Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8iux_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N GLN 342.A O no hydrogen 3.006 N/A LYS 2.A N GLN 342.A O no hydrogen 3.202 N/A ILE 3.A N PHE 453.A O no hydrogen 2.927 N/A CYS 4.A N ARG 340.A O no hydrogen 3.161 N/A GLY 6.A N GLY 338.A O no hydrogen 3.487 N/A HIS 8.A N TRP 336.A O no hydrogen 3.303 N/A ALA 9.A N TRP 329.A O no hydrogen 2.944 N/A THR 14.A N VAL 26.A O no hydrogen 2.888 N/A VAL 16.A N VAL 24.A O no hydrogen 2.955 N/A THR 18.A N GLU 21.A O no hydrogen 3.279 N/A THR 18.A OG1 GLU 21.A O no hydrogen 3.297 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.126 N/A VAL 24.A N VAL 16.A O no hydrogen 2.761 N/A VAL 26.A N THR 14.A O no hydrogen 2.967 N/A VAL 27.A N MET 311.A O no hydrogen 3.066 N/A ALA 29.A N ASN 28.A OD1 no hydrogen 2.754 N/A THR 32.A N LEU 305.A O no hydrogen 3.168 N/A THR 32.A OG1 LEU 305.A O no hydrogen 2.552 N/A GLU 34.A N PHE 285.A O no hydrogen 2.997 N/A ARG 35.A NH1 GLU 31.A OE2 no hydrogen 2.989 N/A ARG 35.A NH1 ARG 303.A O no hydrogen 2.455 N/A THR 36.A OG1 GLU 34.A OE2 no hydrogen 2.872 N/A ASN 37.A ND2 HIS 274.A NE2 no hydrogen 3.321 N/A THR 38.A N THR 278.A O no hydrogen 2.973 N/A ARG 40.A N THR 38.A O no hydrogen 2.805 N/A ARG 40.A NE ASP 265.A OD2 no hydrogen 2.770 N/A ILE 41.A N GLN 263.A O no hydrogen 3.169 N/A CYS 42.A N THR 278.A OG1 no hydrogen 3.359 N/A SER 43.A N ASP 265.A O no hydrogen 3.026 N/A SER 43.A OG ASP 265.A O no hydrogen 3.269 N/A LYS 44.A N CYS 268.A O no hydrogen 3.140 N/A LYS 44.A NZ ASN 267.A O no hydrogen 2.510 N/A LYS 46.A NZ ASP 271.A OD1 no hydrogen 3.256 N/A LYS 46.A NZ TYR 273.A OH no hydrogen 3.326 N/A THR 48.A OG1 LYS 46.A O no hydrogen 3.046 N/A VAL 49.A N LEU 76.A O no hydrogen 3.095 N/A LEU 51.A N ILE 78.A O no hydrogen 3.136 N/A CYS 54.A SG GLY 55.A O no hydrogen 3.243 N/A GLY 55.A N SER 84.A O no hydrogen 3.082 N/A LEU 57.A N ASP 85.A OD1 no hydrogen 3.340 N/A GLY 58.A N GLY 55.A O no hydrogen 3.385 N/A THR 59.A OG1 LEU 56.A O no hydrogen 3.294 N/A GLY 62.A N GLY 58.A O no hydrogen 3.037 N/A GLN 65.A N GLN 65.A OE1 no hydrogen 2.801 N/A GLN 65.A NE2 SER 84.A O no hydrogen 3.173 N/A CYS 66.A N PRO 63.A O no hydrogen 2.978 N/A GLN 68.A N GLN 68.A OE1 no hydrogen 2.727 N/A ASP 75.A N ARG 47.A O no hydrogen 3.026 N/A LEU 76.A N ARG 47.A O no hydrogen 3.283 N/A ILE 77.A N MET 256.A O no hydrogen 3.173 N/A ILE 78.A N VAL 49.A O no hydrogen 3.169 N/A GLU 79.A N ILE 258.A O no hydrogen 3.259 N/A ARG 80.A NE ASP 50.A OD1 no hydrogen 2.920 N/A ARG 80.A NH1 VAL 262.A O no hydrogen 2.619 N/A ARG 80.A NH2 ASP 50.A OD1 no hydrogen 3.404 N/A ARG 80.A NH2 ASP 50.A OD2 no hydrogen 3.010 N/A ARG 80.A NH2 VAL 262.A O no hydrogen 3.109 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.707 N/A SER 84.A N GLN 53.A O no hydrogen 3.370 N/A SER 84.A OG VAL 86.A O no hydrogen 3.337 N/A CYS 87.A N TYR 137.A OH no hydrogen 3.429 N/A LYS 91.A N ILE 221.A O no hydrogen 3.404 N/A VAL 93.A N PHE 223.A O no hydrogen 3.119 N/A ARG 99.A N GLU 95.A O no hydrogen 3.317 N/A ARG 99.A NH1 GLU 96.A OE1 no hydrogen 3.416 N/A ARG 99.A NH2 ASP 85.A OD2 no hydrogen 3.526 N/A GLN 100.A N GLU 96.A O no hydrogen 3.435 N/A LEU 102.A N LEU 98.A O no hydrogen 3.338 N/A ARG 103.A N ARG 99.A O no hydrogen 3.203 N/A SER 105.A OG LEU 102.A O no hydrogen 2.985 N/A SER 105.A OG GLY 107.A O no hydrogen 2.874 N/A ILE 108.A N PHE 72.A O no hydrogen 3.276 N/A ASP 109.A N PHE 250.A O no hydrogen 3.242 N/A MET 113.A N ASP 246.A O no hydrogen 2.916 N/A ARG 121.A N LEU 144.A O no hydrogen 3.085 N/A THR 126.A N SER 135.A O no hydrogen 3.110 N/A ARG 131.A NE ASP 67.A OD1 no hydrogen 3.468 N/A ARG 131.A NH1 PHE 136.A O no hydrogen 2.660 N/A SER 135.A N CYS 129.A O no hydrogen 2.997 N/A TYR 137.A OH TYR 88.A O no hydrogen 3.370 N/A ALA 138.A N GLY 62.A O no hydrogen 2.848 N/A LYS 141.A N ALA 244.A O no hydrogen 2.663 N/A LEU 144.A N ARG 121.A O no hydrogen 3.010 N/A SER 145.A N LEU 185.A O no hydrogen 3.183 N/A SER 145.A OG ALA 151.A O no hydrogen 3.192 N/A SER 145.A OG LEU 185.A O no hydrogen 3.343 N/A SER 145.A OG TYR 186.A O no hydrogen 2.589 N/A MET 155.A N PHE 238.A O no hydrogen 2.896 N/A THR 156.A OG1 SER 237.A OG no hydrogen 3.150 N/A LYS 157.A N PHE 236.A O no hydrogen 3.110 N/A TYR 159.A N VAL 234.A O no hydrogen 3.037 N/A ASN 161.A N ASP 232.A O no hydrogen 2.901 N/A ASN 161.A ND2 ASN 229.A O no hydrogen 3.039 N/A ARG 163.A N ASN 161.A OD1 no hydrogen 3.314 N/A ARG 163.A NH1 ASP 109.A OD2 no hydrogen 3.227 N/A ALA 167.A N LEU 228.A O no hydrogen 3.233 N/A ILE 168.A N SER 249.A O no hydrogen 2.755 N/A ILE 169.A N LEU 226.A O no hydrogen 3.396 N/A TRP 171.A N HIS 224.A O no hydrogen 3.209 N/A GLY 172.A N ILE 243.A O no hydrogen 3.114 N/A ILE 173.A N ASP 222.A O no hydrogen 3.056 N/A HIS 175.A N ARG 220.A O no hydrogen 3.133 N/A HIS 175.A NE2 ASP 222.A OD2 no hydrogen 2.699 N/A SER 176.A OG SER 178.A O no hydrogen 3.406 N/A ALA 180.A N SER 178.A OG no hydrogen 3.237 N/A GLU 181.A N SER 178.A OG no hydrogen 3.352 N/A GLN 182.A N SER 178.A O no hydrogen 3.337 N/A THR 183.A N THR 179.A O no hydrogen 3.117 N/A THR 183.A OG1 THR 179.A O no hydrogen 3.289 N/A THR 183.A OG1 ALA 180.A O no hydrogen 3.109 N/A TYR 186.A N GLN 182.A O no hydrogen 3.018 N/A LYS 191.A NZ SER 188.A O no hydrogen 2.887 N/A LYS 191.A NZ GLY 189.A O no hydrogen 3.071 N/A LEU 192.A N ASN 239.A OD1 no hydrogen 3.038 N/A VAL 193.A N PHE 204.A O no hydrogen 3.399 N/A THR 194.A N SER 237.A O no hydrogen 2.943 N/A THR 194.A OG1 SER 237.A O no hydrogen 3.474 N/A GLY 196.A N THR 235.A O no hydrogen 3.007 N/A SER 197.A N TYR 200.A O no hydrogen 3.094 N/A SER 198.A OG ASP 232.A OD1 no hydrogen 2.620 N/A SER 198.A OG ASP 232.A OD2 no hydrogen 3.308 N/A ASN 199.A N SER 197.A OG no hydrogen 3.155 N/A SER 203.A OG GLN 202.A O no hydrogen 2.676 N/A PHE 204.A N VAL 193.A O no hydrogen 3.181 N/A GLY 209.A N SER 176.A O no hydrogen 3.479 N/A LEU 217.A N VAL 214.A O no hydrogen 3.190 N/A ARG 220.A N HIS 175.A O no hydrogen 3.255 N/A ILE 221.A N PRO 89.A O no hydrogen 3.209 N/A ASP 222.A N ILE 173.A O no hydrogen 3.146 N/A PHE 223.A N LYS 91.A O no hydrogen 3.095 N/A HIS 224.A N TRP 171.A O no hydrogen 3.108 N/A LEU 226.A N ILE 169.A O no hydrogen 3.350 N/A THR 233.A N ASP 232.A OD1 no hydrogen 2.588 N/A THR 233.A OG1 TYR 159.A O no hydrogen 2.660 N/A VAL 234.A N TYR 159.A O no hydrogen 3.047 N/A THR 235.A N GLY 196.A O no hydrogen 2.783 N/A PHE 236.A N LYS 157.A O no hydrogen 3.033 N/A SER 237.A N THR 194.A O no hydrogen 3.197 N/A SER 237.A OG THR 156.A OG1 no hydrogen 3.150 N/A PHE 238.A N MET 155.A O no hydrogen 3.184 N/A ASN 239.A ND2 ASN 190.A O no hydrogen 3.270 N/A ILE 243.A N GLY 172.A O no hydrogen 2.917 N/A ALA 244.A N LYS 141.A O no hydrogen 2.889 N/A ASP 246.A N GLU 139.A O no hydrogen 2.864 N/A ARG 247.A N GLU 139.A OE1 no hydrogen 3.385 N/A ARG 247.A NH2 LYS 110.A O no hydrogen 3.354 N/A ALA 248.A N GLU 111.A O no hydrogen 2.663 N/A PHE 250.A N ASP 109.A O no hydrogen 2.774 N/A ARG 252.A NE ILE 108.A O no hydrogen 3.343 N/A GLY 253.A N SER 105.A O no hydrogen 2.688 N/A SER 255.A OG ARG 103.A O no hydrogen 2.696 N/A MET 256.A N ASP 75.A O no hydrogen 3.260 N/A ILE 258.A N ILE 77.A O no hydrogen 2.928 N/A GLN 259.A NE2 ASN 383.A OD1 no hydrogen 2.550 N/A SER 260.A N GLU 79.A O no hydrogen 3.448 N/A VAL 262.A N SER 260.A OG no hydrogen 3.171 N/A ASP 265.A N ILE 41.A O no hydrogen 2.722 N/A ASN 267.A N ASP 265.A OD1 no hydrogen 3.414 N/A TYR 273.A N VAL 293.A O no hydrogen 3.049 N/A TYR 273.A OH CYS 42.A O no hydrogen 2.626 N/A HIS 274.A N GLY 277.A O no hydrogen 3.341 N/A GLY 276.A N HIS 274.A ND1 no hydrogen 3.075 N/A THR 278.A N THR 38.A O no hydrogen 2.833 N/A THR 278.A OG1 ARG 40.A O no hydrogen 2.737 N/A ILE 279.A N CYS 272.A O no hydrogen 3.062 N/A SER 281.A OG GLU 34.A OE1 no hydrogen 2.858 N/A LEU 283.A N SER 281.A OG no hydrogen 3.187 N/A GLN 286.A N ARG 298.A O no hydrogen 2.809 N/A GLN 286.A NE2 ASP 289.A O no hydrogen 3.323 N/A GLN 286.A NE2 PRO 297.A O no hydrogen 3.519 N/A ASN 287.A N GLU 34.A O no hydrogen 3.042 N/A ILE 288.A N GLN 286.A OE1 no hydrogen 3.093 N/A ARG 291.A N ASP 289.A OD2 no hydrogen 3.138 N/A ARG 291.A NE ASP 382.A OD1 no hydrogen 3.496 N/A ARG 291.A NE ASP 382.A OD2 no hydrogen 3.211 N/A ARG 291.A NH2 ASP 382.A OD1 no hydrogen 2.986 N/A VAL 293.A N TYR 273.A O no hydrogen 2.940 N/A GLY 294.A N PHE 378.A O no hydrogen 3.187 N/A LYS 295.A N ASP 271.A O no hydrogen 3.169 N/A CYS 296.A SG VAL 293.A O no hydrogen 3.329 N/A ARG 298.A N PRO 284.A O no hydrogen 3.102 N/A VAL 300.A N GLN 286.A O no hydrogen 3.178 N/A LYS 301.A NZ GLU 405.A OE1 no hydrogen 2.676 N/A LYS 301.A NZ GLU 405.A OE2 no hydrogen 2.978 N/A GLN 302.A NE2 SER 408.A O no hydrogen 3.226 N/A SER 304.A OG GLU 31.A OE1 no hydrogen 3.283 N/A LEU 305.A N GLU 31.A OE2 no hydrogen 3.463 N/A LEU 307.A N THR 30.A O no hydrogen 2.708 N/A ALA 308.A N ASN 419.A OD1 no hydrogen 2.672 N/A THR 309.A N ASN 28.A O no hydrogen 3.145 N/A THR 309.A OG1 THR 309.A O no hydrogen 2.563 N/A ASN 313.A N GLU 25.A O no hydrogen 3.203 N/A ASN 313.A ND2 VAL 10.A O no hydrogen 2.577 N/A PHE 318.A N ASP 427.A OD2 no hydrogen 3.342 N/A ALA 320.A N ASP 427.A OD1 no hydrogen 3.202 N/A ILE 321.A N ASP 427.A OD1 no hydrogen 3.076 N/A GLY 323.A N ALA 320.A O no hydrogen 3.221 N/A PHE 324.A N GLY 319.A O no hydrogen 3.421 N/A ASN 327.A ND2 GLU 316.A OE1 no hydrogen 2.356 N/A GLY 328.A N VAL 314.A O no hydrogen 2.850 N/A TRP 329.A N HIS 7.A O no hydrogen 2.711 N/A TRP 336.A N THR 356.A OG1 no hydrogen 3.126 N/A TYR 337.A OH ALA 426.A O no hydrogen 2.793 N/A GLY 338.A N GLY 6.A O no hydrogen 3.162 N/A ARG 340.A N CYS 4.A O no hydrogen 3.151 N/A HIS 341.A N GLY 348.A O no hydrogen 3.262 N/A GLN 342.A N LYS 2.A O no hydrogen 3.034 N/A ASN 343.A N GLY 346.A O no hydrogen 3.147 N/A ASN 343.A ND2 CYS 459.A O no hydrogen 2.879 N/A GLN 345.A N ASN 343.A OD1 no hydrogen 3.194 N/A GLY 346.A N ASN 343.A O no hydrogen 3.252 N/A ALA 350.A N PHE 339.A O no hydrogen 2.887 N/A ASP 352.A N TYR 337.A O no hydrogen 2.869 N/A SER 355.A N ASP 352.A OD2 no hydrogen 2.906 N/A SER 355.A OG ASP 352.A OD2 no hydrogen 2.906 N/A THR 356.A OG1 ASP 352.A O no hydrogen 2.703 N/A GLN 357.A N TYR 353.A O no hydrogen 3.107 N/A ALA 359.A N THR 356.A O no hydrogen 3.165 N/A ILE 360.A N THR 356.A O no hydrogen 3.147 N/A GLN 362.A N ALA 359.A O no hydrogen 3.345 N/A ILE 363.A N ALA 359.A O no hydrogen 3.217 N/A THR 364.A N ILE 360.A O no hydrogen 2.998 N/A THR 364.A OG1 ILE 360.A O no hydrogen 2.973 N/A LYS 366.A N ILE 363.A O no hydrogen 3.065 N/A LYS 366.A NZ GLU 418.A O no hydrogen 3.550 N/A LYS 366.A NZ HIS 421.A ND1 no hydrogen 3.083 N/A LYS 366.A NZ THR 422.A OG1 no hydrogen 2.796 N/A LEU 367.A N ILE 363.A O no hydrogen 3.243 N/A ASN 368.A N THR 364.A O no hydrogen 3.058 N/A ARG 369.A N LYS 366.A O no hydrogen 3.280 N/A LEU 370.A N LYS 366.A O no hydrogen 3.213 N/A ILE 371.A N LEU 367.A O no hydrogen 3.100 N/A LYS 373.A NZ ASN 282.A OD1 no hydrogen 2.833 N/A LYS 379.A NZ SER 255.A O no hydrogen 3.546 N/A ASN 383.A ND2 GLU 96.A OE1 no hydrogen 3.234 N/A GLU 384.A N GLN 259.A OE1 no hydrogen 3.227 N/A GLN 391.A N GLU 389.A OE1 no hydrogen 3.136 N/A GLN 391.A N GLU 389.A OE2 no hydrogen 3.381 N/A ILE 392.A N GLU 389.A OE1 no hydrogen 3.211 N/A GLY 393.A N GLU 389.A O no hydrogen 2.844 N/A ASN 394.A N LYS 390.A O no hydrogen 3.286 N/A VAL 395.A N ILE 392.A O no hydrogen 3.276 N/A ILE 396.A N ILE 392.A O no hydrogen 3.270 N/A ASN 397.A N GLY 393.A O no hydrogen 3.339 N/A TRP 398.A N ASN 394.A O no hydrogen 3.299 N/A THR 399.A N VAL 395.A O no hydrogen 3.048 N/A THR 399.A OG1 VAL 395.A O no hydrogen 2.943 N/A ARG 400.A N ILE 396.A O no hydrogen 3.080 N/A ARG 400.A NH1 ASP 382.A OD2 no hydrogen 3.462 N/A ARG 400.A NH2 ASP 382.A OD2 no hydrogen 3.462 N/A ASP 401.A N ASN 397.A O no hydrogen 3.179 N/A SER 402.A N THR 399.A O no hydrogen 3.160 N/A SER 402.A OG TRP 398.A O no hydrogen 2.924 N/A ILE 403.A N THR 399.A O no hydrogen 3.131 N/A THR 404.A N ARG 400.A O no hydrogen 3.195 N/A THR 404.A OG1 ARG 400.A O no hydrogen 2.812 N/A TRP 407.A N ILE 403.A O no hydrogen 3.131 N/A SER 408.A N THR 404.A O no hydrogen 3.160 N/A SER 408.A OG THR 404.A O no hydrogen 2.901 N/A SER 408.A OG GLU 405.A O no hydrogen 3.504 N/A TYR 409.A N VAL 406.A O no hydrogen 3.156 N/A ASN 410.A N VAL 406.A O no hydrogen 3.050 N/A ALA 411.A N TRP 407.A O no hydrogen 3.011 N/A LEU 413.A N TYR 409.A O no hydrogen 3.209 N/A LEU 414.A N ASN 410.A O no hydrogen 3.349 N/A VAL 415.A N ALA 411.A O no hydrogen 3.220 N/A ALA 416.A N GLU 412.A O no hydrogen 3.357 N/A MET 417.A N LEU 413.A O no hydrogen 3.238 N/A GLU 418.A N LEU 414.A O no hydrogen 2.926 N/A GLU 418.A N VAL 415.A O no hydrogen 2.988 N/A ASN 419.A N VAL 415.A O no hydrogen 2.925 N/A ASN 419.A ND2 ASN 17.A O no hydrogen 3.250 N/A ASN 419.A ND2 LEU 306.A O no hydrogen 3.266 N/A GLN 420.A NE2 ASP 424.A OD2 no hydrogen 3.504 N/A HIS 421.A N MET 417.A O no hydrogen 3.321 N/A THR 422.A N GLU 418.A O no hydrogen 3.260 N/A THR 422.A OG1 GLU 418.A O no hydrogen 2.719 N/A ILE 423.A N ASN 419.A O no hydrogen 3.307 N/A LEU 425.A N THR 422.A O no hydrogen 3.116 N/A ALA 426.A N THR 422.A O no hydrogen 3.210 N/A SER 428.A N ASP 424.A O no hydrogen 3.345 N/A LYS 432.A N SER 428.A O no hydrogen 3.081 N/A LYS 432.A NZ GLU 429.A OE2 no hydrogen 2.943 N/A TYR 434.A N MET 430.A O no hydrogen 3.157 N/A GLU 435.A N ASP 431.A O no hydrogen 3.341 N/A ARG 436.A N LYS 432.A O no hydrogen 3.186 N/A LYS 438.A N TYR 434.A O no hydrogen 3.129 N/A ARG 439.A N GLU 435.A O no hydrogen 3.369 N/A ARG 439.A NE GLU 435.A O no hydrogen 3.204 N/A GLN 440.A N ARG 436.A O no hydrogen 3.145 N/A LEU 441.A N VAL 437.A O no hydrogen 3.292 N/A LEU 441.A N LYS 438.A O no hydrogen 3.145 N/A GLU 446.A N GLU 454.A O no hydrogen 3.502 N/A ASP 448.A N CYS 452.A O no hydrogen 3.170 N/A THR 450.A OG1 ASP 448.A OD2 no hydrogen 3.395 N/A CYS 452.A SG PHE 453.A O no hydrogen 3.664 N/A PHE 453.A N ILE 3.A O no hydrogen 2.915 N/A GLU 454.A N GLU 446.A O no hydrogen 3.307 N/A ILE 455.A N ASP 1.A O no hydrogen 2.918 N/A PHE 456.A N ASN 444.A O no hydrogen 3.170 N/A HIS 457.A NE2 TYR 472.A OH no hydrogen 2.927 N/A CYS 463.A N ASP 460.A OD1 no hydrogen 3.271 N/A MET 464.A N ASP 460.A O no hydrogen 2.710 N/A ALA 465.A N ASP 461.A O no hydrogen 3.249 N/A SER 466.A N CYS 463.A O no hydrogen 3.089 N/A SER 466.A OG CYS 463.A O no hydrogen 2.391 N/A ILE 467.A N MET 464.A O no hydrogen 3.317 N/A ARG 468.A NE MET 464.A O no hydrogen 3.567 N/A ASN 469.A N ALA 465.A O no hydrogen 3.428 N/A ASN 470.A N ILE 467.A O no hydrogen 3.422 N/A THR 471.A N SER 466.A O no hydrogen 2.918 N/A THR 471.A OG1 ASN 469.A O no hydrogen 3.134 N/A TYR 472.A OH HIS 457.A NE2 no hydrogen 2.927 N/A ARG 475.A N ASP 473.A OD1 no hydrogen 3.415 N/A ARG 475.A NH1 GLU 479.A OE2 no hydrogen 3.102 N/A LYS 476.A NZ TYR 477.A OH no hydrogen 3.145 N/A TYR 477.A N HIS 474.A O no hydrogen 3.242 N/A ALA 481.A N TYR 477.A O no hydrogen 3.243 N/A GLN 483.A N GLU 480.A O no hydrogen 3.350 N/A