Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8uux_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 10.A NE2 MET 130.A O no hydrogen 3.314 N/A LEU 22.A N GLY 19.A O no hydrogen 3.217 N/A ALA 24.A N ALA 20.A O no hydrogen 2.912 N/A ALA 26.A N ALA 23.A O no hydrogen 3.399 N/A ALA 27.A N ALA 23.A O no hydrogen 3.125 N/A ASN 31.A N PHE 197.A O no hydrogen 3.247 N/A TRP 36.A N ASP 34.A OD2 no hydrogen 3.324 N/A ILE 37.A N ASP 34.A O no hydrogen 3.210 N/A GLN 39.A N TRP 36.A O no hydrogen 3.413 N/A VAL 42.A N SER 189.A O no hydrogen 3.076 N/A CYS 44.A N LEU 187.A O no hydrogen 3.226 N/A CYS 44.A SG LEU 70.A O no hydrogen 3.256 N/A CYS 44.A SG SER 189.A OG no hydrogen 3.398 N/A PHE 49.A N GLY 185.A O no hydrogen 2.951 N/A ILE 51.A N VAL 183.A O no hydrogen 2.879 N/A ARG 54.A NH1 PRO 407.A O no hydrogen 3.517 N/A ASN 55.A N SER 52.A O no hydrogen 3.160 N/A THR 56.A N GLU 59.A OE2 no hydrogen 3.417 N/A GLY 58.A N LEU 167.A O no hydrogen 3.135 N/A GLU 59.A N THR 56.A O no hydrogen 3.346 N/A LEU 61.A N CYS 165.A O no hydrogen 2.812 N/A LEU 64.A N LEU 163.A O no hydrogen 2.903 N/A LEU 66.A N MET 161.A O no hydrogen 3.068 N/A LEU 70.A N GLY 67.A O no hydrogen 3.464 N/A ALA 75.A N ASN 71.A O no hydrogen 2.769 N/A HIS 76.A N PRO 72.A O no hydrogen 2.904 N/A LEU 77.A N TYR 73.A O no hydrogen 2.914 N/A SER 78.A N LEU 74.A O no hydrogen 2.905 N/A SER 78.A OG LEU 74.A O no hydrogen 3.510 N/A SER 78.A OG ALA 75.A O no hydrogen 2.815 N/A MET 80.A N LEU 77.A O no hydrogen 3.469 N/A TYR 81.A N SER 78.A O no hydrogen 3.468 N/A THR 82.A N TYR 199.A O no hydrogen 3.204 N/A TRP 84.A N HIS 152.A O no hydrogen 3.110 N/A VAL 85.A N ASN 196.A O no hydrogen 2.942 N/A GLY 86.A N ASP 145.A OD2 no hydrogen 3.451 N/A MET 88.A N LEU 143.A O no hydrogen 2.901 N/A GLU 89.A N LYS 190.A O no hydrogen 2.879 N/A VAL 90.A N LEU 141.A O no hydrogen 2.916 N/A GLN 91.A N LEU 188.A O no hydrogen 2.850 N/A LEU 92.A N ILE 139.A O no hydrogen 2.839 N/A VAL 93.A N ARG 186.A O no hydrogen 2.954 N/A ALA 95.A N SER 184.A O no hydrogen 2.920 N/A THR 100.A OG1 ASN 97.A O no hydrogen 3.336 N/A ALA 101.A N ARG 172.A O no hydrogen 2.836 N/A LYS 103.A N THR 169.A OG1 no hydrogen 2.648 N/A VAL 104.A N CYS 131.A O no hydrogen 2.884 N/A VAL 105.A N MET 166.A O no hydrogen 3.108 N/A VAL 106.A N VAL 129.A O no hydrogen 2.945 N/A ALA 107.A N VAL 164.A O no hydrogen 3.120 N/A LEU 108.A N PRO 127.A O no hydrogen 2.900 N/A VAL 109.A N ARG 162.A O no hydrogen 3.306 N/A TYR 112.A N GLU 159.A OE2 no hydrogen 3.022 N/A ILE 123.A N THR 119.A O no hydrogen 3.242 N/A THR 124.A OG1 ALA 121.A O no hydrogen 3.069 N/A CYS 125.A N GLN 122.A O no hydrogen 2.918 N/A CYS 125.A SG ALA 121.A O no hydrogen 3.977 N/A HIS 128.A ND1 PHE 126.A O no hydrogen 3.254 N/A VAL 129.A N VAL 106.A O no hydrogen 2.885 N/A CYS 131.A N VAL 104.A O no hydrogen 2.924 N/A VAL 133.A N GLY 102.A O no hydrogen 3.420 N/A THR 135.A N ASP 132.A O no hydrogen 3.408 N/A THR 135.A OG1 ASP 132.A O no hydrogen 2.821 N/A THR 135.A OG1 ASP 132.A OD1 no hydrogen 2.911 N/A ILE 139.A N LEU 92.A O no hydrogen 2.966 N/A LEU 141.A N VAL 90.A O no hydrogen 2.896 N/A LEU 143.A N MET 88.A O no hydrogen 2.899 N/A ASP 145.A N ASN 87.A OD1 no hydrogen 2.867 N/A ARG 147.A NE VAL 149.A O no hydrogen 2.893 N/A ARG 147.A NE LEU 150.A O no hydrogen 3.482 N/A ARG 147.A NH1 ALA 18.A O no hydrogen 3.239 N/A ARG 147.A NH1 ASP 145.A O no hydrogen 3.356 N/A ARG 147.A NH2 ALA 18.A O no hydrogen 3.455 N/A ARG 147.A NH2 LEU 150.A O no hydrogen 3.328 N/A HIS 152.A N TRP 84.A O no hydrogen 3.145 N/A ALA 153.A N GLU 158.A OE1 no hydrogen 2.986 N/A THR 154.A N THR 82.A O no hydrogen 3.126 N/A THR 154.A OG1 TYR 81.A O no hydrogen 3.018 N/A THR 154.A OG1 GLN 155.A OE1 no hydrogen 3.543 N/A GLN 157.A NE2 TYR 209.A OH no hydrogen 3.394 N/A SER 160.A OG LEU 66.A O no hydrogen 3.185 N/A ARG 162.A N VAL 109.A O no hydrogen 3.019 N/A ARG 162.A NE ASP 63.A OD2 no hydrogen 3.476 N/A ARG 162.A NH2 ASP 63.A OD2 no hydrogen 3.098 N/A LEU 163.A N LEU 64.A O no hydrogen 2.876 N/A VAL 164.A N ALA 107.A O no hydrogen 3.351 N/A CYS 165.A N PHE 62.A O no hydrogen 2.938 N/A MET 166.A N VAL 105.A O no hydrogen 3.107 N/A LEU 167.A N GLU 59.A O no hydrogen 3.192 N/A TYR 168.A N LYS 103.A O no hydrogen 2.785 N/A THR 169.A N LYS 103.A O no hydrogen 2.923 N/A ARG 172.A N ALA 101.A O no hydrogen 2.985 N/A SER 180.A OG SER 180.A O no hydrogen 2.542 N/A VAL 183.A N ILE 51.A O no hydrogen 2.913 N/A GLY 185.A N PHE 49.A O no hydrogen 2.894 N/A ARG 186.A N VAL 93.A O no hydrogen 2.926 N/A ARG 186.A NH1 GLY 185.A O no hydrogen 3.258 N/A LEU 187.A N GLY 47.A O no hydrogen 3.422 N/A LEU 188.A N GLN 91.A O no hydrogen 2.893 N/A SER 189.A N VAL 42.A O no hydrogen 2.886 N/A SER 189.A OG LEU 70.A O no hydrogen 2.622 N/A SER 189.A OG ASN 71.A OD1 no hydrogen 3.569 N/A LYS 190.A N GLU 89.A O no hydrogen 2.940 N/A ALA 192.A N ASN 87.A O no hydrogen 3.062 N/A ASN 196.A N VAL 85.A O no hydrogen 2.881 N/A ASN 196.A ND2 ASN 31.A O no hydrogen 3.069 N/A PHE 197.A N ASN 31.A O no hydrogen 3.351 N/A LEU 200.A N GLN 29.A OE1 no hydrogen 2.971 N/A THR 201.A N MET 80.A O no hydrogen 3.044 N/A THR 201.A OG1 PRO 202.A O no hydrogen 3.254 N/A ILE 204.A N ALA 79.A O no hydrogen 3.198 N/A ARG 206.A NE SER 445.A O no hydrogen 3.387 N/A ARG 206.A NH2 SER 445.A O no hydrogen 3.141 N/A THR 207.A OG1 ILE 204.A O no hydrogen 2.851 N/A THR 207.A OG1 GLU 205.A O no hydrogen 3.531 N/A ARG 210.A NH1 ASN 446.A OD1 no hydrogen 3.300 N/A ARG 220.A NH1 GLN 218.A OE1 no hydrogen 3.411 N/A LEU 221.A N GLN 218.A O no hydrogen 3.079 N/A CYS 222.A SG GLN 218.A O no hydrogen 3.383 N/A THR 223.A N GLU 438.A OE1 no hydrogen 3.198 N/A HIS 224.A N ALA 229.A O no hydrogen 3.010 N/A HIS 224.A NE2 PHE 414.A O no hydrogen 3.172 N/A ARG 226.A N HIS 224.A ND1 no hydrogen 3.168 N/A ARG 226.A NE ASP 312.A OD2 no hydrogen 3.507 N/A ARG 226.A NH1 ASP 432.A O no hydrogen 2.820 N/A ARG 226.A NH2 ASP 385.A OD1 no hydrogen 2.901 N/A TRP 227.A N HIS 224.A ND1 no hydrogen 3.233 N/A VAL 231.A N CYS 222.A O no hydrogen 3.381 N/A TYR 232.A N ARG 415.A O no hydrogen 3.106 N/A GLY 233.A N ARG 415.A O no hydrogen 2.930 N/A LEU 235.A N ARG 413.A O no hydrogen 2.965 N/A VAL 236.A N LEU 489.A O no hydrogen 3.179 N/A SER 239.A N ASP 237.A OD1 no hydrogen 3.067 N/A SER 239.A OG ASP 237.A OD1 no hydrogen 2.463 N/A GLN 245.A NE2 ALA 399.A O no hydrogen 3.200 N/A TRP 246.A NE1 ASP 385.A OD2 no hydrogen 3.267 N/A GLN 247.A N ASP 312.A OD2 no hydrogen 2.785 N/A GLN 247.A NE2 GLN 245.A O no hydrogen 3.270 N/A ASN 248.A N ASP 312.A OD2 no hydrogen 3.137 N/A ASN 248.A ND2 TYR 310.A O no hydrogen 3.035 N/A ARG 250.A N THR 261.A OG1 no hydrogen 3.325 N/A ARG 250.A NH1 PRO 400.A O no hydrogen 2.522 N/A ARG 250.A NH2 PRO 400.A O no hydrogen 3.198 N/A HIS 252.A N THR 256.A O no hydrogen 2.688 N/A VAL 253.A N ASN 475.A O no hydrogen 3.178 N/A ASP 254.A N HIS 252.A ND1 no hydrogen 3.257 N/A GLY 255.A N HIS 252.A O no hydrogen 3.111 N/A THR 256.A N ASP 254.A OD1 no hydrogen 3.307 N/A THR 256.A OG1 ASP 254.A OD1 no hydrogen 3.086 N/A LEU 258.A N ARG 250.A O no hydrogen 3.086 N/A THR 260.A OG1 ASN 248.A OD1 no hydrogen 3.340 N/A THR 261.A OG1 GLN 247.A O no hydrogen 3.333 N/A THR 261.A OG1 ARG 250.A O no hydrogen 3.080 N/A THR 261.A OG1 LEU 258.A O no hydrogen 2.496 N/A SER 264.A OG SER 266.A OG no hydrogen 3.229 N/A SER 266.A N SER 264.A OG no hydrogen 3.382 N/A SER 266.A OG SER 264.A OG no hydrogen 3.229 N/A SER 269.A N GLY 309.A O no hydrogen 2.913 N/A CYS 270.A SG SER 266.A O no hydrogen 3.970 N/A CYS 270.A SG VAL 268.A O no hydrogen 3.380 N/A PHE 271.A N ALA 375.A O no hydrogen 2.985 N/A ALA 273.A N VAL 373.A O no hydrogen 2.957 N/A GLU 274.A N THR 290.A O no hydrogen 2.890 N/A ALA 275.A N GLY 371.A O no hydrogen 2.837 N/A ALA 276.A N THR 288.A O no hydrogen 2.941 N/A TYR 277.A N ASP 370.A OD1 no hydrogen 3.346 N/A GLU 278.A N VAL 286.A O no hydrogen 2.896 N/A GLU 285.A N VAL 360.A O no hydrogen 2.919 N/A VAL 286.A N GLU 278.A O no hydrogen 2.897 N/A ALA 287.A N ALA 358.A O no hydrogen 2.868 N/A THR 288.A N ALA 276.A O no hydrogen 2.883 N/A PHE 289.A N VAL 356.A O no hydrogen 2.861 N/A THR 290.A N GLU 274.A O no hydrogen 2.915 N/A LEU 291.A N GLY 354.A O no hydrogen 2.982 N/A ILE 292.A N ALA 272.A O no hydrogen 2.925 N/A GLU 293.A N SER 297.A O no hydrogen 3.387 N/A GLN 294.A NE2 TRP 267.A O no hydrogen 3.101 N/A GLN 294.A NE2 LEU 308.A O no hydrogen 3.240 N/A ASP 295.A N ASP 295.A OD1 no hydrogen 2.581 N/A GLY 296.A N GLU 293.A O no hydrogen 3.186 N/A SER 297.A OG ASP 295.A OD1 no hydrogen 3.384 N/A SER 297.A OG ASP 295.A OD2 no hydrogen 2.918 N/A TYR 299.A OH TYR 352.A O no hydrogen 3.031 N/A ARG 304.A NE ALA 306.A O no hydrogen 3.553 N/A GLY 309.A N THR 260.A O no hydrogen 2.760 N/A TYR 310.A N PRO 307.A O no hydrogen 3.162 N/A SER 314.A N GLN 384.A O no hydrogen 2.990 N/A SER 314.A OG THR 386.A O no hydrogen 2.993 N/A GLN 316.A N TYR 381.A O no hydrogen 2.906 N/A LEU 317.A N MET 339.A O no hydrogen 2.875 N/A GLU 318.A N SER 379.A O no hydrogen 2.890 N/A ILE 319.A N PHE 337.A O no hydrogen 2.923 N/A ILE 321.A N THR 335.A O no hydrogen 2.955 N/A THR 323.A N LYS 333.A O no hydrogen 2.882 N/A THR 323.A OG1 LYS 333.A O no hydrogen 3.358 N/A THR 323.A OG1 THR 335.A OG1 no hydrogen 2.519 N/A THR 325.A N LYS 331.A O no hydrogen 3.239 N/A THR 325.A OG1 ASP 367.A OD1 no hydrogen 3.431 N/A THR 326.A N ASP 367.A OD1 no hydrogen 3.180 N/A THR 326.A OG1 ASP 367.A O no hydrogen 2.714 N/A LYS 327.A N THR 325.A OG1 no hydrogen 3.204 N/A LYS 327.A NZ ASP 367.A OD2 no hydrogen 2.756 N/A LYS 333.A N THR 323.A O no hydrogen 2.945 N/A LYS 333.A NZ ASP 330.A OD2 no hydrogen 3.010 N/A THR 335.A N ILE 321.A O no hydrogen 2.895 N/A THR 335.A OG1 THR 323.A OG1 no hydrogen 2.519 N/A PHE 337.A N ILE 319.A O no hydrogen 2.867 N/A GLU 338.A N SER 359.A O no hydrogen 3.063 N/A MET 339.A N LEU 317.A O no hydrogen 2.893 N/A LEU 341.A N GLY 315.A O no hydrogen 2.883 N/A GLY 342.A N GLY 315.A O no hydrogen 3.276 N/A THR 345.A N THR 344.A OG1 no hydrogen 2.680 N/A GLN 349.A NE2 ILE 340.A O no hydrogen 2.906 N/A ALA 350.A N ARG 355.A O no hydrogen 3.463 N/A TYR 352.A N TYR 390.A O no hydrogen 3.295 N/A GLN 353.A N ALA 350.A O no hydrogen 3.043 N/A GLY 354.A N ALA 350.A O no hydrogen 2.931 N/A GLY 354.A N PRO 351.A O no hydrogen 3.159 N/A ARG 355.A N ALA 350.A O no hydrogen 3.237 N/A VAL 356.A N PHE 289.A O no hydrogen 2.944 N/A PHE 357.A N GLN 349.A OE1 no hydrogen 3.401 N/A ALA 358.A N ALA 287.A O no hydrogen 2.942 N/A SER 359.A N GLU 338.A O no hydrogen 3.310 N/A VAL 360.A N GLU 285.A O no hydrogen 2.901 N/A THR 361.A OG1 THR 283.A O no hydrogen 3.422 N/A VAL 369.A N GLU 324.A O no hydrogen 3.193 N/A GLY 371.A N ALA 275.A O no hydrogen 2.994 N/A VAL 373.A N ALA 273.A O no hydrogen 2.899 N/A ARG 374.A NH2 SER 266.A O no hydrogen 3.127 N/A ALA 375.A N PHE 271.A O no hydrogen 2.856 N/A ARG 378.A N GLU 318.A O no hydrogen 2.631 N/A ILE 380.A N ARG 419.A O no hydrogen 3.160 N/A TYR 381.A N GLN 316.A O no hydrogen 2.883 N/A GLN 384.A N SER 314.A O no hydrogen 3.333 N/A GLU 389.A N LEU 341.A O no hydrogen 3.373 N/A ALA 399.A N GLN 247.A OE1 no hydrogen 3.475 N/A ILE 402.A N PRO 244.A O no hydrogen 3.017 N/A LEU 406.A N GLU 409.A OE1 no hydrogen 2.829 N/A GLU 409.A N LEU 406.A O no hydrogen 3.061 N/A VAL 410.A N LEU 481.A O no hydrogen 2.887 N/A LEU 412.A N ILE 479.A O no hydrogen 3.120 N/A ARG 413.A N LEU 235.A O no hydrogen 2.897 N/A ARG 413.A NH2 PRO 241.A O no hydrogen 2.987 N/A PHE 414.A N CYS 433.A O no hydrogen 2.932 N/A ARG 415.A N GLY 233.A O no hydrogen 2.873 N/A ARG 415.A NE ASP 432.A OD1 no hydrogen 3.022 N/A ARG 415.A NH2 ASP 432.A OD2 no hydrogen 3.376 N/A THR 416.A N ILE 431.A O no hydrogen 2.951 N/A THR 416.A OG1 PRO 230.A O no hydrogen 2.542 N/A MET 418.A N GLU 429.A O no hydrogen 2.912 N/A ILE 421.A N ILE 380.A O no hydrogen 2.898 N/A ALA 424.A N ASP 422.A OD1 no hydrogen 3.314 N/A ALA 427.A N ASP 425.A OD1 no hydrogen 3.280 N/A ILE 431.A N THR 416.A O no hydrogen 2.891 N/A CYS 433.A N PHE 414.A O no hydrogen 2.876 N/A CYS 433.A SG PHE 414.A O no hydrogen 3.775 N/A CYS 433.A SG LEU 435.A O no hydrogen 3.551 N/A GLN 437.A N THR 223.A O no hydrogen 2.740 N/A GLN 437.A NE2 ILE 263.A O no hydrogen 3.455 N/A PHE 439.A N PRO 436.A O no hydrogen 3.246 N/A TRP 442.A NE1 ASP 213.A O no hydrogen 3.092 N/A ALA 444.A N ASN 446.A O no hydrogen 3.244 N/A ASN 446.A ND2 TRP 442.A O no hydrogen 3.156 N/A SER 452.A OG VAL 503.A O no hydrogen 3.281 N/A ALA 454.A N VAL 503.A O no hydrogen 2.961 N/A LEU 455.A N LEU 473.A O no hydrogen 2.816 N/A LEU 456.A N SER 501.A O no hydrogen 2.915 N/A LEU 457.A N CYS 471.A O no hydrogen 3.035 N/A ARG 458.A N GLU 498.A O no hydrogen 3.153 N/A TYR 459.A N PHE 469.A O no hydrogen 3.251 N/A TYR 459.A OH PRO 492.A O no hydrogen 2.916 N/A ARG 460.A N ILE 496.A O no hydrogen 3.365 N/A ARG 460.A NE GLU 498.A OE2 no hydrogen 3.223 N/A ASN 461.A N GLN 466.A O no hydrogen 3.032 N/A ASN 461.A ND2 LEU 463.A O no hydrogen 2.257 N/A THR 464.A OG1 LEU 463.A O no hydrogen 2.744 N/A LEU 468.A N TYR 459.A O no hydrogen 2.901 N/A CYS 471.A N LEU 457.A O no hydrogen 3.180 N/A CYS 471.A SG LEU 457.A O no hydrogen 3.683 N/A LYS 472.A N ALA 480.A O no hydrogen 3.271 N/A LYS 472.A NZ TYR 474.A OH no hydrogen 3.398 N/A LYS 472.A NZ TYR 507.A O no hydrogen 3.201 N/A LEU 473.A N LEU 455.A O no hydrogen 2.652 N/A TYR 474.A N TYR 478.A O no hydrogen 3.125 N/A TYR 474.A OH GLU 409.A OE1 no hydrogen 3.186 N/A GLY 477.A N TYR 474.A O no hydrogen 3.171 N/A TYR 478.A OH PRO 404.A O no hydrogen 3.207 N/A ALA 480.A N LYS 472.A O no hydrogen 3.117 N/A LEU 481.A N VAL 410.A O no hydrogen 2.903 N/A TYR 483.A N GLY 408.A O no hydrogen 3.255 N/A TYR 483.A OH GLY 487.A O no hydrogen 3.428 N/A LEU 489.A N VAL 236.A O no hydrogen 3.148 N/A PHE 491.A N LEU 234.A O no hydrogen 3.196 N/A ILE 496.A N ARG 460.A O no hydrogen 3.097 N/A GLU 498.A N ARG 458.A O no hydrogen 3.128 N/A VAL 500.A N LEU 456.A O no hydrogen 2.943 N/A SER 501.A OG PRO 45.A O no hydrogen 2.774 N/A SER 501.A OG TRP 502.A O no hydrogen 2.946 N/A TRP 502.A N PRO 45.A O no hydrogen 3.254 N/A VAL 503.A N ALA 454.A O no hydrogen 2.865 N/A GLN 508.A N SER 50.A OG no hydrogen 3.020 N/A VAL 512.A N SER 482.A O no hydrogen 2.775 N/A