Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7du2_O.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 THR 1.A O no hydrogen 2.338 N/A THR 1.A OG1 GLU 4.A OE2 no hydrogen 2.829 N/A LYS 6.A N GLN 2.A O no hydrogen 2.915 N/A LEU 7.A N ALA 3.A O no hydrogen 3.275 N/A LEU 7.A N GLU 4.A O no hydrogen 3.102 N/A CYS 8.A N GLU 4.A O no hydrogen 3.240 N/A CYS 8.A SG GLU 4.A O no hydrogen 3.215 N/A SER 9.A N ILE 5.A O no hydrogen 3.190 N/A SER 9.A OG ILE 5.A O no hydrogen 2.960 N/A SER 9.A OG LYS 6.A O no hydrogen 2.440 N/A LEU 10.A N LYS 6.A O no hydrogen 3.204 N/A LEU 11.A N LEU 7.A O no hydrogen 2.549 N/A LEU 12.A N CYS 8.A O no hydrogen 3.477 N/A GLU 14.A N LEU 10.A O no hydrogen 3.348 N/A HIS 15.A ND1 LEU 11.A O no hydrogen 2.612 N/A PHE 16.A N LEU 12.A O no hydrogen 3.261 N/A GLY 17.A N LEU 12.A O no hydrogen 3.351 N/A LYS 22.A N GLU 18.A O no hydrogen 2.862 N/A LYS 22.A NZ THR 42.A O no hydrogen 2.904 N/A ILE 23.A N ILE 19.A O no hydrogen 2.892 N/A VAL 25.A N GLU 21.A O no hydrogen 2.401 N/A HIS 26.A N LYS 22.A O no hydrogen 2.906 N/A LEU 27.A N ILE 23.A O no hydrogen 3.315 N/A LEU 27.A N GLY 24.A O no hydrogen 3.126 N/A ILE 28.A N GLY 24.A O no hydrogen 3.245 N/A ARG 29.A N HIS 26.A O no hydrogen 2.910 N/A THR 30.A N HIS 26.A O no hydrogen 2.820 N/A THR 30.A OG1 HIS 26.A O no hydrogen 2.653 N/A THR 30.A OG1 GLN 33.A OE1 no hydrogen 2.690 N/A GLY 31.A N LEU 27.A O no hydrogen 2.898 N/A SER 32.A OG GLU 75.A OE1 no hydrogen 3.454 N/A GLN 33.A N TYR 74.A O no hydrogen 3.237 N/A ILE 38.A N PRO 34.A O no hydrogen 3.207 N/A ALA 39.A N LEU 35.A O no hydrogen 3.425 N/A HIS 40.A N ARG 36.A O no hydrogen 3.185 N/A HIS 40.A ND1 ARG 36.A O no hydrogen 2.391 N/A ASP 41.A N VAL 37.A O no hydrogen 3.127 N/A ASP 41.A N ILE 38.A O no hydrogen 3.322 N/A THR 42.A N ILE 38.A O no hydrogen 3.116 N/A THR 42.A OG1 ILE 38.A O no hydrogen 3.157 N/A THR 42.A OG1 THR 44.A OG1 no hydrogen 2.533 N/A THR 44.A N ALA 39.A O no hydrogen 3.187 N/A THR 44.A OG1 THR 42.A OG1 no hydrogen 2.533 N/A SER 45.A OG ASP 47.A OD1 no hydrogen 2.295 N/A SER 45.A OG GLN 48.A OE1 no hydrogen 3.281 N/A GLN 48.A N SER 45.A O no hydrogen 3.139 N/A VAL 49.A N SER 45.A O no hydrogen 3.233 N/A LYS 50.A N LEU 46.A O no hydrogen 3.241 N/A LYS 51.A N ASP 47.A O no hydrogen 3.414 N/A ALA 52.A N GLN 48.A O no hydrogen 2.891 N/A LEU 53.A N VAL 49.A O no hydrogen 2.918 N/A CYS 54.A N LYS 50.A O no hydrogen 3.234 N/A VAL 55.A N LYS 51.A O no hydrogen 3.065 N/A LEU 56.A N ALA 52.A O no hydrogen 3.124 N/A VAL 57.A N LEU 53.A O no hydrogen 2.821 N/A GLN 58.A N CYS 54.A O no hydrogen 3.307 N/A GLN 58.A NE2 ASN 112.A O no hydrogen 2.417 N/A GLN 58.A NE2 LYS 114.A O no hydrogen 3.347 N/A HIS 59.A N VAL 55.A O no hydrogen 3.277 N/A ASN 60.A N VAL 57.A O no hydrogen 3.356 N/A LEU 61.A N LEU 56.A O no hydrogen 2.958 N/A VAL 62.A N LEU 56.A O no hydrogen 3.355 N/A SER 63.A N GLU 75.A O no hydrogen 2.583 N/A SER 63.A OG GLU 75.A O no hydrogen 3.433 N/A HIS 67.A NE2 GLU 73.A OE1 no hydrogen 2.988 N/A GLU 75.A N SER 63.A O no hydrogen 2.709 N/A GLN 77.A N LEU 61.A O no hydrogen 3.349 N/A GLN 77.A N GLN 77.A OE1 no hydrogen 2.653 N/A ARG 80.A NH1 ARG 80.A O no hydrogen 3.067 N/A ARG 80.A NH1 TYR 87.A OH no hydrogen 3.374 N/A ARG 80.A NH2 TYR 87.A OH no hydrogen 2.943 N/A VAL 81.A N CYS 78.A O no hydrogen 3.111 N/A ARG 83.A N ARG 80.A O no hydrogen 2.969 N/A ARG 83.A NH2 GLU 433.A OE2 no hydrogen 3.238 N/A LEU 85.A N LEU 82.A O no hydrogen 3.216 N/A ARG 86.A N ARG 83.A O no hydrogen 3.129 N/A ARG 86.A NH1 HIS 191.A NE2 no hydrogen 3.042 N/A ARG 86.A NH2 GLU 433.A OE1 no hydrogen 2.945 N/A TYR 87.A N MET 84.A O no hydrogen 3.288 N/A TYR 90.A N ARG 86.A O no hydrogen 2.962 N/A TYR 90.A OH HIS 191.A NE2 no hydrogen 2.326 N/A ILE 91.A N TYR 87.A O no hydrogen 3.281 N/A TYR 92.A N ARG 89.A O no hydrogen 3.216 N/A THR 94.A N ILE 91.A O no hydrogen 3.294 N/A THR 94.A OG1 TYR 90.A O no hydrogen 3.076 N/A LYS 95.A N TYR 92.A O no hydrogen 2.793 N/A THR 96.A N TYR 92.A O no hydrogen 3.124 N/A THR 96.A OG1 THR 93.A O no hydrogen 3.060 N/A LEU 97.A N THR 93.A O no hydrogen 3.082 N/A THR 101.A N SER 99.A OG no hydrogen 3.372 N/A GLU 103.A N SER 99.A O no hydrogen 3.067 N/A LEU 104.A N ASP 100.A O no hydrogen 3.234 N/A ILE 105.A N GLY 102.A O no hydrogen 3.063 N/A VAL 106.A N GLY 102.A O no hydrogen 3.272 N/A GLU 108.A N LEU 104.A O no hydrogen 3.382 N/A LEU 109.A N ILE 105.A O no hydrogen 3.249 N/A LEU 110.A N VAL 106.A O no hydrogen 2.936 N/A LEU 111.A N GLU 107.A O no hydrogen 2.770 N/A ASN 112.A N GLU 108.A O no hydrogen 3.225 N/A LYS 114.A NZ ASN 60.A OD1 no hydrogen 2.987 N/A LEU 115.A N TRP 183.A O no hydrogen 2.984 N/A ALA 119.A N THR 116.A O no hydrogen 3.405 N/A VAL 120.A N THR 116.A O no hydrogen 3.307 N/A VAL 121.A N MET 117.A O no hydrogen 3.411 N/A LYS 123.A N ALA 119.A O no hydrogen 2.918 N/A LYS 123.A NZ ALA 119.A O no hydrogen 3.528 N/A VAL 124.A N VAL 120.A O no hydrogen 3.296 N/A ALA 125.A N VAL 121.A O no hydrogen 3.250 N/A ASP 126.A N LYS 123.A O no hydrogen 2.942 N/A ARG 127.A N LYS 123.A O no hydrogen 3.172 N/A LEU 128.A N VAL 124.A O no hydrogen 3.115 N/A THR 129.A OG1 ALA 125.A O no hydrogen 2.443 N/A THR 129.A OG1 ASP 126.A O no hydrogen 3.063 N/A GLU 130.A N ASP 126.A O no hydrogen 3.145 N/A MET 132.A N THR 129.A O no hydrogen 3.306 N/A LYS 136.A N GLU 133.A O no hydrogen 2.943 N/A ALA 141.A N ASP 139.A OD1 no hydrogen 3.445 N/A VAL 143.A N TYR 140.A O no hydrogen 3.081 N/A SER 144.A N TYR 140.A O no hydrogen 3.263 N/A SER 144.A OG TYR 140.A O no hydrogen 3.507 N/A SER 144.A OG ALA 141.A O no hydrogen 2.571 N/A ASN 145.A N ALA 141.A O no hydrogen 2.982 N/A THR 146.A N GLU 142.A O no hydrogen 3.002 N/A PHE 147.A N VAL 143.A O no hydrogen 2.717 N/A ARG 149.A N ASN 145.A O no hydrogen 3.320 N/A LEU 150.A N THR 146.A O no hydrogen 3.209 N/A ALA 151.A N VAL 148.A O no hydrogen 2.669 N/A ASP 152.A N VAL 148.A O no hydrogen 2.831 N/A THR 153.A OG1 THR 153.A O no hydrogen 2.436 N/A THR 153.A OG1 GLU 223.A OE1 no hydrogen 3.326 N/A HIS 154.A N ALA 151.A O no hydrogen 3.008 N/A PHE 155.A N LEU 150.A O no hydrogen 2.957 N/A CYS 159.A N TYR 182.A O no hydrogen 3.463 N/A CYS 159.A SG PRO 160.A O no hydrogen 3.035 N/A THR 164.A OG1 PRO 163.A O no hydrogen 2.465 N/A TRP 183.A N LEU 115.A O no hydrogen 2.743 N/A ASN 186.A N PHE 155.A O no hydrogen 3.136 N/A ASN 186.A ND2 HIS 154.A O no hydrogen 3.065 N/A ARG 189.A N ASN 186.A OD1 no hydrogen 2.993 N/A ARG 189.A NE THR 153.A O no hydrogen 2.858 N/A ARG 189.A NH1 ARG 189.A O no hydrogen 3.201 N/A ARG 189.A NH2 THR 153.A OG1 no hydrogen 3.059 N/A HIS 191.A N LEU 187.A O no hydrogen 3.187 N/A GLN 192.A N ASP 188.A O no hydrogen 3.248 N/A HIS 193.A N ARG 189.A O no hydrogen 2.920 N/A PHE 194.A N PHE 190.A O no hydrogen 2.378 N/A ASP 196.A N GLN 192.A O no hydrogen 2.643 N/A GLN 197.A N HIS 193.A O no hydrogen 3.082 N/A ALA 198.A N ARG 195.A O no hydrogen 2.950 N/A ILE 199.A N ARG 195.A O no hydrogen 2.957 N/A VAL 200.A N ASP 196.A O no hydrogen 3.317 N/A SER 201.A N GLN 197.A O no hydrogen 3.157 N/A SER 201.A OG GLN 197.A O no hydrogen 2.746 N/A ALA 202.A N ALA 198.A O no hydrogen 3.047 N/A VAL 203.A N ILE 199.A O no hydrogen 3.005 N/A ALA 204.A N VAL 200.A O no hydrogen 3.284 N/A ASN 205.A N SER 201.A O no hydrogen 3.344 N/A ARG 206.A N VAL 203.A O no hydrogen 2.984 N/A MET 207.A N VAL 203.A O no hydrogen 2.482 N/A GLN 209.A N ASP 208.A OD1 no hydrogen 2.732 N/A GLN 209.A NE2 TYR 249.A OH no hydrogen 3.424 N/A SER 211.A OG ASP 208.A O no hydrogen 2.461 N/A SER 212.A N GLN 209.A O no hydrogen 3.366 N/A SER 212.A OG GLN 209.A O no hydrogen 3.300 N/A ARG 216.A N SER 212.A O no hydrogen 2.891 N/A THR 217.A N GLU 213.A O no hydrogen 2.886 N/A THR 217.A OG1 GLU 213.A O no hydrogen 2.858 N/A MET 218.A N ILE 214.A O no hydrogen 3.102 N/A LEU 219.A N VAL 215.A O no hydrogen 2.976 N/A ARG 220.A N ARG 216.A O no hydrogen 2.620 N/A MET 221.A N THR 217.A O no hydrogen 3.379 N/A SER 222.A N LEU 219.A O no hydrogen 3.219 N/A SER 222.A OG THR 233.A OG1 no hydrogen 2.773 N/A SER 228.A OG GLU 437.A OE1 no hydrogen 3.420 N/A ALA 230.A N SER 227.A O no hydrogen 3.288 N/A THR 233.A OG1 SER 222.A OG no hydrogen 2.773 N/A THR 233.A OG1 GLN 234.A O no hydrogen 3.388 N/A SER 237.A N GLU 240.A OE2 no hydrogen 3.076 N/A ASN 239.A N SER 237.A OG no hydrogen 3.155 N/A PHE 242.A N SER 238.A O no hydrogen 3.392 N/A ARG 243.A N ASN 239.A O no hydrogen 3.364 N/A SER 244.A N GLU 240.A O no hydrogen 2.882 N/A SER 244.A N ILE 241.A O no hydrogen 3.171 N/A SER 244.A OG GLU 240.A O no hydrogen 2.510 N/A SER 244.A OG ILE 241.A O no hydrogen 3.196 N/A TYR 249.A N PRO 246.A O no hydrogen 3.430 N/A LEU 256.A N SER 252.A O no hydrogen 3.344 N/A ASP 257.A N LYS 253.A O no hydrogen 2.914 N/A GLN 258.A N GLN 254.A O no hydrogen 3.078 N/A TYR 259.A N VAL 255.A O no hydrogen 3.060 N/A LEU 260.A N LEU 256.A O no hydrogen 2.566 N/A THR 261.A N ASP 257.A O no hydrogen 2.993 N/A LEU 262.A N GLN 258.A O no hydrogen 2.886 N/A LEU 263.A N TYR 259.A O no hydrogen 2.741 N/A ALA 264.A N LEU 260.A O no hydrogen 3.059 N/A ASP 265.A N LEU 262.A O no hydrogen 3.257 N/A ALA 275.A N ASN 271.A O no hydrogen 3.034 N/A SER 278.A N LYS 274.A O no hydrogen 2.940 N/A SER 278.A OG ALA 275.A O no hydrogen 3.230 N/A LEU 279.A N ALA 275.A O no hydrogen 3.053 N/A ALA 280.A N LEU 276.A O no hydrogen 3.153 N/A THR 281.A OG1 SER 278.A O no hydrogen 3.121 N/A THR 283.A N LEU 279.A O no hydrogen 3.227 N/A THR 283.A OG1 LEU 279.A O no hydrogen 2.706 N/A LEU 284.A N ALA 280.A O no hydrogen 2.931 N/A GLU 285.A N THR 281.A O no hydrogen 2.753 N/A SER 286.A N ALA 282.A O no hydrogen 2.812 N/A VAL 287.A N LEU 284.A O no hydrogen 2.998 N/A VAL 288.A N LEU 284.A O no hydrogen 3.223 N/A GLN 289.A N GLU 285.A O no hydrogen 3.005 N/A GLU 290.A N SER 286.A O no hydrogen 3.285 N/A ARG 291.A N VAL 288.A O no hydrogen 3.220 N/A PHE 292.A N VAL 288.A O no hydrogen 2.740 N/A ALA 297.A N GLY 293.A O no hydrogen 3.148 N/A ARG 298.A N ARG 295.A O no hydrogen 3.254 N/A ARG 298.A NH2 ALA 318.A O no hydrogen 2.352 N/A PHE 300.A N CYS 296.A O no hydrogen 2.950 N/A ARG 301.A N ALA 297.A O no hydrogen 3.200 N/A ARG 301.A NE GLU 285.A OE1 no hydrogen 2.673 N/A LEU 302.A N ILE 299.A O no hydrogen 3.241 N/A GLN 305.A N LEU 302.A O no hydrogen 3.285 N/A LYS 306.A N LEU 302.A O no hydrogen 3.322 N/A GLU 315.A N GLU 315.A OE1 no hydrogen 2.603 N/A ASP 316.A N GLN 313.A O no hydrogen 2.797 N/A PHE 317.A N GLN 313.A O no hydrogen 2.458 N/A ALA 325.A N PRO 321.A O no hydrogen 2.887 N/A LYS 326.A N ALA 322.A O no hydrogen 3.281 N/A LYS 326.A NZ TYR 330.A OH no hydrogen 2.993 N/A MET 328.A N ALA 325.A O no hydrogen 2.796 N/A LEU 329.A N ALA 325.A O no hydrogen 3.051 N/A TYR 330.A N LYS 326.A O no hydrogen 3.297 N/A LYS 331.A N ASP 327.A O no hydrogen 3.131 N/A MET 332.A N MET 328.A O no hydrogen 3.011 N/A LEU 333.A N LEU 329.A O no hydrogen 2.686 N/A SER 334.A N TYR 330.A O no hydrogen 2.809 N/A SER 334.A OG TYR 330.A O no hydrogen 3.311 N/A SER 334.A OG GLU 335.A OE1 no hydrogen 2.312 N/A GLU 335.A N LYS 331.A O no hydrogen 3.341 N/A ASN 336.A N LEU 333.A O no hydrogen 2.925 N/A PHE 337.A N MET 332.A O no hydrogen 2.698 N/A MET 338.A N MET 332.A O no hydrogen 2.577 N/A ILE 343.A N GLN 341.A O no hydrogen 2.843 N/A LYS 345.A N THR 354.A OG1 no hydrogen 3.150 N/A THR 354.A OG1 ILE 343.A O no hydrogen 3.495 N/A TYR 356.A OH ALA 350.A O no hydrogen 3.170 N/A THR 359.A OG1 LYS 307.A O no hydrogen 2.454 N/A THR 359.A OG1 HIS 308.A ND1 no hydrogen 2.421 N/A THR 359.A OG1 TYR 358.A O no hydrogen 2.681 N/A SER 364.A OG ASN 361.A O no hydrogen 3.154 N/A ALA 365.A N ASN 361.A O no hydrogen 3.294 N/A ARG 367.A N LEU 363.A O no hydrogen 2.698 N/A MET 368.A N SER 364.A O no hydrogen 3.366 N/A LEU 370.A N ALA 366.A O no hydrogen 2.929 N/A HIS 371.A N ARG 367.A O no hydrogen 3.014 N/A ARG 372.A N MET 368.A O no hydrogen 2.586 N/A CYS 373.A N LEU 369.A O no hydrogen 2.778 N/A CYS 373.A SG VAL 425.A O no hydrogen 3.239 N/A TYR 374.A N LEU 370.A O no hydrogen 2.887 N/A LYS 375.A N HIS 371.A O no hydrogen 3.098 N/A SER 376.A N ARG 372.A O no hydrogen 2.829 N/A ASN 379.A N LYS 375.A O no hydrogen 3.360 N/A LEU 380.A N SER 376.A O no hydrogen 3.109 N/A ILE 381.A N ILE 377.A O no hydrogen 3.080 N/A GLU 382.A N ALA 378.A O no hydrogen 3.273 N/A ARG 383.A NE GLU 387.A OE1 no hydrogen 2.524 N/A ARG 383.A NH2 GLU 387.A OE1 no hydrogen 3.211 N/A ARG 384.A N LEU 380.A O no hydrogen 3.292 N/A GLN 385.A N ILE 381.A O no hydrogen 2.470 N/A GLU 387.A N ARG 383.A O no hydrogen 2.912 N/A THR 388.A OG1 ARG 384.A O no hydrogen 2.285 N/A LYS 389.A NZ GLN 385.A O no hydrogen 2.508 N/A LYS 392.A NZ LYS 389.A O no hydrogen 2.461 N/A LEU 394.A N ASN 391.A O no hydrogen 3.437 N/A LYS 397.A NZ ARG 393.A O no hydrogen 2.405 N/A LYS 397.A NZ GLU 396.A OE2 no hydrogen 2.909 N/A THR 401.A N GLU 404.A OE1 no hydrogen 2.716 N/A ALA 402.A N THR 401.A OG1 no hydrogen 2.683 N/A ARG 405.A N THR 401.A O no hydrogen 3.005 N/A GLN 406.A N ALA 402.A O no hydrogen 3.195 N/A GLN 407.A N PRO 403.A O no hydrogen 3.176 N/A LEU 408.A N ARG 405.A O no hydrogen 2.887 N/A GLU 409.A N ARG 405.A O no hydrogen 3.154 N/A THR 410.A N GLN 406.A O no hydrogen 3.188 N/A THR 410.A OG1 GLN 406.A O no hydrogen 2.760 N/A THR 410.A OG1 GLN 407.A O no hydrogen 2.930 N/A LEU 411.A N GLN 407.A O no hydrogen 2.902 N/A LYS 412.A N LEU 408.A O no hydrogen 2.729 N/A ARG 413.A N GLU 409.A O no hydrogen 3.171 N/A ASN 414.A N THR 410.A O no hydrogen 3.241 N/A VAL 415.A N LEU 411.A O no hydrogen 2.796 N/A ASN 416.A N LYS 412.A O no hydrogen 3.435 N/A LYS 417.A N ARG 413.A O no hydrogen 3.172 N/A LEU 418.A N ASN 414.A O no hydrogen 2.707 N/A ASP 419.A N VAL 415.A O no hydrogen 2.654 N/A ALA 420.A N ASN 416.A O no hydrogen 3.374 N/A SER 421.A OG LYS 417.A O no hydrogen 2.903 N/A SER 421.A OG LEU 418.A O no hydrogen 2.442 N/A ILE 423.A N ALA 420.A O no hydrogen 3.290 N/A GLN 424.A NE2 ALA 420.A O no hydrogen 3.096 N/A ASP 426.A N ILE 423.A O no hydrogen 3.038 N/A GLU 427.A N ILE 423.A O no hydrogen 3.259 N/A THR 428.A N VAL 425.A O no hydrogen 3.261 N/A ILE 429.A N ASP 426.A O no hydrogen 3.150 N/A PHE 430.A N ASP 426.A O no hydrogen 3.423 N/A LEU 431.A N GLU 427.A O no hydrogen 3.369 N/A LEU 432.A N THR 428.A O no hydrogen 3.148 N/A LEU 432.A N ILE 429.A O no hydrogen 2.973 N/A GLU 433.A N ILE 429.A O no hydrogen 2.509 N/A SER 434.A N PHE 430.A O no hydrogen 2.984 N/A ILE 436.A N LEU 432.A O no hydrogen 2.809 N/A GLU 437.A N GLU 433.A O no hydrogen 2.729 N/A CYS 438.A N SER 434.A O no hydrogen 3.068 N/A CYS 438.A SG HIS 273.A ND1 no hydrogen 3.124 N/A THR 439.A N ILE 436.A O no hydrogen 3.346 N/A THR 439.A OG1 THR 439.A O no hydrogen 2.487 N/A