Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wny_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 7.A N GLU 7.A OE1 no hydrogen 2.657 N/A LEU 9.A N LYS 5.A O no hydrogen 2.675 N/A LYS 10.A N GLU 6.A O no hydrogen 2.917 N/A VAL 11.A N GLU 7.A O no hydrogen 2.907 N/A ALA 12.A N LEU 8.A O no hydrogen 2.909 N/A GLY 13.A N LEU 9.A O no hydrogen 2.743 N/A SER 14.A OG LYS 10.A O no hydrogen 2.948 N/A ARG 21.A N TRP 17.A O no hydrogen 2.912 N/A TRP 22.A N VAL 18.A O no hydrogen 2.931 N/A ALA 23.A N ARG 19.A O no hydrogen 2.897 N/A LEU 24.A N THR 20.A O no hydrogen 2.910 N/A LEU 25.A N ARG 21.A O no hydrogen 2.934 N/A LEU 26.A N TRP 22.A O no hydrogen 2.946 N/A LEU 27.A N ALA 23.A O no hydrogen 2.879 N/A PHE 28.A N LEU 24.A O no hydrogen 2.890 N/A TRP 29.A N LEU 25.A O no hydrogen 2.980 N/A LEU 30.A N LEU 26.A O no hydrogen 2.912 N/A GLY 31.A N LEU 27.A O no hydrogen 2.885 N/A TRP 32.A N PHE 28.A O no hydrogen 2.911 N/A LEU 33.A N TRP 29.A O no hydrogen 2.946 N/A GLY 34.A N LEU 30.A O no hydrogen 2.904 N/A MET 35.A N GLY 31.A O no hydrogen 2.863 N/A LEU 36.A N TRP 32.A O no hydrogen 2.971 N/A ALA 37.A N LEU 33.A O no hydrogen 2.919 N/A GLY 38.A N GLY 34.A O no hydrogen 2.893 N/A ALA 39.A N MET 35.A O no hydrogen 2.932 N/A VAL 40.A N LEU 36.A O no hydrogen 2.981 N/A VAL 41.A N ALA 37.A O no hydrogen 2.911 N/A ILE 42.A N GLY 38.A O no hydrogen 2.963 N/A ILE 43.A N ALA 39.A O no hydrogen 2.953 N/A VAL 44.A N VAL 40.A O no hydrogen 2.897 N/A ARG 45.A N VAL 41.A O no hydrogen 3.221 N/A ALA 46.A N ILE 43.A O no hydrogen 3.489 N/A ARG 50.A N ASP 397.A OD2 no hydrogen 3.191 N/A LYS 56.A NZ GLU 211.A O no hydrogen 3.336 N/A TRP 57.A NE1 ASP 212.A O no hydrogen 3.091 N/A HIS 59.A ND1 TRP 58.A O no hydrogen 2.601 N/A LEU 63.A N PRO 303.A O no hydrogen 3.065 N/A TYR 64.A N GLY 97.A O no hydrogen 2.918 N/A TYR 64.A OH GLU 310.A OE2 no hydrogen 3.302 N/A ARG 65.A N PHE 305.A O no hydrogen 2.733 N/A ARG 65.A NE SER 306.A OG no hydrogen 3.371 N/A ARG 65.A NH1 SER 275.A O no hydrogen 3.162 N/A ARG 65.A NH2 SER 306.A OG no hydrogen 3.187 N/A ILE 66.A N VAL 99.A O no hydrogen 2.917 N/A GLY 74.A N GLN 70.A O no hydrogen 3.135 N/A ALA 77.A N GLY 74.A O no hydrogen 3.359 N/A ASN 79.A N ALA 77.A O no hydrogen 2.921 N/A LEU 80.A N PHE 123.A O no hydrogen 3.353 N/A LEU 83.A N ASN 79.A O no hydrogen 2.956 N/A LYS 84.A N LEU 80.A O no hydrogen 2.920 N/A LYS 84.A NZ SER 131.A OG no hydrogen 2.982 N/A GLY 85.A N GLY 82.A O no hydrogen 3.097 N/A ARG 86.A N LEU 83.A O no hydrogen 3.029 N/A TYR 89.A N ASP 88.A OD1 no hydrogen 2.644 N/A TYR 89.A OH GLU 310.A OE2 no hydrogen 2.263 N/A LEU 90.A N ARG 86.A O no hydrogen 2.953 N/A SER 91.A N LEU 87.A O no hydrogen 2.860 N/A SER 92.A N ASP 88.A O no hydrogen 2.902 N/A SER 92.A OG TYR 89.A O no hydrogen 2.263 N/A LEU 93.A N TYR 89.A O no hydrogen 2.949 N/A LYS 94.A N SER 91.A O no hydrogen 2.904 N/A LYS 96.A N ALA 62.A O no hydrogen 3.037 N/A LEU 98.A N ARG 142.A O no hydrogen 2.886 N/A VAL 99.A N TYR 64.A O no hydrogen 2.888 N/A LEU 100.A N ILE 144.A O no hydrogen 2.743 N/A HIS 104.A ND1 LYS 105.A O no hydrogen 3.352 N/A HIS 104.A NE2 THR 148.A O no hydrogen 2.475 N/A LYS 105.A N ASP 115.A O no hydrogen 3.279 N/A LYS 105.A NZ ASP 120.A OD1 no hydrogen 3.314 N/A ASN 106.A ND2 ASN 150.A OD1 no hydrogen 2.562 N/A THR 114.A N ASP 110.A O no hydrogen 2.999 N/A THR 114.A OG1 ASP 110.A O no hydrogen 2.555 N/A LEU 117.A N ASP 115.A OD1 no hydrogen 3.109 N/A ASP 120.A N ILE 103.A O no hydrogen 3.157 N/A GLY 124.A N PRO 121.A O no hydrogen 3.220 N/A PHE 129.A N SER 125.A O no hydrogen 3.177 N/A ASP 130.A N LYS 126.A O no hydrogen 2.913 N/A SER 131.A N GLU 127.A O no hydrogen 2.914 N/A LEU 132.A N ASP 128.A O no hydrogen 2.890 N/A LEU 133.A N PHE 129.A O no hydrogen 2.886 N/A GLN 134.A N ASP 130.A O no hydrogen 2.929 N/A SER 135.A N SER 131.A O no hydrogen 2.912 N/A SER 135.A OG SER 131.A O no hydrogen 3.221 N/A ALA 136.A N LEU 132.A O no hydrogen 2.889 N/A LYS 137.A N LEU 133.A O no hydrogen 2.873 N/A LYS 138.A N GLN 134.A O no hydrogen 2.938 N/A LYS 139.A N SER 135.A O no hydrogen 3.221 N/A LYS 139.A N ALA 136.A O no hydrogen 3.078 N/A SER 140.A N LYS 137.A O no hydrogen 3.194 N/A ILE 141.A N ALA 136.A O no hydrogen 2.831 N/A ILE 144.A N LEU 98.A O no hydrogen 2.666 N/A ASP 146.A N LEU 100.A O no hydrogen 2.715 N/A LEU 147.A N GLN 185.A O no hydrogen 2.860 N/A THR 148.A OG1 ASP 146.A OD1 no hydrogen 3.397 N/A ASN 150.A ND2 ASN 155.A O no hydrogen 2.625 N/A TYR 151.A OH HIS 104.A O no hydrogen 2.256 N/A ARG 152.A NE ASN 106.A O no hydrogen 3.116 N/A GLU 154.A N GLU 154.A OE2 no hydrogen 2.269 N/A SER 156.A OG ASP 188.A OD2 no hydrogen 3.233 N/A TRP 157.A N ASN 155.A OD1 no hydrogen 2.887 N/A TRP 157.A NE1 ASP 188.A O no hydrogen 2.517 N/A THR 164.A N GLN 161.A OE1 no hydrogen 3.233 N/A THR 164.A OG1 GLN 161.A OE1 no hydrogen 2.423 N/A ALA 166.A N VAL 162.A O no hydrogen 2.833 N/A THR 167.A N ASP 163.A O no hydrogen 2.919 N/A THR 167.A OG1 ASP 163.A O no hydrogen 2.817 N/A LYS 168.A N THR 164.A O no hydrogen 2.904 N/A LYS 168.A NZ THR 114.A O no hydrogen 3.276 N/A VAL 169.A N VAL 165.A O no hydrogen 2.874 N/A LYS 170.A N ALA 166.A O no hydrogen 2.914 N/A LYS 170.A NZ ALA 166.A O no hydrogen 3.034 N/A ASP 171.A N THR 167.A O no hydrogen 2.945 N/A ALA 172.A N LYS 168.A O no hydrogen 2.882 N/A LEU 173.A N VAL 169.A O no hydrogen 2.877 N/A GLU 174.A N LYS 170.A O no hydrogen 2.988 N/A PHE 175.A N ASP 171.A O no hydrogen 2.933 N/A TRP 176.A N ALA 172.A O no hydrogen 2.895 N/A LEU 177.A N LEU 173.A O no hydrogen 2.927 N/A GLN 178.A N GLU 174.A O no hydrogen 3.001 N/A GLN 178.A NE2 GLU 174.A O no hydrogen 2.636 N/A ALA 179.A N PHE 175.A O no hydrogen 2.893 N/A GLY 180.A N TRP 176.A O no hydrogen 2.899 N/A VAL 181.A N TRP 176.A O no hydrogen 3.061 N/A ASP 182.A N VAL 143.A O no hydrogen 3.128 N/A PHE 184.A N LEU 214.A O no hydrogen 3.099 N/A GLN 185.A N LEU 145.A O no hydrogen 3.154 N/A VAL 186.A N ILE 216.A O no hydrogen 2.891 N/A ILE 189.A N GLY 218.A O no hydrogen 3.351 N/A LEU 192.A N ILE 189.A O no hydrogen 3.086 N/A LYS 193.A NZ ASN 191.A O no hydrogen 3.545 N/A SER 197.A N ASP 194.A O no hydrogen 3.102 N/A SER 197.A OG ASP 194.A OD2 no hydrogen 3.299 N/A LEU 199.A N ALA 195.A O no hydrogen 2.889 N/A ALA 200.A N SER 196.A O no hydrogen 2.904 N/A GLU 201.A N SER 197.A O no hydrogen 2.943 N/A TRP 202.A N PHE 198.A O no hydrogen 2.877 N/A GLN 203.A N LEU 199.A O no hydrogen 2.882 N/A ASN 204.A N ALA 200.A O no hydrogen 2.843 N/A ILE 205.A N GLU 201.A O no hydrogen 2.866 N/A THR 206.A N TRP 202.A O no hydrogen 2.896 N/A THR 206.A OG1 TRP 202.A O no hydrogen 2.774 N/A LYS 207.A N GLN 203.A O no hydrogen 2.810 N/A LYS 207.A NZ ARG 213.A O no hydrogen 2.550 N/A GLY 208.A N ILE 205.A O no hydrogen 2.814 N/A ILE 216.A N PHE 184.A O no hydrogen 2.890 N/A ALA 217.A N LEU 238.A O no hydrogen 2.882 N/A GLY 218.A N VAL 186.A O no hydrogen 2.896 N/A THR 219.A N THR 240.A O no hydrogen 3.105 N/A THR 219.A OG1 ASN 220.A OD1 no hydrogen 3.199 N/A ASN 220.A N ASN 220.A OD1 no hydrogen 2.463 N/A SER 221.A OG GLN 226.A OE1 no hydrogen 2.573 N/A GLN 226.A N ASP 223.A OD1 no hydrogen 3.265 N/A SER 229.A N GLN 226.A O no hydrogen 3.052 N/A SER 229.A OG GLN 226.A O no hydrogen 2.326 N/A LEU 231.A N ILE 227.A O no hydrogen 2.946 N/A THR 240.A N ALA 217.A O no hydrogen 2.928 N/A THR 240.A OG1 ALA 217.A O no hydrogen 3.527 N/A SER 241.A OG SER 221.A O no hydrogen 3.248 N/A TYR 243.A OH LEU 257.A O no hydrogen 2.797 N/A SER 249.A OG GLY 248.A O no hydrogen 2.488 N/A THR 254.A N THR 250.A O no hydrogen 3.400 N/A THR 254.A OG1 THR 250.A O no hydrogen 3.431 N/A LYS 255.A N GLY 251.A O no hydrogen 2.907 N/A LYS 255.A NZ PHE 383.A O no hydrogen 2.776 N/A SER 256.A N GLU 252.A O no hydrogen 2.879 N/A SER 256.A OG GLU 252.A O no hydrogen 3.483 N/A SER 256.A OG HIS 253.A O no hydrogen 2.459 N/A LEU 257.A N HIS 253.A O no hydrogen 2.936 N/A VAL 258.A N THR 254.A O no hydrogen 2.921 N/A THR 259.A N LYS 255.A O no hydrogen 2.897 N/A THR 259.A OG1 LYS 255.A O no hydrogen 2.369 N/A THR 259.A OG1 SER 256.A O no hydrogen 3.037 N/A GLN 260.A N SER 256.A O no hydrogen 2.889 N/A TYR 261.A N LEU 257.A O no hydrogen 2.943 N/A LEU 262.A N VAL 258.A O no hydrogen 2.928 N/A ASN 263.A N THR 259.A O no hydrogen 2.884 N/A ALA 264.A N GLN 260.A O no hydrogen 2.909 N/A THR 265.A N TYR 261.A O no hydrogen 3.373 N/A GLY 266.A N ASN 263.A O no hydrogen 3.169 N/A ARG 268.A NE LYS 235.A O no hydrogen 3.435 N/A ARG 268.A NH2 LEU 231.A O no hydrogen 3.473 N/A TRP 269.A NE1 THR 302.A OG1 no hydrogen 2.605 N/A CYS 270.A SG TYR 261.A OH no hydrogen 3.467 N/A CYS 270.A SG ARG 268.A O no hydrogen 3.285 N/A TRP 272.A NE1 PRO 300.A O no hydrogen 2.770 N/A SER 273.A OG SER 275.A O no hydrogen 3.123 N/A SER 275.A OG LEU 274.A O no hydrogen 2.549 N/A GLN 276.A NE2 ASP 188.A OD1 no hydrogen 3.556 N/A LEU 280.A N ASP 309.A OD1 no hydrogen 3.280 N/A LEU 280.A N ASP 309.A OD2 no hydrogen 3.251 N/A PHE 283.A N LEU 280.A O no hydrogen 3.296 N/A ARG 290.A NH1 THR 438.A O no hydrogen 2.426 N/A TYR 292.A N LEU 288.A O no hydrogen 2.978 N/A GLN 293.A N LEU 289.A O no hydrogen 2.946 N/A MET 295.A N LEU 291.A O no hydrogen 2.960 N/A LEU 296.A N TYR 292.A O no hydrogen 2.879 N/A PHE 297.A N GLN 293.A O no hydrogen 2.927 N/A THR 298.A N MET 295.A O no hydrogen 3.328 N/A THR 298.A OG1 LEU 294.A O no hydrogen 2.225 N/A THR 298.A OG1 MET 295.A O no hydrogen 3.393 N/A THR 298.A OG1 TYR 392.A OH no hydrogen 2.754 N/A THR 302.A N CYS 270.A O no hydrogen 3.051 N/A THR 302.A OG1 TRP 58.A O no hydrogen 3.042 N/A VAL 304.A N TRP 272.A O no hydrogen 3.319 N/A PHE 305.A N LEU 63.A O no hydrogen 3.161 N/A SER 306.A OG ARG 278.A O no hydrogen 3.478 N/A TYR 307.A OH PRO 326.A O no hydrogen 2.708 N/A ASP 309.A N SER 306.A O no hydrogen 3.246 N/A GLU 310.A N GLU 310.A OE1 no hydrogen 2.458 N/A LEU 313.A N GLY 308.A O no hydrogen 2.756 N/A ALA 316.A N ASP 314.A OD1 no hydrogen 2.867 N/A MET 328.A N ALA 71.A O no hydrogen 2.885 N/A TRP 330.A N SER 334.A OG no hydrogen 2.968 N/A TRP 330.A NE1 PHE 72.A O no hydrogen 2.985 N/A ASP 331.A N SER 334.A OG no hydrogen 3.318 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.672 N/A SER 333.A N ASP 331.A OD1 no hydrogen 2.724 N/A SER 333.A OG ASP 331.A OD1 no hydrogen 2.238 N/A SER 334.A N ASP 331.A O no hydrogen 3.410 N/A ALA 341.A N ILE 338.A O no hydrogen 3.397 N/A MET 346.A N SER 343.A O no hydrogen 3.154 N/A THR 347.A OG1 TRP 330.A O no hydrogen 3.550 N/A VAL 348.A N LEU 329.A O no hydrogen 3.407 N/A LYS 349.A N TRP 330.A O no hydrogen 2.923 N/A GLY 350.A N THR 347.A OG1 no hydrogen 3.184 N/A GLN 351.A N VAL 348.A O no hydrogen 3.239 N/A SER 352.A N VAL 348.A O no hydrogen 3.097 N/A SER 352.A OG VAL 348.A O no hydrogen 2.936 N/A GLY 356.A N ASP 354.A OD1 no hydrogen 3.245 N/A SER 357.A N ASP 354.A O no hydrogen 3.101 N/A SER 357.A OG GLN 351.A O no hydrogen 2.760 N/A SER 357.A OG ASP 354.A O no hydrogen 2.499 N/A SER 360.A OG PRO 355.A O no hydrogen 2.522 N/A SER 360.A OG SER 357.A O no hydrogen 3.255 N/A PHE 362.A N LEU 358.A O no hydrogen 2.922 N/A ARG 363.A N LEU 359.A O no hydrogen 2.897 N/A ARG 363.A NH2 SER 92.A OG no hydrogen 2.925 N/A ARG 364.A N SER 360.A O no hydrogen 2.917 N/A LEU 365.A N LEU 361.A O no hydrogen 2.916 N/A SER 366.A N PHE 362.A O no hydrogen 2.906 N/A SER 366.A OG LEU 93.A O no hydrogen 3.007 N/A SER 366.A OG LYS 94.A O no hydrogen 3.297 N/A ASP 367.A N ARG 363.A O no hydrogen 2.924 N/A GLN 368.A N ARG 364.A O no hydrogen 2.938 N/A ARG 369.A N LEU 365.A O no hydrogen 2.869 N/A ARG 369.A NH1 HIS 59.A O no hydrogen 3.225 N/A SER 370.A N SER 366.A O no hydrogen 2.940 N/A SER 370.A OG THR 60.A O no hydrogen 3.043 N/A SER 370.A OG SER 366.A O no hydrogen 3.522 N/A LYS 371.A NZ GLU 372.A OE1 no hydrogen 3.487 N/A GLU 372.A N GLN 368.A O no hydrogen 3.272 N/A SER 374.A OG GLU 400.A O no hydrogen 2.758 N/A LEU 376.A N GLU 372.A O no hydrogen 2.970 N/A HIS 377.A N ARG 373.A O no hydrogen 2.942 N/A GLY 378.A N SER 374.A O no hydrogen 2.759 N/A ASP 379.A N HIS 395.A O no hydrogen 2.885 N/A HIS 381.A N ILE 393.A O no hydrogen 2.944 N/A HIS 381.A ND1 HIS 395.A NE2 no hydrogen 3.062 N/A PHE 390.A N LEU 406.A O no hydrogen 2.910 N/A TYR 392.A N VAL 404.A O no hydrogen 2.936 N/A TYR 392.A OH THR 298.A OG1 no hydrogen 2.754 N/A ILE 393.A N HIS 381.A O no hydrogen 2.867 N/A ARG 394.A N PHE 402.A O no hydrogen 2.895 N/A ARG 394.A NH1 THR 298.A O no hydrogen 2.988 N/A ARG 394.A NH2 GLY 378.A O no hydrogen 3.375 N/A HIS 395.A N ASP 379.A O no hydrogen 2.942 N/A HIS 395.A NE2 HIS 381.A ND1 no hydrogen 3.062 N/A ASN 399.A N TRP 396.A O no hydrogen 3.063 N/A ARG 401.A N PHE 465.A O no hydrogen 2.929 N/A ARG 401.A NH1 ASP 397.A O no hydrogen 2.634 N/A ARG 401.A NH1 ASN 399.A O no hydrogen 3.394 N/A ARG 401.A NH2 ASP 397.A O no hydrogen 2.754 N/A ARG 401.A NH2 SER 425.A O no hydrogen 3.017 N/A PHE 402.A N ARG 394.A O no hydrogen 2.946 N/A LEU 403.A N LEU 463.A O no hydrogen 2.906 N/A VAL 404.A N TYR 392.A O no hydrogen 2.931 N/A VAL 405.A N LEU 461.A O no hydrogen 2.954 N/A LEU 406.A N PHE 390.A O no hydrogen 2.879 N/A ASN 407.A N GLU 459.A O no hydrogen 3.138 N/A ASN 407.A ND2 GLU 456.A O no hydrogen 3.336 N/A GLY 409.A N ASN 407.A OD1 no hydrogen 2.984 N/A LEU 413.A N LEU 455.A O no hydrogen 3.073 N/A ALA 415.A N LEU 453.A O no hydrogen 2.782 N/A SER 420.A OG SER 420.A O no hydrogen 2.233 N/A ALA 426.A N PRO 423.A O no hydrogen 3.117 N/A ALA 432.A N LEU 448.A O no hydrogen 2.922 N/A LEU 435.A N LEU 462.A O no hydrogen 2.889 N/A LEU 436.A N LEU 462.A O no hydrogen 2.981 N/A SER 437.A OG GLN 439.A OE1 no hydrogen 2.707 N/A SER 437.A OG GLU 459.A OE2 no hydrogen 3.545 N/A SER 437.A OG GLY 460.A O no hydrogen 3.447 N/A THR 438.A N GLY 460.A O no hydrogen 3.150 N/A GLY 445.A N LEU 434.A O no hydrogen 3.008 N/A SER 446.A OG GLU 443.A O no hydrogen 2.992 N/A LEU 448.A N ALA 432.A O no hydrogen 2.879 N/A GLU 449.A N GLU 449.A OE1 no hydrogen 2.624 N/A LEU 450.A N ALA 430.A O no hydrogen 3.241 N/A LEU 455.A N LEU 413.A O no hydrogen 2.630 N/A GLU 456.A N GLU 459.A OE1 no hydrogen 2.335 N/A HIS 458.A N GLY 409.A O no hydrogen 3.200 N/A LEU 461.A N VAL 405.A O no hydrogen 2.857 N/A LEU 462.A N LEU 436.A O no hydrogen 2.914 N/A LEU 463.A N LEU 403.A O no hydrogen 2.917 N/A ARG 464.A N ASP 433.A O no hydrogen 2.860 N/A PHE 465.A N ARG 401.A O no hydrogen 2.927 N/A