Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q2v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 7.A N VAL 95.A O no hydrogen 3.037 N/A CYS 9.A N THR 97.A O no hydrogen 3.151 N/A CYS 9.A SG GLU 13.A OE1 no hydrogen 2.761 N/A GLU 11.A N THR 99.A O no hydrogen 3.195 N/A ASN 12.A N LEU 66.A O no hydrogen 2.621 N/A LYS 19.A N VAL 62.A O no hydrogen 2.748 N/A LEU 21.A N LEU 60.A O no hydrogen 2.645 N/A ILE 24.A N GLY 58.A O no hydrogen 2.657 N/A LYS 25.A NZ ASP 29.A OD1 no hydrogen 3.327 N/A SER 26.A N TYR 36.A OH no hydrogen 2.988 N/A SER 26.A OG GLU 89.A OE1 no hydrogen 2.231 N/A ASP 29.A N SER 26.A O no hydrogen 2.672 N/A GLU 31.A N ARG 28.A O no hydrogen 3.124 N/A THR 32.A N ARG 28.A O no hydrogen 3.114 N/A THR 32.A OG1 LYS 33.A O no hydrogen 3.523 N/A PHE 35.A N VAL 81.A O no hydrogen 2.666 N/A TYR 36.A N ARG 55.A O no hydrogen 2.803 N/A SER 37.A N HIS 79.A O no hydrogen 3.145 N/A SER 37.A OG HIS 79.A O no hydrogen 3.562 N/A THR 39.A N TYR 77.A O no hydrogen 2.978 N/A THR 39.A OG1 HIS 79.A NE2 no hydrogen 3.168 N/A GLY 40.A N ASP 44.A OD1 no hydrogen 3.325 N/A GLN 41.A NE2.B GLN 41.A O.B no hydrogen 3.484 N/A GLN 41.A NE2.B ILE 75.A O no hydrogen 2.534 N/A GLY 42.A N LYS 45.A O no hydrogen 2.515 N/A ALA 43.A N GLY 40.A O no hydrogen 2.693 N/A ASP 44.A N GLY 40.A O no hydrogen 2.947 N/A LYS 45.A N GLY 40.A O no hydrogen 2.816 N/A GLY 49.A N ALA 43.A O no hydrogen 3.100 N/A PHE 51.A N GLY 42.A O no hydrogen 2.722 N/A ILE 52.A N LYS 61.A O no hydrogen 2.748 N/A GLU 54.A N TRP 59.A O no hydrogen 3.043 N/A ARG 55.A NH1 ILE 53.A O no hydrogen 3.053 N/A THR 57.A OG1 GLU 54.A OE1 no hydrogen 2.818 N/A GLY 58.A N GLU 54.A O no hydrogen 2.662 N/A LEU 60.A N VAL 22.A O no hydrogen 2.667 N/A LYS 61.A N ILE 52.A O no hydrogen 2.801 N/A LYS 61.A NZ GLU 54.A OE2 no hydrogen 3.254 N/A VAL 62.A N LYS 19.A O no hydrogen 2.678 N/A THR 63.A N VAL 50.A O no hydrogen 2.791 N/A THR 63.A OG1 GLY 49.A O no hydrogen 2.707 N/A THR 63.A OG1 VAL 50.A O no hydrogen 2.733 N/A ARG 68.A N GLU 11.A OE2 no hydrogen 2.468 N/A ALA 70.A N ASP 67.A OD2 no hydrogen 2.940 N/A ILE 71.A N ASP 67.A O no hydrogen 2.934 N/A TYR 74.A N ILE 96.A O no hydrogen 2.528 N/A LEU 76.A N ILE 94.A O no hydrogen 2.547 N/A TYR 77.A N THR 39.A O no hydrogen 3.268 N/A SER 78.A N MET 92.A O no hydrogen 2.892 N/A SER 78.A OG MET 92.A O no hydrogen 3.339 N/A HIS 79.A N SER 37.A O no hydrogen 2.617 N/A HIS 79.A NE2 THR 39.A OG1 no hydrogen 3.168 N/A SER 82.A N GLU 86.A O no hydrogen 2.851 N/A SER 82.A OG GLU 86.A O no hydrogen 3.189 N/A ASN 84.A N SER 82.A OG no hydrogen 3.234 N/A ASN 84.A ND2 SER 83.A O no hydrogen 3.310 N/A GLY 85.A N SER 82.A O no hydrogen 3.171 N/A VAL 88.A N ALA 80.A O no hydrogen 2.665 N/A GLU 89.A N ALA 80.A O no hydrogen 3.390 N/A MET 92.A N SER 78.A O no hydrogen 3.067 N/A ILE 94.A N LEU 76.A O no hydrogen 2.575 N/A ILE 96.A N TYR 74.A O no hydrogen 2.603 N/A THR 97.A N ILE 7.A O no hydrogen 2.846 N/A THR 97.A OG1 ILE 7.A O no hydrogen 3.523 N/A VAL 98.A N ALA 72.A O no hydrogen 2.877 N/A THR 99.A N CYS 9.A O no hydrogen 3.048 N/A ASP 103.A N ASP 136.A OD2 no hydrogen 2.849 N/A ASN 104.A N ASP 136.A OD2 no hydrogen 3.183 N/A THR 109.A N SER 131.A O no hydrogen 3.188 N/A GLN 110.A NE2 VAL 112.A O no hydrogen 2.942 N/A PHE 113.A N LYS 206.A O no hydrogen 2.915 N/A VAL 117.A N THR 210.A O no hydrogen 3.062 N/A GLU 119.A N LYS 212.A O no hydrogen 3.021 N/A GLY 120.A N LEU 179.A O no hydrogen 2.883 N/A GLY 124.A N VAL 174.A O no hydrogen 2.666 N/A THR 125.A N VAL 122.A O no hydrogen 2.746 N/A VAL 127.A N ILE 172.A O no hydrogen 2.817 N/A MET 128.A N ILE 172.A O no hydrogen 2.952 N/A VAL 130.A N GLY 170.A O no hydrogen 2.910 N/A SER 131.A OG ALA 132.A O no hydrogen 3.478 N/A ALA 132.A N TYR 148.A OH no hydrogen 2.989 N/A THR 133.A N GLU 107.A O no hydrogen 3.255 N/A ASP 136.A N ASP 134.A OD2 no hydrogen 3.004 N/A ASP 137.A N ASP 100.A OD1 no hydrogen 3.039 N/A ASN 140.A ND2 ASP 137.A OD1 no hydrogen 3.033 N/A ASN 140.A ND2 ASP 137.A OD2 no hydrogen 2.965 N/A THR 141.A N ASP 137.A O no hydrogen 2.758 N/A THR 141.A OG1 ASP 100.A OD1 no hydrogen 3.511 N/A THR 141.A OG1 ASP 137.A O no hydrogen 2.374 N/A THR 141.A OG1 ASN 143.A OD1 no hydrogen 3.086 N/A ALA 145.A N TYR 142.A O no hydrogen 2.918 N/A ALA 147.A N ALA 194.A O no hydrogen 2.875 N/A TYR 148.A N ARG 167.A O no hydrogen 2.513 N/A TYR 148.A OH ALA 132.A O no hydrogen 3.292 N/A THR 149.A N GLN 192.A O no hydrogen 2.864 N/A THR 149.A OG1 GLN 192.A O no hydrogen 3.494 N/A THR 149.A OG1 GLN 192.A OE1 no hydrogen 2.663 N/A VAL 151.A N VAL 190.A O no hydrogen 2.512 N/A SER 152.A N VAL 190.A O no hydrogen 3.399 N/A GLN 153.A NE2 PRO 155.A O no hydrogen 2.616 N/A GLN 153.A NE2 HIS 159.A O no hydrogen 2.783 N/A ASP 154.A N THR 188.A O no hydrogen 2.800 N/A MET 162.A N GLN 153.A OE1 no hydrogen 2.613 N/A THR 164.A N SER 173.A O no hydrogen 2.879 N/A ASN 166.A N VAL 171.A O no hydrogen 2.582 N/A ARG 167.A NH2 GLN 197.A O no hydrogen 3.239 N/A THR 169.A N ASN 166.A O no hydrogen 2.629 N/A GLY 170.A N ASN 166.A O no hydrogen 2.966 N/A ILE 172.A N MET 128.A O no hydrogen 2.672 N/A SER 173.A N THR 164.A O no hydrogen 2.905 N/A VAL 174.A N THR 125.A O no hydrogen 2.749 N/A THR 176.A N MET 162.A O no hydrogen 3.207 N/A ARG 181.A NH1 GLU 182.A OE1 no hydrogen 3.089 N/A ARG 181.A NH1 ASP 247.A O no hydrogen 3.039 N/A GLU 182.A N ASP 180.A OD1 no hydrogen 3.058 N/A SER 183.A OG ASP 180.A OD2 no hydrogen 3.141 N/A TYR 184.A N ASP 180.A O no hydrogen 3.125 N/A TYR 187.A N ILE 209.A O no hydrogen 2.674 N/A TYR 187.A OH LEU 157.A O no hydrogen 2.666 N/A THR 188.A N ASP 154.A O no hydrogen 2.777 N/A LEU 189.A N ALA 207.A O no hydrogen 2.478 N/A VAL 190.A N SER 152.A O no hydrogen 2.847 N/A VAL 191.A N ALA 205.A O no hydrogen 2.825 N/A GLN 192.A N THR 149.A O no hydrogen 2.520 N/A ALA 193.A N THR 203.A O no hydrogen 2.783 N/A ASP 195.A N LEU 201.A O no hydrogen 3.217 N/A GLN 197.A N ALA 145.A O no hydrogen 2.906 N/A GLY 198.A N ASP 195.A O no hydrogen 2.808 N/A GLY 200.A N ASP 195.A O no hydrogen 2.619 N/A LEU 201.A N ASP 195.A OD2 no hydrogen 3.130 N/A THR 203.A N ALA 193.A O no hydrogen 3.049 N/A THR 203.A OG1 PRO 106.A O no hydrogen 3.539 N/A ALA 205.A N VAL 191.A O no hydrogen 2.937 N/A LYS 206.A N GLU 111.A O no hydrogen 3.309 N/A ALA 207.A N LEU 189.A O no hydrogen 2.670 N/A VAL 208.A N PHE 113.A O no hydrogen 2.666 N/A ILE 209.A N TYR 187.A O no hydrogen 2.826 N/A THR 210.A N GLY 115.A O no hydrogen 3.106 N/A VAL 211.A N PRO 185.A O no hydrogen 2.653 N/A LYS 212.A N VAL 117.A O no hydrogen 2.634 N/A ASP 216.A N ILE 214.A O no hydrogen 2.790 N/A ASN 217.A N ASP 248.A OD1 no hydrogen 3.122 N/A ASN 217.A N ASP 248.A OD2 no hydrogen 2.998 N/A VAL 220.A N THR 245.A O no hydrogen 2.875 N/A ASN 222.A N LYS 243.A O no hydrogen 2.612 N/A TYR 226.A N THR 318.A O no hydrogen 3.078 N/A TYR 226.A OH PRO 223.A O no hydrogen 2.749 N/A GLN 227.A NE2 ASP 322.A OD2 no hydrogen 2.881 N/A GLY 228.A N THR 320.A O no hydrogen 3.010 N/A VAL 230.A N ASP 322.A O no hydrogen 2.979 N/A ASN 236.A N THR 284.A O no hydrogen 2.394 N/A ILE 239.A N LEU 282.A O no hydrogen 2.704 N/A LEU 242.A N GLY 280.A O no hydrogen 2.729 N/A LYS 243.A N TYR 226.A OH no hydrogen 2.802 N/A THR 245.A N VAL 220.A O no hydrogen 2.600 N/A THR 245.A OG1 VAL 220.A O no hydrogen 3.083 N/A THR 252.A N ALA 249.A O no hydrogen 3.160 N/A THR 252.A OG1 ALA 249.A O no hydrogen 2.384 N/A TRP 255.A N THR 252.A O no hydrogen 2.600 N/A LYS 256.A N THR 252.A O no hydrogen 2.595 N/A VAL 258.A N GLU 303.A O no hydrogen 2.863 N/A TYR 259.A OH ASN 278.A O no hydrogen 2.710 N/A THR 260.A N ARG 301.A O no hydrogen 2.859 N/A VAL 262.A N HIS 299.A O no hydrogen 2.839 N/A ASN 263.A ND2 HIS 299.A ND1 no hydrogen 3.330 N/A GLN 268.A NE2 TYR 296.A OH no hydrogen 2.796 N/A VAL 270.A N LYS 283.A O no hydrogen 3.364 N/A VAL 272.A N ILE 281.A O no hydrogen 2.964 N/A THR 273.A OG1 ALA 257.A O no hydrogen 3.259 N/A ASP 274.A N ASP 279.A O no hydrogen 2.939 N/A THR 277.A OG1 ASP 279.A OD2 no hydrogen 2.842 N/A ASN 278.A N ASP 274.A O no hydrogen 2.337 N/A ASN 278.A ND2 VAL 244.A O no hydrogen 3.347 N/A ASN 278.A ND2 THR 277.A O no hydrogen 2.322 N/A GLY 280.A N LEU 242.A O no hydrogen 2.621 N/A LEU 282.A N ALA 240.A O no hydrogen 2.604 N/A LYS 283.A N VAL 270.A O no hydrogen 2.661 N/A ALA 285.A N GLN 268.A O no hydrogen 2.564 N/A LYS 286.A N GLN 268.A O no hydrogen 3.054 N/A GLU 291.A N GLU 291.A OE2 no hydrogen 2.682 N/A LYS 293.A N ASP 289.A O no hydrogen 2.986 N/A TYR 296.A N VAL 321.A O no hydrogen 2.778 N/A LEU 298.A N VAL 319.A O no hydrogen 3.096 N/A VAL 300.A N ALA 317.A O no hydrogen 3.076 N/A ARG 301.A N THR 260.A O no hydrogen 2.746 N/A ARG 301.A NE GLU 303.A OE2 no hydrogen 3.396 N/A VAL 302.A N SER 315.A O no hydrogen 2.845 N/A GLU 303.A N VAL 258.A O no hydrogen 2.989 N/A GLU 305.A N LYS 256.A O no hydrogen 2.894 N/A GLU 306.A N PRO 253.A O no hydrogen 3.019 N/A GLU 309.A N ASN 215.A O no hydrogen 3.175 N/A ALA 317.A N VAL 300.A O no hydrogen 2.897 N/A THR 318.A N SER 224.A O no hydrogen 2.732 N/A VAL 319.A N LEU 298.A O no hydrogen 3.146 N/A THR 320.A N TYR 226.A O no hydrogen 3.279 N/A VAL 321.A N TYR 296.A O no hydrogen 2.486 N/A ASP 322.A N GLY 228.A O no hydrogen 2.725 N/A VAL 324.A N VAL 230.A O no hydrogen 2.584 N/A VAL 326.A N GLU 232.A OE1 no hydrogen 3.450 N/A ASN 327.A ND2 ASP 415.A OD1 no hydrogen 3.386 N/A GLU 328.A N ASP 360.A OD1 no hydrogen 2.402 N/A GLU 328.A N ASP 360.A OD2 no hydrogen 3.116 N/A ILE 331.A N ARG 357.A O no hydrogen 3.130 N/A MET 333.A N THR 355.A O no hydrogen 3.164 N/A ARG 338.A NH2 GLU 340.A OE1 no hydrogen 3.248 N/A VAL 339.A N LEU 428.A O no hydrogen 3.312 N/A VAL 341.A N VAL 430.A O no hydrogen 2.815 N/A GLU 343.A N LEU 432.A O no hydrogen 3.189 N/A PHE 345.A N PRO 342.A O no hydrogen 3.328 N/A ILE 351.A N ILE 388.A O no hydrogen 2.719 N/A SER 353.A OG GLU 350.A OE1 no hydrogen 3.257 N/A TYR 354.A N GLY 386.A O no hydrogen 2.996 N/A TYR 354.A OH PRO 334.A O no hydrogen 2.481 N/A ALA 356.A N TYR 369.A OH no hydrogen 2.778 N/A ARG 357.A N ILE 331.A O no hydrogen 2.625 N/A ASP 360.A N GLU 358.A OE1 no hydrogen 3.138 N/A THR 361.A N GLU 291.A OE1 no hydrogen 3.463 N/A ASP 364.A N PHE 362.A O no hydrogen 2.740 N/A LYS 366.A N ASP 416.A OD2 no hydrogen 3.094 N/A THR 368.A N THR 414.A O no hydrogen 2.850 N/A THR 368.A OG1 LYS 366.A O no hydrogen 3.360 N/A THR 368.A OG1 THR 414.A OG1 no hydrogen 3.034 N/A TYR 369.A OH ALA 356.A O no hydrogen 3.280 N/A ARG 370.A N ILE 412.A O no hydrogen 2.777 N/A TRP 372.A N LEU 410.A O no hydrogen 2.568 N/A ARG 373.A N LEU 410.A O no hydrogen 2.967 N/A ARG 373.A NH1 ARG 373.A O no hydrogen 3.343 N/A ARG 373.A NH2 THR 375.A OG1 no hydrogen 2.991 N/A ALA 376.A N TYR 407.A OH no hydrogen 3.206 N/A ASN 377.A N ASP 374.A O no hydrogen 3.444 N/A ASN 382.A N ALA 387.A O no hydrogen 2.784 N/A ASN 382.A ND2 THR 385.A OG1 no hydrogen 3.036 N/A GLY 386.A N ASN 382.A O no hydrogen 2.669 N/A ILE 388.A N THR 352.A O no hydrogen 2.793 N/A THR 390.A N GLN 349.A O no hydrogen 2.948 N/A THR 390.A OG1 GLY 346.A O no hydrogen 3.357 N/A THR 390.A OG1 GLN 349.A O no hydrogen 3.048 N/A ARG 391.A N TRP 378.A O no hydrogen 3.111 N/A ASP 398.A N ASP 395.A O no hydrogen 3.305 N/A VAL 402.A N ASP 398.A O no hydrogen 2.936 N/A LYS 403.A NZ GLU 400.A O no hydrogen 3.307 N/A SER 405.A N ASN 404.A OD1 no hydrogen 2.587 N/A SER 405.A OG ASN 404.A OD1 no hydrogen 2.854 N/A TYR 407.A N LEU 429.A O no hydrogen 2.731 N/A ALA 409.A N LEU 427.A O no hydrogen 2.761 N/A LEU 410.A N ARG 373.A O no hydrogen 2.922 N/A ILE 411.A N GLY 425.A O no hydrogen 3.028 N/A ILE 412.A N ARG 370.A O no hydrogen 2.873 N/A THR 414.A N THR 368.A O no hydrogen 3.069 N/A THR 414.A OG1 THR 368.A O no hydrogen 3.058 N/A THR 414.A OG1 THR 368.A OG1 no hydrogen 3.034 N/A GLY 423.A N ALA 413.A O no hydrogen 3.317 N/A THR 424.A OG1 GLY 423.A O no hydrogen 2.605 N/A GLY 425.A N ILE 411.A O no hydrogen 3.049 N/A THR 426.A N ALA 335.A O no hydrogen 3.220 N/A LEU 427.A N ALA 409.A O no hydrogen 2.735 N/A LEU 428.A N ARG 337.A O no hydrogen 2.813 N/A VAL 430.A N VAL 339.A O no hydrogen 3.257 N/A LEU 432.A N VAL 341.A O no hydrogen 2.866 N/A VAL 434.A N GLU 343.A OE2 no hydrogen 3.333 N/A ASN 435.A ND2 ASP 513.A OD1 no hydrogen 3.461 N/A ASP 436.A N VAL 434.A O no hydrogen 2.686 N/A ASN 437.A N ASP 464.A OD2 no hydrogen 3.219 N/A ILE 440.A N LEU 461.A O no hydrogen 3.191 N/A ARG 444.A NE PRO 441.A O no hydrogen 2.824 N/A PHE 448.A N HIS 526.A O no hydrogen 2.956 N/A CYS 449.A SG ASN 452.A O no hydrogen 2.833 N/A CYS 449.A SG CYS 528.A O no hydrogen 3.979 N/A GLN 450.A N CYS 528.A O no hydrogen 2.827 N/A HIS 456.A N LEU 498.A O no hydrogen 3.045 N/A ILE 458.A N LEU 496.A O no hydrogen 2.712 N/A THR 459.A OG1 GLU 442.A OE2 no hydrogen 3.069 N/A LEU 461.A N ILE 440.A O no hydrogen 2.685 N/A ASP 464.A N ASP 462.A OD1 no hydrogen 3.312 N/A LEU 465.A N ASP 433.A OD2 no hydrogen 2.562 N/A ASN 468.A N LEU 465.A O no hydrogen 3.085 N/A THR 469.A OG1 ASP 464.A O no hydrogen 3.102 N/A THR 473.A N ALA 512.A O no hydrogen 2.862 N/A ALA 474.A N TYR 488.A OH no hydrogen 2.624 N/A GLU 475.A N LYS 510.A O no hydrogen 2.739 N/A SER 481.A N GLY 479.A O no hydrogen 2.954 N/A GLU 487.A N ILE 497.A O no hydrogen 3.057 N/A TYR 488.A OH ALA 474.A O no hydrogen 2.438 N/A GLN 493.A N ASP 490.A O no hydrogen 3.457 N/A LEU 496.A N ILE 458.A O no hydrogen 3.217 N/A ILE 497.A N GLU 487.A O no hydrogen 2.627 N/A LEU 498.A N HIS 456.A O no hydrogen 2.712 N/A GLN 499.A N THR 485.A O no hydrogen 3.324 N/A LYS 510.A N GLU 475.A O no hydrogen 2.565 N/A ASN 516.A ND2 LYS 517.A O no hydrogen 3.638 N/A VAL 520.A N LEU 509.A O no hydrogen 2.572 N/A CYS 528.A N PHE 448.A O no hydrogen 3.223 N/A CYS 528.A SG PHE 448.A O no hydrogen 3.770 N/A CYS 530.A N CYS 528.A O no hydrogen 2.809 N/A CYS 530.A SG CYS 528.A O no hydrogen 3.658 N/A