Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bqm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N SER 117.A O no hydrogen 2.907 N/A SER 3.A OG TRP 212.A O no hydrogen 2.630 N/A THR 7.A OG1 VAL 8.A O no hydrogen 3.443 N/A LYS 13.A N ARG 83.A O no hydrogen 3.054 N/A MET 16.A N LYS 13.A O no hydrogen 3.057 N/A LYS 20.A NZ ASP 17.A OD2 no hydrogen 3.147 N/A GLN 23.A NE2 VAL 60.A O no hydrogen 3.278 N/A GLU 29.A N GLU 28.A OE1 no hydrogen 3.280 N/A LYS 30.A NZ ALA 62.A O no hydrogen 3.300 N/A ILE 31.A N THR 27.A O no hydrogen 3.316 N/A LYS 32.A N GLU 28.A O no hydrogen 3.022 N/A ALA 33.A N LYS 30.A O no hydrogen 3.130 N/A LEU 34.A N ILE 31.A O no hydrogen 3.115 N/A VAL 35.A N ILE 31.A O no hydrogen 2.857 N/A CYS 38.A N LEU 34.A O no hydrogen 2.881 N/A THR 39.A N VAL 35.A O no hydrogen 3.086 N/A THR 39.A OG1 VAL 35.A O no hydrogen 3.024 N/A THR 39.A OG1 TYR 144.A OH no hydrogen 3.099 N/A GLU 40.A N ILE 37.A O no hydrogen 3.378 N/A MET 41.A N CYS 38.A O no hydrogen 3.169 N/A GLU 42.A N CYS 38.A O no hydrogen 3.104 N/A GLY 45.A N GLU 42.A O no hydrogen 2.909 N/A LYS 46.A N MET 41.A O no hydrogen 2.881 N/A LYS 46.A NZ GLU 44.A OE1 no hydrogen 3.507 N/A SER 48.A OG ILE 47.A O no hydrogen 2.569 N/A SER 48.A OG ASN 147.A OD1 no hydrogen 2.872 N/A ILE 50.A N SER 48.A O no hydrogen 3.039 N/A TYR 56.A OH ASP 17.A OD1 no hydrogen 3.121 N/A ASN 57.A ND2 VAL 21.A O no hydrogen 3.606 N/A THR 58.A N ASN 57.A OD1 no hydrogen 2.606 N/A THR 58.A OG1 ASN 57.A O no hydrogen 2.528 N/A THR 58.A OG1 ALA 129.A O no hydrogen 3.524 N/A VAL 60.A N GLN 23.A OE1 no hydrogen 3.073 N/A PHE 61.A N LEU 74.A O no hydrogen 2.885 N/A LYS 65.A N ILE 63.A O no hydrogen 2.765 N/A ASP 67.A N LYS 65.A O no hydrogen 2.775 N/A SER 68.A OG LYS 65.A O no hydrogen 3.215 N/A LYS 73.A NZ TYR 146.A OH no hydrogen 3.497 N/A LEU 74.A N PHE 61.A O no hydrogen 2.827 N/A LYS 82.A NZ GLU 79.A OE1 no hydrogen 2.977 N/A ARG 83.A N GLU 79.A O no hydrogen 3.462 N/A ARG 83.A NH1 GLU 79.A O no hydrogen 3.196 N/A THR 84.A N LEU 80.A O no hydrogen 2.992 N/A GLN 85.A N LYS 11.A O no hydrogen 2.720 N/A LEU 92.A N VAL 90.A O no hydrogen 2.664 N/A HIS 96.A NE2 GLN 269.A OE1 no hydrogen 2.787 N/A ALA 98.A N HIS 96.A ND1 no hydrogen 3.016 N/A GLY 99.A N HIS 96.A O no hydrogen 2.905 N/A LEU 100.A N PRO 97.A O no hydrogen 2.864 N/A LYS 103.A N LYS 101.A O no hydrogen 2.831 N/A LYS 104.A N LYS 102.A O no hydrogen 2.775 N/A SER 105.A N SER 191.A O no hydrogen 2.738 N/A THR 107.A N VAL 189.A O no hydrogen 2.638 N/A LEU 109.A N LEU 187.A O no hydrogen 2.760 N/A TYR 115.A OH MET 184.A O no hydrogen 3.120 N/A SER 117.A OG ALA 114.A O no hydrogen 3.194 N/A LEU 120.A N ASN 147.A O no hydrogen 2.767 N/A ASP 123.A N ASP 121.A OD1 no hydrogen 3.186 N/A ARG 125.A NE LEU 120.A O no hydrogen 2.914 N/A ARG 125.A NE ASP 121.A O no hydrogen 3.225 N/A LYS 126.A NZ GLU 122.A O no hydrogen 3.376 N/A LYS 126.A NZ ASP 123.A O no hydrogen 2.576 N/A TYR 127.A N PHE 124.A O no hydrogen 2.834 N/A THR 128.A N ARG 125.A O no hydrogen 3.218 N/A THR 128.A OG1 ARG 125.A O no hydrogen 2.603 N/A ALA 129.A N LYS 126.A O no hydrogen 3.302 N/A THR 131.A N ASN 57.A OD1 no hydrogen 3.017 N/A ILE 132.A N ILE 142.A O no hydrogen 3.096 N/A GLU 138.A N SER 134.A OG no hydrogen 3.367 N/A ARG 143.A NH1 TYR 56.A O no hydrogen 3.335 N/A ARG 143.A NH2 TYR 56.A O no hydrogen 2.766 N/A TYR 144.A N PHE 130.A O no hydrogen 3.266 N/A TYR 146.A N THR 128.A OG1 no hydrogen 3.077 N/A ASN 147.A N LYS 46.A O no hydrogen 2.772 N/A LEU 149.A N VAL 118.A O no hydrogen 3.337 N/A LYS 154.A NZ ASN 81.A O no hydrogen 3.472 N/A LYS 154.A NZ GLN 85.A O no hydrogen 3.003 N/A SER 156.A N TRP 153.A O no hydrogen 2.713 N/A SER 156.A OG PRO 150.A O no hydrogen 2.617 N/A SER 156.A OG TRP 153.A O no hydrogen 3.393 N/A ALA 158.A N GLY 155.A O no hydrogen 2.852 N/A ILE 159.A N GLY 155.A O no hydrogen 2.689 N/A PHE 160.A N SER 156.A O no hydrogen 2.844 N/A GLN 161.A N PRO 157.A O no hydrogen 3.375 N/A SER 162.A N ILE 159.A O no hydrogen 3.177 N/A SER 163.A N ILE 159.A O no hydrogen 2.668 N/A SER 163.A OG ILE 159.A O no hydrogen 2.901 N/A MET 164.A N PHE 160.A O no hydrogen 2.847 N/A THR 165.A N SER 162.A O no hydrogen 3.147 N/A THR 165.A OG1 GLN 161.A O no hydrogen 2.788 N/A LYS 166.A N SER 163.A O no hydrogen 3.036 N/A LYS 166.A NZ GLU 6.A O no hydrogen 3.109 N/A ILE 167.A N SER 163.A O no hydrogen 3.055 N/A GLU 169.A N LYS 166.A O no hydrogen 3.228 N/A LYS 172.A N LEU 168.A O no hydrogen 2.947 N/A LYS 173.A N GLU 169.A O no hydrogen 3.014 N/A GLN 174.A N PRO 170.A O no hydrogen 2.800 N/A ASN 175.A N PHE 171.A O no hydrogen 2.836 N/A GLN 182.A NE2 ASP 186.A O no hydrogen 3.291 N/A TYR 183.A N ASP 186.A O no hydrogen 3.263 N/A ASP 186.A N TYR 183.A O no hydrogen 3.050 N/A TYR 188.A N TYR 181.A O no hydrogen 3.145 N/A TYR 188.A OH ASP 186.A OD2 no hydrogen 3.225 N/A GLY 190.A N VAL 179.A O no hydrogen 3.177 N/A SER 191.A N SER 105.A O no hydrogen 2.666 N/A GLN 197.A N GLU 194.A O no hydrogen 2.563 N/A HIS 198.A N GLU 194.A O no hydrogen 3.405 N/A ARG 199.A N ILE 195.A O no hydrogen 2.520 N/A THR 200.A OG1 GLN 197.A O no hydrogen 2.387 N/A LYS 201.A NZ GLU 204.A OE1 no hydrogen 3.172 N/A LYS 201.A NZ GLU 204.A OE2 no hydrogen 2.715 N/A ILE 202.A N HIS 198.A O no hydrogen 3.345 N/A GLU 204.A N THR 200.A O no hydrogen 2.837 N/A LEU 205.A N LYS 201.A O no hydrogen 3.086 N/A ARG 206.A N ILE 202.A O no hydrogen 2.782 N/A ARG 206.A NE THR 216.A O no hydrogen 3.495 N/A ARG 206.A NH1 GLU 203.A OE1 no hydrogen 2.830 N/A GLN 207.A N GLU 204.A O no hydrogen 3.175 N/A HIS 208.A N GLU 204.A O no hydrogen 2.995 N/A HIS 208.A N LEU 205.A O no hydrogen 2.801 N/A LEU 209.A N LEU 205.A O no hydrogen 2.952 N/A LEU 210.A N ARG 206.A O no hydrogen 3.379 N/A ARG 211.A N HIS 208.A O no hydrogen 3.032 N/A TRP 212.A N HIS 208.A O no hydrogen 2.895 N/A TRP 212.A N LEU 209.A O no hydrogen 2.652 N/A THR 216.A OG1 LEU 214.A O no hydrogen 3.382 N/A ASP 218.A N THR 216.A O no hydrogen 2.830 N/A GLN 222.A N ASP 218.A O no hydrogen 2.799 N/A LYS 223.A N HIS 221.A O no hydrogen 2.531 N/A PHE 227.A N LEU 234.A O no hydrogen 2.753 N/A TRP 229.A N TYR 232.A O no hydrogen 2.823 N/A TYR 232.A N TRP 229.A O no hydrogen 2.765 N/A TYR 232.A OH GLN 269.A OE1 no hydrogen 2.683 N/A GLU 233.A N THR 240.A O no hydrogen 2.574 N/A LEU 234.A N PHE 227.A O no hydrogen 2.769 N/A HIS 235.A N LYS 238.A O no hydrogen 3.140 N/A LYS 238.A N HIS 235.A O no hydrogen 3.280 N/A TRP 239.A N GLY 316.A O no hydrogen 2.556 N/A THR 240.A N GLU 233.A O no hydrogen 3.089 N/A THR 240.A OG1 TRP 239.A O no hydrogen 2.340 N/A THR 240.A OG1 VAL 314.A O no hydrogen 2.742 N/A THR 253.A OG1 ASP 256.A OD2 no hydrogen 3.254 N/A VAL 254.A N GLU 291.A O no hydrogen 3.115 N/A ASP 256.A N THR 253.A O no hydrogen 3.124 N/A ILE 257.A N VAL 254.A O no hydrogen 2.945 N/A GLN 258.A N VAL 254.A O no hydrogen 3.170 N/A LEU 260.A N ASP 256.A O no hydrogen 3.321 N/A VAL 261.A N ILE 257.A O no hydrogen 2.830 N/A GLY 262.A N LYS 259.A O no hydrogen 3.057 N/A LYS 263.A N LYS 259.A O no hydrogen 3.029 N/A LEU 264.A N LEU 260.A O no hydrogen 3.364 N/A TRP 266.A N GLY 262.A O no hydrogen 3.028 N/A ALA 267.A N LYS 263.A O no hydrogen 2.945 N/A SER 268.A N ASN 265.A O no hydrogen 2.815 N/A SER 268.A OG LEU 264.A O no hydrogen 2.938 N/A SER 268.A OG ASN 265.A O no hydrogen 2.523 N/A GLN 269.A N TRP 266.A O no hydrogen 3.208 N/A GLN 269.A NE2 TRP 266.A O no hydrogen 3.129 N/A GLN 278.A N GLU 302.A OE1 no hydrogen 3.021 N/A SER 280.A N ARG 277.A O no hydrogen 2.934 N/A SER 280.A OG VAL 276.A O no hydrogen 2.867 N/A SER 280.A OG ARG 277.A O no hydrogen 2.728 N/A LYS 281.A N ARG 277.A O no hydrogen 2.801 N/A LEU 283.A N SER 280.A O no hydrogen 2.886 N/A GLU 291.A N ALA 288.A O no hydrogen 3.439 N/A ILE 293.A N TRP 252.A O no hydrogen 3.238 N/A ALA 299.A N THR 296.A O no hydrogen 3.386 N/A ALA 299.A N THR 296.A OG1 no hydrogen 3.017 N/A LEU 301.A N GLU 297.A O no hydrogen 3.054 N/A GLU 302.A N ALA 299.A O no hydrogen 3.266 N/A LEU 303.A N ALA 299.A O no hydrogen 2.744 N/A ALA 304.A N GLU 300.A O no hydrogen 2.755 N/A ASN 306.A ND2 LYS 275.A O no hydrogen 3.685 N/A ARG 307.A N LEU 303.A O no hydrogen 3.155 N/A ARG 307.A NH2 LEU 246.A O no hydrogen 2.754 N/A LEU 310.A N ASN 306.A O no hydrogen 2.860 N/A LYS 311.A N ARG 307.A O no hydrogen 3.008 N/A VAL 317.A N ASN 348.A O no hydrogen 2.861 N/A TYR 318.A OH HIS 235.A O no hydrogen 3.208 N/A TYR 319.A N LEU 100.A O no hydrogen 2.773 N/A ASP 320.A N GLN 343.A OE1 no hydrogen 3.039 N/A SER 322.A N ASP 320.A OD1 no hydrogen 2.999 N/A SER 322.A OG ASP 320.A OD1 no hydrogen 2.448 N/A LYS 323.A N ASP 320.A O no hydrogen 2.771 N/A LYS 323.A N ASP 320.A OD1 no hydrogen 3.064 N/A ILE 326.A N TYR 342.A O no hydrogen 2.849 N/A ALA 327.A N LYS 388.A O no hydrogen 3.037 N/A GLU 328.A N GLN 340.A O no hydrogen 3.051 N/A GLN 330.A N THR 338.A O no hydrogen 2.733 N/A GLN 330.A NE2 GLN 340.A OE1 no hydrogen 3.509 N/A LYS 331.A NZ LEU 422.A O no hydrogen 3.362 N/A GLN 332.A N GLN 336.A O no hydrogen 2.884 N/A TRP 337.A N TYR 354.A O no hydrogen 2.665 N/A THR 338.A N GLN 330.A O no hydrogen 2.990 N/A TYR 339.A N GLY 352.A O no hydrogen 2.850 N/A TYR 339.A OH GLU 378.A OE1 no hydrogen 2.653 N/A TYR 339.A OH GLU 378.A OE2 no hydrogen 3.054 N/A GLN 340.A N GLU 328.A O no hydrogen 3.059 N/A ILE 341.A N LYS 350.A O no hydrogen 2.836 N/A TYR 342.A N ILE 326.A O no hydrogen 2.679 N/A GLN 343.A NE2 ASP 320.A O no hydrogen 2.981 N/A GLN 343.A NE2 LYS 323.A O no hydrogen 2.603 N/A GLN 343.A NE2 ASP 324.A O no hydrogen 2.883 N/A LYS 347.A N PRO 345.A O no hydrogen 2.637 N/A LEU 349.A N ILE 341.A O no hydrogen 3.398 N/A THR 351.A N GLN 269.A O no hydrogen 2.665 N/A THR 351.A OG1 SER 268.A O no hydrogen 3.530 N/A THR 351.A OG1 GLN 269.A O no hydrogen 2.587 N/A THR 351.A OG1 ILE 270.A O no hydrogen 2.662 N/A GLY 352.A N TYR 339.A O no hydrogen 3.043 N/A TYR 354.A N TRP 337.A O no hydrogen 2.756 N/A TYR 354.A OH GLU 370.A OE1 no hydrogen 2.502 N/A THR 362.A OG1 ALA 360.A O no hydrogen 3.065 N/A ASN 363.A ND2 ALA 508.A O no hydrogen 3.296 N/A VAL 365.A N ASN 363.A OD1 no hydrogen 2.722 N/A GLN 367.A N ASN 363.A O no hydrogen 2.644 N/A LEU 368.A N ASP 364.A O no hydrogen 2.776 N/A LEU 368.A N VAL 365.A O no hydrogen 3.033 N/A THR 369.A N VAL 365.A O no hydrogen 3.054 N/A THR 369.A OG1 VAL 365.A O no hydrogen 3.451 N/A GLU 370.A N LYS 366.A O no hydrogen 2.982 N/A ALA 371.A N GLN 367.A O no hydrogen 3.347 N/A ALA 371.A N LEU 368.A O no hydrogen 2.761 N/A VAL 372.A N LEU 368.A O no hydrogen 3.117 N/A LYS 374.A N GLU 370.A O no hydrogen 3.201 N/A ILE 375.A N ALA 371.A O no hydrogen 3.122 N/A ILE 375.A N VAL 372.A O no hydrogen 3.129 N/A THR 376.A N VAL 372.A O no hydrogen 2.791 N/A THR 376.A OG1 VAL 372.A O no hydrogen 2.580 N/A THR 377.A N GLN 373.A O no hydrogen 2.755 N/A THR 377.A OG1 GLN 373.A O no hydrogen 3.537 N/A THR 377.A OG1 GLN 373.A OE1 no hydrogen 3.019 N/A GLU 378.A N LYS 374.A O no hydrogen 3.213 N/A SER 379.A N ILE 375.A O no hydrogen 2.728 N/A SER 379.A OG ILE 375.A O no hydrogen 3.033 N/A VAL 381.A N THR 377.A O no hydrogen 3.092 N/A ILE 382.A N SER 379.A O no hydrogen 2.728 N/A TRP 383.A N SER 379.A O no hydrogen 2.850 N/A TRP 383.A NE1 ALA 98.A O no hydrogen 2.852 N/A GLY 384.A N SER 379.A O no hydrogen 3.305 N/A LYS 388.A N LEU 325.A O no hydrogen 2.808 N/A PHE 389.A N GLU 413.A O no hydrogen 2.605 N/A LYS 390.A N ALA 327.A O no hydrogen 2.653 N/A LYS 390.A NZ GLU 415.A OE1 no hydrogen 2.906 N/A LEU 391.A N GLU 415.A O no hydrogen 2.710 N/A ILE 393.A N LEU 391.A O no hydrogen 2.833 N/A THR 397.A N GLN 394.A O no hydrogen 2.936 N/A THR 397.A OG1 GLN 394.A O no hydrogen 2.772 N/A TRP 398.A N GLN 394.A O no hydrogen 3.111 N/A TRP 398.A N LYS 395.A O no hydrogen 2.965 N/A GLU 399.A N LYS 395.A O no hydrogen 2.961 N/A THR 400.A OG1 GLU 396.A O no hydrogen 3.097 N/A TRP 401.A N TRP 398.A O no hydrogen 2.723 N/A THR 403.A OG1 GLU 399.A O no hydrogen 2.775 N/A GLU 415.A N PHE 389.A O no hydrogen 2.688 N/A VAL 417.A N LEU 391.A O no hydrogen 3.204 N/A LEU 422.A N PRO 420.A O no hydrogen 2.987 N/A VAL 423.A N PRO 392.A O no hydrogen 3.077 N/A TYR 427.A OH PRO 510.A O no hydrogen 3.243 N/A GLU 430.A N VAL 531.A O no hydrogen 2.847 N/A ILE 434.A N ASN 494.A OD1 no hydrogen 2.931 N/A ALA 437.A N VAL 435.A O no hydrogen 2.752 N/A PHE 440.A N ASN 494.A O no hydrogen 2.944 N/A TYR 441.A N VAL 458.A O no hydrogen 2.896 N/A VAL 442.A N VAL 496.A O no hydrogen 3.181 N/A GLY 444.A N ASP 443.A OD1 no hydrogen 2.826 N/A ALA 445.A N LYS 454.A O no hydrogen 3.364 N/A LYS 454.A N ALA 445.A O no hydrogen 3.121 N/A LYS 454.A NZ SER 553.A O no hydrogen 2.768 N/A ALA 455.A N VAL 467.A O no hydrogen 3.082 N/A TYR 457.A N LYS 465.A O no hydrogen 3.107 N/A TYR 457.A OH ASP 488.A OD2 no hydrogen 2.516 N/A VAL 458.A N TYR 441.A O no hydrogen 3.152 N/A THR 459.A OG1 GLU 438.A OE2 no hydrogen 3.220 N/A ASN 460.A N THR 439.A O no hydrogen 3.043 N/A ASN 460.A ND2 THR 439.A O no hydrogen 3.671 N/A ARG 463.A NH1 GLU 438.A OE2 no hydrogen 3.464 N/A LYS 465.A NZ ASP 488.A OD2 no hydrogen 3.457 N/A LEU 469.A N GLY 453.A O no hydrogen 2.775 N/A THR 472.A OG1 THR 477.A OG1 no hydrogen 3.065 N/A GLN 475.A N THR 473.A OG1 no hydrogen 2.985 N/A THR 477.A N THR 473.A O no hydrogen 2.803 N/A THR 477.A OG1 THR 473.A O no hydrogen 2.992 N/A GLU 478.A N ASN 474.A O no hydrogen 2.997 N/A LEU 479.A N GLN 475.A O no hydrogen 3.222 N/A GLN 480.A N LYS 476.A O no hydrogen 2.673 N/A ALA 481.A N THR 477.A O no hydrogen 2.858 N/A ILE 482.A N LEU 479.A O no hydrogen 3.114 N/A TYR 483.A N LEU 479.A O no hydrogen 3.420 N/A LEU 484.A N GLN 480.A O no hydrogen 3.010 N/A ALA 485.A N ALA 481.A O no hydrogen 3.019 N/A GLN 487.A N TYR 483.A O no hydrogen 2.865 N/A ASP 488.A N LEU 484.A O no hydrogen 3.355 N/A SER 489.A N LEU 486.A O no hydrogen 3.149 N/A SER 489.A OG ALA 485.A O no hydrogen 3.048 N/A SER 489.A OG LEU 486.A O no hydrogen 3.564 N/A VAL 493.A N LYS 530.A O no hydrogen 2.984 N/A ASN 494.A N GLU 438.A O no hydrogen 3.456 N/A ILE 495.A N TYR 532.A O no hydrogen 2.809 N/A VAL 496.A N PHE 440.A O no hydrogen 3.143 N/A THR 497.A N ALA 534.A O no hydrogen 3.008 N/A THR 497.A OG1 ALA 534.A O no hydrogen 3.292 N/A GLY 504.A N GLN 500.A O no hydrogen 2.690 N/A ILE 505.A N ALA 502.A O no hydrogen 3.370 N/A ILE 506.A N ALA 502.A O no hydrogen 3.095 N/A ILE 506.A N LEU 503.A O no hydrogen 2.921 N/A GLN 507.A N LEU 503.A O no hydrogen 2.872 N/A GLN 509.A N ILE 506.A O no hydrogen 3.412 N/A GLN 509.A NE2 GLN 507.A O no hydrogen 3.052 N/A SER 513.A OG LYS 512.A O no hydrogen 2.711 N/A ASN 519.A N SER 515.A O no hydrogen 2.903 N/A ASN 519.A ND2 SER 513.A O no hydrogen 2.691 N/A GLN 520.A N GLU 516.A O no hydrogen 2.797 N/A ILE 521.A N VAL 518.A O no hydrogen 3.274 N/A ILE 522.A N VAL 518.A O no hydrogen 3.098 N/A GLU 523.A N ASN 519.A O no hydrogen 3.000 N/A LEU 525.A N ILE 521.A O no hydrogen 2.886 N/A ILE 526.A N ILE 522.A O no hydrogen 2.884 N/A LYS 527.A N GLU 523.A O no hydrogen 3.320 N/A LYS 528.A N GLN 524.A O no hydrogen 2.998 N/A GLU 529.A N LEU 491.A O no hydrogen 3.053 N/A TYR 532.A N VAL 493.A O no hydrogen 3.020 N/A ALA 534.A N ILE 495.A O no hydrogen 2.639 N/A VAL 536.A N THR 497.A O no hydrogen 2.911 N/A GLY 544.A N ILE 542.A O no hydrogen 3.292 N/A ASN 545.A ND2 ILE 542.A O no hydrogen 3.422 N/A GLN 547.A N GLY 544.A O no hydrogen 3.169 N/A VAL 548.A N GLY 544.A O no hydrogen 2.831 N/A ASP 549.A N ASN 545.A O no hydrogen 2.920 N/A SER 553.A OG LYS 550.A O no hydrogen 2.960 N/A