.757 N/A ASN 92.A N HIS 88.A O no hydrogen 2.982 N/A ASN 92.A N LEU 89.A O no hydrogen 3.221 N/A ASN 92.A ND2 HIS 88.A ND1 no hydrogen 2.662 N/A ASN 92.A ND2 HIS 88.A O no hydrogen 3.204 N/A TYR 93.A N LEU 89.A O no hydrogen 3.030 N/A ASP 99.A N THR 460.A O no hydrogen 2.536 N/A ALA 100.A N THR 460.A OG1 no hydrogen 2.866 N/A LEU 101.A N TYR 214.A O no hydrogen 2.974 N/A THR 102.A N THR 458.A O no hydrogen 2.800 N/A THR 102.A OG1 MET 212.A O no hydrogen 2.896 N/A VAL 103.A N MET 212.A O no hydrogen 3.247 N/A THR 104.A N THR 456.A O no hydrogen 2.756 N/A THR 104.A OG1 THR 456.A O no hydrogen 3.348 N/A ILE 105.A N ALA 210.A O no hydrogen 3.237 N/A SER 106.A N ILE 454.A O no hydrogen 3.316 N/A LYS 111.A NZ ASP 125.A OD1 no hydrogen 2.497 N/A VAL 113.A N VAL 448.A O no hydrogen 2.969 N/A THR 114.A N GLN 122.A O no hydrogen 2.760 N/A THR 114.A OG1 GLN 122.A O no hydrogen 3.560 N/A LYS 116.A NZ GLN 122.A OE1 no hydrogen 3.550 N/A GLN 122.A N THR 114.A O no hydrogen 2.964 N/A THR 124.A N ASP 112.A O no hydrogen 3.087 N/A THR 124.A OG1 ASP 112.A OD1 no hydrogen 3.439 N/A SER 126.A OG ASP 112.A OD2 no hydrogen 3.124 N/A SER 126.A OG ALA 127.A O no hydrogen 2.822 N/A GLY 129.A N ALA 127.A O no hydrogen 2.069 N/A LEU 131.A N LEU 204.A O no hydrogen 3.295 N/A MET 133.A N GLN 202.A O no hydrogen 2.860 N/A LEU 134.A N PHE 426.A O no hydrogen 3.066 N/A ASP 136.A N GLN 424.A O no hydrogen 3.046 N/A TYR 139.A N ASP 136.A OD2 no hydrogen 2.805 N/A TYR 139.A OH PRO 421.A O no hydrogen 2.405 N/A TYR 141.A OH LEU 196.A O no hydrogen 3.053 N/A TYR 141.A OH SER 199.A OG no hydrogen 2.895 N/A GLN 147.A N VAL 144.A O no hydrogen 3.148 N/A THR 151.A OG1 GLN 149.A O no hydrogen 2.507 N/A TYR 161.A OH ASP 73.A O no hydrogen 2.819 N/A TYR 166.A N TRP 69.A O no hydrogen 2.540 N/A TYR 166.A OH PRO 142.A O no hydrogen 2.177 N/A TYR 168.A N TYR 65.A O no hydrogen 2.896 N/A TYR 168.A OH ALA 192.A O no hydrogen 2.819 N/A THR 170.A OG1 ALA 192.A O no hydrogen 2.598 N/A ASN 175.A N LYS 184.A O no hydrogen 2.724 N/A SER 183.A N HIS 47.A O no hydrogen 3.105 N/A LYS 184.A N ASN 175.A O no hydrogen 2.639 N/A LEU 186.A N ASP 173.A O no hydrogen 2.345 N/A SER 188.A N SER 191.A OG no hydrogen 2.775 N/A SER 191.A N GLU 189.A O no hydrogen 2.364 N/A SER 191.A OG VAL 171.A O no hydrogen 2.470 N/A GLU 197.A N TYR 36.A OH no hydrogen 3.401 N/A HIS 198.A N VAL 195.A O no hydrogen 2.741 N/A SER 199.A OG TYR 141.A OH no hydrogen 2.895 N/A SER 199.A OG LEU 196.A O no hydrogen 3.303 N/A SER 199.A OG SER 199.A O no hydrogen 2.495 N/A GLN 202.A N MET 133.A O no hydrogen 2.991 N/A GLY 207.A N ILE 108.A O no hydrogen 3.256 N/A GLY 208.A N THR 206.A O no hydrogen 2.560 N/A THR 211.A OG1 ALA 210.A O no hydrogen 2.549 N/A TYR 214.A N LEU 101.A O no hydrogen 3.242 N/A GLU 222.A N ILE 96.A O no hydrogen 2.957 N/A GLU 225.A N ASN 223.A OD1 no hydrogen 2.417 N/A CYS 227.A SG ASN 345.A OD1 no hydrogen 3.703 N/A SER 228.A N HIS 521.A O no hydrogen 2.737 N/A SER 228.A OG HIS 521.A O no hydrogen 2.850 N/A GLN 229.A N CYS 227.A O no hydrogen 2.321 N/A PHE 231.A N GLN 349.A OE1 no hydrogen 2.384 N/A GLU 233.A N HIS 230.A O no hydrogen 2.568 N/A TYR 239.A N ASN 236.A O no hydrogen 2.898 N/A ARG 242.A N SER 241.A OG no hydrogen 2.634 N/A GLY 244.A N PHE 255.A O no hydrogen 3.048 N/A GLY 244.A N ARG 256.A O no hydrogen 3.205 N/A GLY 251.A N LEU 249.A O no hydrogen 2.673 N/A SER 257.A OG ARG 256.A O no hydrogen 2.283 N/A SER 257.A OG ASP 262.A OD1 no hydrogen 2.910 N/A LEU 258.A N ASP 262.A OD1 no hydrogen 2.760 N/A GLU 261.A N LEU 258.A O no hydrogen 2.783 N/A ILE 265.A N ASP 262.A O no hydrogen 2.608 N/A LEU 275.A N ARG 376.A O no hydrogen 3.222 N/A ASN 277.A N ILE 374.A O no hydrogen 2.768 N/A ASN 277.A ND2 VAL 276.A O no hydrogen 3.007 N/A VAL 279.A N ASN 277.A OD1 no hydrogen 3.119 N/A SER 286.A OG ASN 319.A OD1 no hydrogen 2.404 N/A THR 287.A OG1 GLY 288.A O no hydrogen 2.667 N/A THR 287.A OG1 SER 296.A O no hydrogen 2.425 N/A THR 289.A OG1 THR 287.A O no hydrogen 3.360 N/A SER 290.A OG THR 289.A O no hydrogen 2.573 N/A THR 293.A OG1 GLN 291.A O no hydrogen 3.361 N/A SER 296.A OG ILE 295.A O no hydrogen 2.463 N/A ARG 298.A NE LEU 297.A O no hydrogen 2.602 N/A ARG 298.A NH2 SER 296.A O no hydrogen 3.227 N/A ARG 298.A NH2 LEU 297.A O no hydrogen 3.422 N/A SER 303.A OG PRO 274.A O no hydrogen 2.931 N/A GLN 304.A N PRO 301.A O no hydrogen 3.115 N/A HIS 308.A ND1 HIS 307.A O no hydrogen 2.284 N/A LYS 313.A NZ THR 311.A OG1 no hydrogen 3.416 N/A VAL 315.A N LYS 313.A O no hydrogen 3.072 N/A THR 316.A OG1 TYR 314.A O no hydrogen 3.295 N/A THR 316.A OG1 VAL 315.A O no hydrogen 2.457 N/A THR 316.A OG1 GLN 337.A OE1 no hydrogen 3.437 N/A SER 322.A OG GLN 338.A O no hydrogen 2.945 N/A SER 322.A OG GLY 339.A O no hydrogen 2.500 N/A GLN 325.A NE2 GLU 332.A O no hydrogen 2.571 N/A THR 327.A OG1 GLN 325.A O no hydrogen 3.262 N/A GLN 349.A N GLU 346.A O no hydrogen 2.700 N/A GLN 349.A NE2 GLN 229.A O no hydrogen 3.292 N/A LEU 350.A N LYS 347.A O no hydrogen 2.730 N/A THR 367.A OG1 ASN 364.A O no hydrogen 2.943 N/A GLN 373.A N GLN 373.A OE1 no hydrogen 2.645 N/A ARG 376.A NH1 LEU 350.A O no hydrogen 2.534 N/A SER 382.A OG MET 379.A O no hydrogen 2.890 N/A ARG 386.A NE GLU 222.A OE1 no hydrogen 3.284 N/A ARG 387.A NE ALA 412.A O no hydrogen 3.453 N/A ARG 387.A NH1 PRO 301.A O no hydrogen 3.023 N/A ARG 387.A NH2 GLY 300.A O no hydrogen 2.505 N/A ARG 387.A NH2 ALA 412.A O no hydrogen 3.230 N/A TYR 391.A OH PHE 81.A O no hydrogen 2.947 N/A SER 393.A OG GLN 394.A O no hydrogen 2.677 N/A GLN 394.A NE2 GLY 146.A O no hydrogen 2.484 N/A LEU 395.A N ASN 75.A OD1 no hydrogen 2.745 N/A SER 397.A N TRP 416.A O no hydrogen 2.295 N/A SER 397.A OG GLN 147.A OE1 no hydrogen 3.259 N/A LYS 398.A NZ ILE 399.A O no hydrogen 3.407 N/A LYS 398.A NZ ASN 401.A OD1 no hydrogen 2.554 N/A SER 405.A OG LEU 402.A O no hydrogen 3.215 N/A SER 405.A OG ASP 403.A O no hydrogen 2.906 N/A SER 405.A OG ASP 404.A O no hydrogen 2.546 N/A THR 408.A OG1 SER 405.A O no hydrogen 2.312 N/A ALA 411.A N GLY 415.A O no hydrogen 3.032 N/A GLY 414.A N ALA 411.A O no hydrogen 2.500 N/A TRP 416.A N LEU 395.A O no hydrogen 2.833 N/A TRP 416.A NE1 PRO 220.A O no hydrogen 2.926 N/A GLY 417.A N GLN 409.A O no hydrogen 2.757 N/A LEU 418.A N SER 397.A O no hydrogen 3.253 N/A HIS 419.A N HIS 419.A ND1 no hydrogen 2.475 N/A GLN 424.A NE2 TYR 141.A O no hydrogen 3.080 N/A LEU 427.A N ARG 70.A O no hydrogen 2.932 N/A LYS 428.A NZ GLU 197.A OE1 no hydrogen 2.969 N/A LEU 430.A N ARG 130.A O no hydrogen 3.039 N/A GLN 432.A N GLN 449.A OE1 no hydrogen 2.889 N/A GLY 438.A N SER 441.A OG no hydrogen 2.638 N/A THR 445.A N GLY 443.A O no hydrogen 2.589 N/A THR 445.A OG1 GLY 434.A O no hydrogen 3.380 N/A THR 445.A OG1 GLY 443.A O no hydrogen 3.564 N/A THR 446.A OG1 PRO 32.A O no hydrogen 2.941 N/A GLN 449.A NE2 GLN 432.A OE1 no hydrogen 2.459 N/A TYR 450.A N LYS 111.A O no hydrogen 2.989 N/A ALA 451.A N ILE 28.A O no hydrogen 3.424 N/A THR 458.A OG1 THR 21.A OG1 no hydrogen 2.990 N/A MET 459.A N CYS 20.A O no hydrogen 2.518 N/A THR 460.A N ALA 100.A O no hydrogen 3.014 N/A THR 460.A OG1 ALA 100.A O no hydrogen 2.393 N/A PHE 461.A N VAL 18.A O no hydrogen 3.069 N/A LYS 462.A N ALA 97.A O no hydrogen 2.785 N/A GLY 464.A N SER 95.A O no hydrogen 3.082 N/A LYS 467.A N GLU 225.A OE1 no hydrogen 3.315 N/A LYS 467.A NZ GLY 94.A O no hydrogen 3.345 N/A ARG 471.A NH1 ASN 473.A O no hydrogen 2.162 N/A GLN 475.A NE2 VAL 520.A O no hydrogen 2.864 N/A HIS 486.A N ALA 483.A O no hydrogen 2.951 N/A LEU 487.A N TYR 492.A OH no hydrogen 2.918 N/A TYR 489.A N GLU 508.A O no hydrogen 3.244 N/A TYR 492.A N HIS 505.A O no hydrogen 3.202 N/A THR 495.A N ASP 493.A OD1 no hydrogen 2.727 N/A THR 495.A OG1 ASP 493.A OD1 no hydrogen 2.946 N/A LYS 500.A N ASP 498.A OD1 no hydrogen 3.432 N/A HIS 502.A N LYS 500.A O no hydrogen 2.637 N/A HIS 503.A N THR 497.A OG1 no hydrogen 3.264 N/A THR 515.A OG1 LEU 513.A O no hydrogen 3.508 N/A LYS 517.A NZ ASN 385.A OD1 no hydrogen 3.219 N/A SER 518.A N ALA 516.A O no hydrogen 2.162 N/A SER 518.A OG THR 515.A O no hydrogen 3.490 N/A SER 518.A OG ALA 516.A O no hydrogen 2.892 N/A ARG 519.A NH2 GLU 91.A O no hydrogen 3.396 N/A