Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bub_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N GLU 23.A OE1 no hydrogen 3.463 N/A SER 3.A OG TYR 20.A O no hydrogen 2.682 N/A SER 7.A N SER 3.A O no hydrogen 3.086 N/A ASN 8.A N THR 4.A O no hydrogen 2.960 N/A LEU 9.A N ILE 5.A O no hydrogen 2.816 N/A ILE 13.A N LYS 10.A O no hydrogen 3.170 N/A LEU 14.A N GLN 71.A O no hydrogen 3.033 N/A GLU 15.A N GLN 71.A O no hydrogen 3.246 N/A ARG 17.A N TYR 69.A O no hydrogen 3.288 N/A ARG 17.A NH1 GLU 15.A OE2 no hydrogen 2.178 N/A THR 25.A N GLY 37.A O no hydrogen 3.278 N/A SER 28.A N LEU 39.A O no hydrogen 3.037 N/A LYS 33.A N HIS 30.A O no hydrogen 3.370 N/A VAL 34.A N SER 31.A O no hydrogen 2.976 N/A LYS 35.A N ASP 38.A OD2 no hydrogen 3.294 N/A GLY 37.A N GLY 53.A O no hydrogen 2.620 N/A LEU 39.A N GLY 26.A O no hydrogen 2.836 N/A PHE 40.A N ALA 56.A O no hydrogen 2.836 N/A ILE 41.A N SER 28.A O no hydrogen 3.111 N/A CYS 42.A N VAL 58.A O no hydrogen 2.953 N/A ARG 43.A NH1 GLU 79.A OE1 no hydrogen 2.769 N/A ARG 43.A NH2 GLU 79.A OE1 no hydrogen 2.483 N/A VAL 50.A N ILE 46.A O no hydrogen 2.783 N/A LYS 52.A N GLU 49.A O no hydrogen 3.309 N/A VAL 55.A N ASP 38.A O no hydrogen 3.003 N/A VAL 57.A N PRO 68.A O no hydrogen 3.085 N/A VAL 58.A N PHE 40.A O no hydrogen 2.731 N/A VAL 59.A N ILE 70.A O no hydrogen 3.004 N/A PHE 67.A N LEU 65.A O no hydrogen 2.409 N/A TYR 69.A N ARG 17.A O no hydrogen 3.181 N/A GLN 71.A N GLU 15.A O no hydrogen 2.993 N/A VAL 72.A N VAL 59.A O no hydrogen 2.972 N/A PHE 73.A N LEU 12.A O no hydrogen 3.417 N/A SER 75.A OG CYS 42.A O no hydrogen 3.415 N/A PHE 78.A N ASP 74.A O no hydrogen 2.839 N/A GLU 79.A N SER 75.A O no hydrogen 2.824 N/A ALA 80.A N ARG 76.A O no hydrogen 3.490 N/A LYS 81.A N TYR 77.A O no hydrogen 3.231 N/A VAL 82.A N PHE 78.A O no hydrogen 2.987 N/A ALA 83.A N GLU 79.A O no hydrogen 3.012 N/A SER 84.A N ALA 80.A O no hydrogen 3.060 N/A SER 84.A OG LYS 81.A O no hydrogen 2.366 N/A SER 84.A OG ASP 89.A OD1 no hydrogen 3.482 N/A LEU 85.A N LYS 81.A O no hydrogen 3.373 N/A PHE 86.A N VAL 82.A O no hydrogen 3.107 N/A PHE 87.A N ALA 83.A O no hydrogen 3.157 N/A GLU 88.A N LEU 85.A O no hydrogen 2.271 N/A ASP 89.A N SER 84.A O no hydrogen 2.633 N/A TRP 91.A NE1 GLY 177.A O no hydrogen 2.844 N/A LYS 92.A N ASP 89.A O no hydrogen 3.448 N/A VAL 94.A N TRP 91.A O no hydrogen 3.306 N/A LEU 95.A N LYS 159.A O no hydrogen 2.654 N/A THR 96.A N ASP 181.A OD2 no hydrogen 3.065 N/A THR 96.A OG1 VAL 94.A O no hydrogen 3.017 N/A PHE 97.A N PHE 161.A O no hydrogen 2.882 N/A GLY 98.A N VAL 182.A O no hydrogen 3.477 N/A VAL 99.A N LEU 163.A O no hydrogen 3.148 N/A THR 100.A N ILE 184.A O no hydrogen 3.022 N/A THR 100.A OG1 VAL 165.A O no hydrogen 3.212 N/A GLY 101.A N THR 100.A OG1 no hydrogen 2.678 N/A THR 102.A N ASN 187.A O no hydrogen 3.044 N/A THR 102.A OG1 TYR 202.A OH no hydrogen 2.572 N/A ASN 103.A N ASN 187.A OD1 no hydrogen 2.726 N/A LYS 105.A NZ GLY 101.A O no hydrogen 3.090 N/A THR 106.A OG1 GLU 164.A OE1 no hydrogen 2.507 N/A THR 108.A N GLY 104.A O no hydrogen 3.004 N/A THR 108.A OG1 GLY 104.A O no hydrogen 3.034 N/A THR 109.A N LYS 105.A O no hydrogen 3.000 N/A THR 109.A OG1 LYS 105.A O no hydrogen 2.829 N/A TYR 111.A N THR 109.A O no hydrogen 2.963 N/A HIS 112.A NE2 THR 307.A OG1 no hydrogen 2.596 N/A THR 114.A N TYR 111.A O no hydrogen 3.260 N/A THR 114.A OG1 HIS 112.A O no hydrogen 3.427 N/A SER 115.A N HIS 112.A O no hydrogen 3.106 N/A GLY 117.A N THR 114.A O no hydrogen 2.694 N/A ARG 119.A NH1 GLY 156.A O no hydrogen 3.151 N/A ARG 119.A NH1 GLY 157.A O no hydrogen 3.049 N/A SER 121.A OG ARG 129.A O no hydrogen 2.616 N/A SER 121.A OG ILE 130.A O no hydrogen 3.001 N/A VAL 122.A N ARG 129.A O no hydrogen 3.215 N/A LEU 123.A N ALA 162.A O no hydrogen 2.920 N/A THR 124.A N VAL 127.A O no hydrogen 3.125 N/A THR 124.A OG1 VAL 127.A O no hydrogen 3.012 N/A VAL 127.A N THR 124.A OG1 no hydrogen 2.995 N/A ARG 129.A N VAL 122.A O no hydrogen 2.931 N/A ASP 143.A N THR 146.A OG1 no hydrogen 3.081 N/A THR 146.A N ASP 143.A OD1 no hydrogen 2.826 N/A THR 146.A OG1 ASP 143.A O no hydrogen 3.128 N/A THR 146.A OG1 ASP 143.A OD1 no hydrogen 3.387 N/A LEU 148.A N ALA 144.A O no hydrogen 3.067 N/A SER 149.A N ILE 145.A O no hydrogen 2.701 N/A ALA 150.A N THR 146.A O no hydrogen 3.135 N/A ALA 150.A N ILE 147.A O no hydrogen 2.930 N/A GLU 152.A N SER 149.A O no hydrogen 3.273 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.987 N/A ASN 153.A ND2 PHE 160.A O no hydrogen 2.729 N/A GLU 155.A N LYS 151.A O no hydrogen 3.284 N/A GLY 156.A N GLU 152.A O no hydrogen 2.845 N/A GLY 157.A N ARG 154.A O no hydrogen 2.883 N/A GLY 158.A N ASN 153.A O no hydrogen 2.845 N/A PHE 161.A N LEU 95.A O no hydrogen 2.941 N/A ALA 162.A N SER 121.A O no hydrogen 2.711 N/A LEU 163.A N PHE 97.A O no hydrogen 2.858 N/A GLU 164.A N LEU 123.A O no hydrogen 2.984 N/A VAL 165.A N VAL 99.A O no hydrogen 2.862 N/A SER 167.A OG ASP 194.A OD2 no hydrogen 3.564 N/A LEU 170.A N SER 166.A O no hydrogen 3.130 N/A VAL 171.A N HIS 168.A O no hydrogen 2.823 N/A GLN 172.A N HIS 168.A O no hydrogen 3.406 N/A ARG 174.A N ALA 169.A O no hydrogen 3.008 N/A GLU 176.A N GLN 173.A O no hydrogen 3.183 N/A PHE 180.A N LEU 212.A O no hydrogen 2.958 N/A ASP 181.A N THR 96.A O no hydrogen 3.206 N/A VAL 182.A N THR 96.A O no hydrogen 3.239 N/A ILE 184.A N GLY 98.A O no hydrogen 2.896 N/A PHE 185.A N VAL 220.A O no hydrogen 2.906 N/A THR 186.A N THR 100.A O no hydrogen 2.998 N/A THR 186.A OG1 THR 100.A O no hydrogen 3.172 N/A THR 186.A OG1 ASN 103.A O no hydrogen 2.898 N/A SER 189.A N THR 102.A OG1 no hydrogen 3.192 N/A ASP 191.A N SER 189.A OG no hydrogen 3.279 N/A TYR 202.A N THR 198.A O no hydrogen 3.064 N/A TYR 202.A OH THR 102.A OG1 no hydrogen 2.572 N/A LEU 203.A N PHE 199.A O no hydrogen 2.808 N/A LEU 203.A N GLU 200.A O no hydrogen 3.231 N/A LYS 204.A N GLU 200.A O no hydrogen 2.803 N/A LYS 204.A NZ GLU 200.A OE2 no hydrogen 2.923 N/A ALA 205.A N ASN 201.A O no hydrogen 3.340 N/A LYS 206.A N LEU 203.A O no hydrogen 2.784 N/A LYS 206.A NZ SER 167.A OG no hydrogen 2.817 N/A LEU 207.A N LEU 203.A O no hydrogen 3.107 N/A LEU 207.A N LYS 204.A O no hydrogen 2.965 N/A HIS 208.A ND1 ASP 211.A OD2 no hydrogen 2.823 N/A HIS 208.A NE2 GLU 176.A OE1 no hydrogen 3.282 N/A HIS 208.A NE2 GLU 176.A OE2 no hydrogen 2.455 N/A PHE 210.A N LEU 207.A O no hydrogen 2.771 N/A LYS 214.A N PHE 180.A O no hydrogen 2.686 N/A LYS 214.A NZ TRP 91.A O no hydrogen 2.847 N/A LYS 214.A NZ ASP 181.A OD1 no hydrogen 3.201 N/A LYS 214.A NZ ASP 181.A OD2 no hydrogen 3.089 N/A GLY 217.A N LYS 214.A O no hydrogen 2.653 N/A VAL 218.A N ASP 181.A O no hydrogen 3.164 N/A ALA 219.A N ARG 234.A O no hydrogen 2.753 N/A VAL 220.A N GLY 183.A O no hydrogen 2.608 N/A LEU 221.A N ILE 236.A O no hydrogen 2.623 N/A GLU 223.A N PHE 238.A O no hydrogen 2.789 N/A LEU 225.A N ASN 222.A O no hydrogen 2.926 N/A ALA 226.A N GLU 223.A O no hydrogen 2.761 N/A ALA 228.A N LEU 225.A O no hydrogen 3.166 N/A PHE 229.A N ALA 226.A O no hydrogen 3.287 N/A ARG 231.A NE ASP 211.A OD1 no hydrogen 2.879 N/A ILE 236.A N ALA 219.A O no hydrogen 2.814 N/A THR 237.A N ASP 245.A OD2 no hydrogen 3.056 N/A PHE 238.A N LEU 221.A O no hydrogen 3.035 N/A GLY 239.A N TYR 246.A O no hydrogen 2.936 N/A SER 241.A OG ASN 243.A OD1 no hydrogen 3.022 N/A ALA 244.A N SER 241.A O no hydrogen 3.323 N/A TYR 246.A N THR 237.A O no hydrogen 2.934 N/A TYR 246.A OH HIS 292.A ND1 no hydrogen 2.431 N/A TYR 246.A OH GLN 293.A OE1 no hydrogen 2.584 N/A ARG 247.A N GLU 263.A O no hydrogen 3.122 N/A ARG 247.A NH1 GLU 263.A OE1 no hydrogen 2.765 N/A LEU 248.A N GLY 239.A O no hydrogen 2.698 N/A GLU 252.A N GLN 259.A O no hydrogen 2.623 N/A GLY 257.A N SER 254.A O no hydrogen 2.569 N/A THR 258.A N ALA 275.A O no hydrogen 3.187 N/A THR 258.A OG1 ALA 275.A O no hydrogen 2.924 N/A THR 258.A OG1 GLY 277.A O no hydrogen 2.646 N/A GLN 259.A N GLU 252.A O no hydrogen 3.249 N/A PHE 260.A N VAL 271.A O no hydrogen 2.817 N/A LEU 262.A N LEU 269.A O no hydrogen 2.972 N/A GLU 263.A N ARG 247.A O no hydrogen 2.731 N/A THR 264.A OG1 ASP 266.A OD1 no hydrogen 3.138 N/A ASP 266.A N THR 264.A OG1 no hydrogen 3.149 N/A LEU 269.A N LEU 262.A O no hydrogen 3.100 N/A VAL 271.A N PHE 260.A O no hydrogen 2.809 N/A THR 273.A N THR 258.A O no hydrogen 2.985 N/A ARG 274.A N PHE 308.A O no hydrogen 3.272 N/A ASP 278.A N ASN 345.A OD1 no hydrogen 3.259 N/A ASN 280.A N GLY 277.A O no hydrogen 2.985 N/A ALA 281.A N ASP 278.A O no hydrogen 3.026 N/A TYR 282.A N PHE 279.A O no hydrogen 3.272 N/A ALA 284.A N ASN 280.A O no hydrogen 3.162 N/A ALA 285.A N ALA 281.A O no hydrogen 2.982 N/A ALA 286.A N TYR 282.A O no hydrogen 3.427 N/A ALA 287.A N ASN 283.A O no hydrogen 3.132 N/A ILE 288.A N ALA 284.A O no hydrogen 2.893 N/A ALA 289.A N ALA 285.A O no hydrogen 3.000 N/A ALA 290.A N ALA 286.A O no hydrogen 3.198 N/A LEU 291.A N ALA 287.A O no hydrogen 2.775 N/A HIS 292.A N ILE 288.A O no hydrogen 3.190 N/A HIS 292.A NE2 ASP 266.A OD2 no hydrogen 3.377 N/A GLN 293.A N ALA 289.A O no hydrogen 2.834 N/A LEU 294.A N LEU 291.A O no hydrogen 2.948 N/A ASP 300.A N ASP 297.A O no hydrogen 3.145 N/A LEU 301.A N ASP 297.A O no hydrogen 3.150 N/A ALA 302.A N PRO 298.A O no hydrogen 2.771 N/A SER 303.A N LYS 299.A O no hydrogen 3.056 N/A SER 303.A OG LYS 299.A O no hydrogen 3.013 N/A SER 304.A N LEU 301.A O no hydrogen 2.756 N/A SER 304.A OG ASP 300.A O no hydrogen 3.359 N/A THR 307.A N SER 304.A O no hydrogen 2.971 N/A THR 307.A OG1 HIS 112.A NE2 no hydrogen 2.596 N/A THR 307.A OG1 SER 304.A O no hydrogen 2.612 N/A PHE 308.A N LEU 305.A O no hydrogen 3.234 N/A GLY 313.A N GLU 316.A OE1 no hydrogen 2.917 N/A ARG 314.A N VAL 311.A O no hydrogen 2.818 N/A PHE 315.A N ASP 331.A OD1 no hydrogen 2.324 N/A GLU 316.A N VAL 330.A O no hydrogen 2.911 N/A VAL 318.A N VAL 328.A O no hydrogen 2.867 N/A ALA 321.A N VAL 318.A O no hydrogen 2.771 N/A ILE 324.A N ALA 321.A O no hydrogen 2.725 N/A ASN 327.A N ASP 430.A O no hydrogen 3.348 N/A VAL 329.A N VAL 432.A O no hydrogen 2.829 N/A VAL 330.A N GLU 316.A O no hydrogen 2.879 N/A ASP 331.A N ILE 434.A O no hydrogen 3.068 N/A HIS 334.A ND1 PHE 332.A O no hydrogen 3.239 N/A ASP 337.A N SER 335.A OG no hydrogen 3.214 N/A ALA 338.A N SER 335.A OG no hydrogen 2.814 N/A LEU 339.A N SER 335.A O no hydrogen 3.275 N/A GLU 340.A N PRO 336.A O no hydrogen 3.268 N/A LYS 341.A N ASP 337.A O no hydrogen 2.977 N/A LEU 342.A N ALA 338.A O no hydrogen 2.982 N/A LEU 343.A N LEU 339.A O no hydrogen 3.162 N/A LYS 344.A N GLU 340.A O no hydrogen 3.019 N/A ASN 345.A N LYS 341.A O no hydrogen 3.066 N/A ASN 345.A ND2 LYS 341.A O no hydrogen 2.553 N/A VAL 346.A N LEU 342.A O no hydrogen 2.820 N/A ARG 347.A N LEU 343.A O no hydrogen 2.610 N/A ARG 347.A NH2 LEU 377.A O no hydrogen 3.114 N/A ARG 347.A NH2 ASP 379.A OD1 no hydrogen 3.261 N/A LYS 348.A N LYS 344.A O no hydrogen 2.833 N/A LYS 348.A NZ ASP 278.A OD1 no hydrogen 3.549 N/A ILE 349.A N ASN 345.A O no hydrogen 3.028 N/A SER 350.A N VAL 346.A O no hydrogen 2.761 N/A SER 350.A N ARG 347.A O no hydrogen 3.227 N/A SER 350.A OG VAL 346.A O no hydrogen 2.505 N/A SER 350.A OG SER 431.A OG no hydrogen 2.791 N/A ARG 353.A N ASP 430.A OD1 no hydrogen 3.096 N/A VAL 354.A N ASP 379.A OD2 no hydrogen 2.964 N/A ILE 355.A N SER 431.A O no hydrogen 2.815 N/A VAL 356.A N VAL 380.A O no hydrogen 2.952 N/A VAL 357.A N VAL 433.A O no hydrogen 2.803 N/A PHE 358.A N ILE 382.A O no hydrogen 3.126 N/A GLY 362.A N ASP 387.A O no hydrogen 3.226 N/A ASN 363.A N GLU 391.A OE1 no hydrogen 3.115 N/A GLY 367.A N ASP 365.A OD1 no hydrogen 2.743 N/A LYS 368.A N ASP 365.A OD1 no hydrogen 2.843 N/A ARG 369.A NH1 GLU 391.A OE1 no hydrogen 3.263 N/A ARG 369.A NH1 GLU 391.A OE2 no hydrogen 2.961 N/A ARG 369.A NH2 GLU 391.A OE1 no hydrogen 3.034 N/A SER 371.A OG ARG 369.A O no hydrogen 3.190 N/A SER 371.A OG PRO 370.A O no hydrogen 3.191 N/A SER 371.A OG LEU 399.A O no hydrogen 2.582 N/A GLU 372.A N PRO 370.A O no hydrogen 3.078 N/A SER 375.A N SER 371.A O no hydrogen 2.587 N/A LYS 376.A N GLU 372.A O no hydrogen 3.288 N/A LYS 376.A N VAL 373.A O no hydrogen 3.085 N/A LEU 377.A N VAL 373.A O no hydrogen 3.110 N/A ASP 379.A N VAL 354.A O no hydrogen 2.966 N/A ILE 382.A N VAL 356.A O no hydrogen 2.784 N/A LEU 383.A N LEU 410.A O no hydrogen 2.858 N/A THR 384.A N PHE 358.A O no hydrogen 2.762 N/A THR 384.A OG1 LEU 412.A O no hydrogen 2.812 N/A ARG 389.A NH1 GLY 362.A O no hydrogen 3.079 N/A GLN 395.A N ASP 392.A O no hydrogen 2.796 N/A ILE 396.A N PRO 393.A O no hydrogen 3.069 N/A GLU 397.A N GLU 397.A OE1 no hydrogen 2.599 N/A LEU 399.A N ILE 396.A O no hydrogen 3.042 N/A GLY 402.A N LEU 399.A O no hydrogen 3.327 N/A ILE 403.A N ILE 400.A O no hydrogen 3.204 N/A ASP 404.A N SER 375.A OG no hydrogen 2.808 N/A ARG 406.A N ASP 404.A OD1 no hydrogen 3.300 N/A ARG 406.A NE ASP 404.A OD1 no hydrogen 3.339 N/A LYS 407.A NZ SER 375.A O no hydrogen 3.514 N/A LEU 410.A N VAL 381.A O no hydrogen 3.156 N/A LEU 412.A N LEU 383.A O no hydrogen 2.990 N/A ARG 415.A NE ASP 455.A OD1 no hydrogen 2.798 N/A ARG 415.A NH1 THR 385.A O no hydrogen 3.413 N/A ARG 415.A NH2 ALA 435.A O no hydrogen 3.009 N/A ARG 415.A NH2 ASP 455.A OD1 no hydrogen 3.266 N/A ARG 415.A NH2 ASP 455.A OD2 no hydrogen 2.754 N/A GLU 417.A N ASP 414.A O no hydrogen 2.963 N/A ALA 418.A N ASP 414.A O no hydrogen 2.937 N/A ILE 419.A N ARG 415.A O no hydrogen 3.018 N/A GLU 420.A N ARG 416.A O no hydrogen 3.143 N/A THR 421.A N GLU 417.A O no hydrogen 2.682 N/A THR 421.A OG1 GLU 417.A O no hydrogen 2.671 N/A ALA 422.A N ALA 418.A O no hydrogen 3.065 N/A LEU 423.A N ILE 419.A O no hydrogen 3.108 N/A THR 424.A N GLU 420.A O no hydrogen 3.304 N/A THR 424.A N THR 421.A O no hydrogen 2.826 N/A THR 424.A OG1 GLU 420.A O no hydrogen 2.903 N/A THR 424.A OG1 THR 421.A O no hydrogen 3.521 N/A ILE 425.A N THR 421.A O no hydrogen 2.969 N/A ASN 427.A N ASP 430.A OD2 no hydrogen 2.556 N/A GLY 429.A N GLY 325.A O no hydrogen 2.737 N/A ASP 430.A N ASN 427.A O no hydrogen 3.457 N/A SER 431.A N ARG 353.A O no hydrogen 2.683 N/A SER 431.A OG ASN 327.A OD1 no hydrogen 3.295 N/A SER 431.A OG SER 350.A OG no hydrogen 2.791 N/A VAL 432.A N ASN 327.A O no hydrogen 3.068 N/A VAL 433.A N ILE 355.A O no hydrogen 2.839 N/A ILE 434.A N VAL 329.A O no hydrogen 2.900 N/A ALA 435.A N VAL 357.A O no hydrogen 2.745 N/A ARG 437.A NH1 ASP 387.A OD1 no hydrogen 3.200 N/A ARG 437.A NH1 TYR 442.A O no hydrogen 3.038 N/A GLN 443.A N VAL 451.A O no hydrogen 3.010 N/A GLN 443.A NE2 ASP 386.A O no hydrogen 2.677 N/A ILE 445.A N GLN 443.A O no hydrogen 3.258 N/A ASP 446.A N LYS 449.A O no hydrogen 3.144 N/A LYS 449.A N ASP 446.A O no hydrogen 2.993 N/A PHE 453.A N ARG 441.A O no hydrogen 3.408 N/A GLN 454.A NE2 HIS 439.A ND1 no hydrogen 2.899 N/A GLN 454.A NE2 HIS 439.A O no hydrogen 3.304 N/A GLU 457.A N GLN 454.A O no hydrogen 2.780 N/A VAL 458.A N GLN 454.A O no hydrogen 3.156 N/A VAL 459.A N ASP 455.A O no hydrogen 3.482 N/A GLU 460.A N ARG 456.A O no hydrogen 3.231 N/A GLU 461.A N GLU 457.A O no hydrogen 2.703 N/A ILE 462.A N VAL 458.A O no hydrogen 3.033 N/A ILE 463.A N VAL 459.A O no hydrogen 3.086 N/A ARG 464.A N GLU 460.A O no hydrogen 2.966 N/A ASP 465.A N GLU 461.A O no hydrogen 3.001 N/A LYS 466.A N ILE 462.A O no hydrogen 2.997 N/A LEU 467.A N ILE 463.A O no hydrogen 3.067 N/A LYS 468.A N ARG 464.A O no hydrogen 3.056 N/A LYS 468.A NZ ASP 465.A OD1 no hydrogen 3.229 N/A GLY 469.A N LYS 466.A O no hydrogen 3.229 N/A