Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5vqr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 7.A N GLN 81.A OE1 no hydrogen 3.040 N/A LYS 9.A N ARG 79.A O no hydrogen 3.478 N/A LYS 9.A NZ LYS 78.A O no hydrogen 2.829 N/A MET 12.A N LYS 9.A O no hydrogen 3.299 N/A VAL 17.A N ASN 53.A O no hydrogen 2.987 N/A LYS 18.A NZ GLN 19.A O no hydrogen 3.456 N/A GLN 19.A NE2 TRP 20.A O no hydrogen 2.943 N/A GLN 19.A NE2 VAL 56.A O no hydrogen 2.771 N/A LYS 26.A NZ GLU 376.A OE1 no hydrogen 3.039 N/A LYS 26.A NZ GLU 376.A OE2 no hydrogen 3.513 N/A ILE 27.A N THR 23.A O no hydrogen 3.040 N/A LYS 28.A N GLU 24.A O no hydrogen 2.920 N/A ALA 29.A N GLU 25.A O no hydrogen 2.923 N/A LEU 30.A N LYS 26.A O no hydrogen 2.923 N/A VAL 31.A N ILE 27.A O no hydrogen 2.884 N/A GLU 32.A N LYS 28.A O no hydrogen 2.971 N/A ILE 33.A N ALA 29.A O no hydrogen 2.934 N/A CYS 34.A N LEU 30.A O no hydrogen 2.900 N/A CYS 34.A SG LEU 30.A O no hydrogen 3.287 N/A THR 35.A N VAL 31.A O no hydrogen 2.911 N/A THR 35.A OG1 VAL 31.A O no hydrogen 2.738 N/A GLU 36.A N GLU 32.A O no hydrogen 2.969 N/A MET 37.A N ILE 33.A O no hydrogen 2.906 N/A GLU 38.A N CYS 34.A O no hydrogen 2.897 N/A LYS 39.A N THR 35.A O no hydrogen 2.959 N/A GLU 40.A N GLU 36.A O no hydrogen 2.933 N/A GLY 41.A N GLU 38.A O no hydrogen 3.095 N/A LYS 42.A N MET 37.A O no hydrogen 2.911 N/A LYS 42.A NZ GLU 40.A OE1 no hydrogen 3.001 N/A SER 44.A N GLN 136.A O no hydrogen 2.923 N/A ILE 46.A N ARG 134.A O no hydrogen 3.362 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.602 N/A ASN 50.A N GLY 47.A O no hydrogen 3.401 N/A ASN 50.A ND2 LYS 117.A O no hydrogen 3.330 N/A TYR 52.A N ASN 50.A OD1 no hydrogen 3.227 N/A TYR 52.A OH ASP 13.A OD1 no hydrogen 2.927 N/A ASN 53.A N PRO 15.A O no hydrogen 2.973 N/A ASN 53.A ND2 VAL 17.A O no hydrogen 2.836 N/A VAL 56.A N GLN 19.A OE1 no hydrogen 2.784 N/A PHE 57.A N LEU 70.A O no hydrogen 2.894 N/A ILE 59.A N ARG 68.A O no hydrogen 2.931 N/A LYS 60.A NZ SER 64.A O no hydrogen 2.824 N/A LYS 66.A N SER 64.A OG no hydrogen 3.285 N/A ARG 68.A N ILE 59.A O no hydrogen 2.878 N/A ARG 68.A NH2 ASP 101.A OD2 no hydrogen 3.463 N/A LYS 69.A NZ TYR 137.A OH no hydrogen 2.292 N/A LEU 70.A N PHE 57.A O no hydrogen 2.863 N/A ASP 72.A N PRO 55.A O no hydrogen 3.117 N/A ARG 74.A N ASP 72.A OD1 no hydrogen 3.398 N/A ARG 74.A NE ASP 72.A OD1 no hydrogen 2.716 N/A ARG 74.A NE ASP 72.A OD2 no hydrogen 3.366 N/A ARG 74.A NH1 PRO 384.A O no hydrogen 3.099 N/A ARG 74.A NH2 ASP 72.A OD2 no hydrogen 2.869 N/A ASN 77.A N PHE 73.A O no hydrogen 2.730 N/A ASN 77.A ND2 GLY 143.A O no hydrogen 3.057 N/A LYS 78.A N ARG 74.A O no hydrogen 2.969 N/A LYS 78.A NZ GLU 385.A OE2 no hydrogen 3.419 N/A ARG 79.A N GLU 75.A O no hydrogen 2.919 N/A ARG 79.A NE GLU 75.A OE2 no hydrogen 2.424 N/A ARG 79.A NH1 ASP 13.A O no hydrogen 2.884 N/A ARG 79.A NH2 GLU 75.A OE2 no hydrogen 3.136 N/A THR 80.A N ASN 77.A O no hydrogen 3.199 N/A THR 80.A OG1 LEU 76.A O no hydrogen 2.451 N/A HIS 87.A NE2 VAL 353.A O no hydrogen 2.860 N/A LEU 91.A N PRO 88.A O no hydrogen 3.328 N/A LYS 92.A NZ ALA 89.A O no hydrogen 2.953 N/A LYS 95.A N ASP 183.A OD1 no hydrogen 3.208 N/A SER 96.A N SER 182.A O no hydrogen 2.930 N/A SER 96.A OG HIS 207.A ND1 no hydrogen 2.968 N/A VAL 97.A N LEU 206.A O no hydrogen 2.781 N/A THR 98.A N VAL 180.A O no hydrogen 2.889 N/A THR 98.A OG1 HIS 189.A NE2 no hydrogen 2.438 N/A LEU 100.A N LEU 178.A O no hydrogen 2.897 N/A VAL 102.A N ASP 176.A O no hydrogen 2.951 N/A GLY 103.A N ASP 101.A OD1 no hydrogen 3.385 N/A TYR 106.A N GLY 103.A O no hydrogen 3.188 N/A TYR 106.A OH MET 175.A O no hydrogen 2.513 N/A PHE 107.A N ASP 104.A O no hydrogen 2.921 N/A SER 108.A N ALA 105.A O no hydrogen 2.935 N/A SER 108.A OG ALA 105.A O no hydrogen 2.659 N/A VAL 109.A N TYR 106.A O no hydrogen 3.248 N/A LEU 111.A N ASN 138.A O no hydrogen 2.798 N/A PHE 115.A N ASP 112.A O no hydrogen 3.220 N/A ARG 116.A N GLU 113.A O no hydrogen 2.934 N/A ARG 116.A NE LEU 111.A O no hydrogen 3.144 N/A ARG 116.A NH2 LEU 111.A O no hydrogen 3.300 N/A LYS 117.A NZ TYR 118.A OH no hydrogen 2.942 N/A TYR 118.A N PHE 115.A O no hydrogen 2.924 N/A THR 119.A N ARG 116.A O no hydrogen 2.927 N/A THR 119.A OG1 ARG 116.A O no hydrogen 2.730 N/A PHE 121.A N TYR 135.A O no hydrogen 2.935 N/A THR 122.A OG1 ASN 53.A OD1 no hydrogen 2.413 N/A ILE 123.A N ILE 133.A O no hydrogen 2.859 N/A SER 125.A OG THR 130.A O no hydrogen 2.632 N/A GLU 129.A N ILE 126.A O no hydrogen 3.321 N/A GLY 132.A N THR 130.A OG1 no hydrogen 3.390 N/A ILE 133.A N ILE 123.A O no hydrogen 2.939 N/A ARG 134.A NE THR 122.A OG1 no hydrogen 3.039 N/A ARG 134.A NH1 TYR 52.A O no hydrogen 3.376 N/A ARG 134.A NH2 TYR 52.A O no hydrogen 2.546 N/A ARG 134.A NH2 ASN 53.A OD1 no hydrogen 2.756 N/A TYR 135.A N PHE 121.A O no hydrogen 2.933 N/A TYR 135.A OH GLU 38.A OE1 no hydrogen 3.381 N/A GLN 136.A N SER 44.A O no hydrogen 2.905 N/A TYR 137.A N THR 119.A OG1 no hydrogen 2.935 N/A ASN 138.A N LYS 42.A O no hydrogen 2.955 N/A ASN 138.A ND2 GLY 41.A O no hydrogen 3.244 N/A ASN 138.A ND2 SER 44.A OG no hydrogen 2.584 N/A LEU 140.A N VAL 109.A O no hydrogen 3.028 N/A TRP 144.A NE1 THR 80.A OG1 no hydrogen 2.918 N/A LYS 145.A N ASN 77.A OD1 no hydrogen 2.683 N/A LYS 145.A NZ ASN 77.A O no hydrogen 3.315 N/A LYS 145.A NZ THR 80.A O no hydrogen 2.903 N/A LYS 145.A NZ GLN 81.A O no hydrogen 3.406 N/A LYS 145.A NZ ASP 82.A OD1 no hydrogen 3.252 N/A SER 147.A N TRP 144.A O no hydrogen 3.280 N/A SER 147.A OG PRO 141.A O no hydrogen 2.587 N/A ILE 150.A N GLY 146.A O no hydrogen 2.911 N/A PHE 151.A N SER 147.A O no hydrogen 3.063 N/A GLN 152.A N ALA 149.A O no hydrogen 3.424 N/A MET 155.A N PHE 151.A O no hydrogen 2.809 N/A THR 156.A N GLN 152.A O no hydrogen 2.918 N/A THR 156.A OG1 GLN 152.A O no hydrogen 2.862 N/A LYS 157.A N SER 153.A O no hydrogen 2.948 N/A ILE 158.A N SER 154.A O no hydrogen 2.897 N/A LEU 159.A N MET 155.A O no hydrogen 2.920 N/A LYS 163.A N LEU 159.A O no hydrogen 2.836 N/A LYS 164.A N GLU 160.A O no hydrogen 2.920 N/A GLN 165.A N PRO 161.A O no hydrogen 2.906 N/A GLN 165.A N PHE 162.A O no hydrogen 3.274 N/A ASN 166.A N PHE 162.A O no hydrogen 3.087 N/A ILE 169.A N ASN 166.A O no hydrogen 3.381 N/A VAL 170.A N GLY 181.A O no hydrogen 2.923 N/A TYR 172.A N TYR 179.A O no hydrogen 2.909 N/A TYR 174.A N ASP 177.A O no hydrogen 2.947 N/A ASP 177.A N TYR 174.A O no hydrogen 2.898 N/A LEU 178.A N LEU 100.A O no hydrogen 2.885 N/A TYR 179.A N TYR 172.A O no hydrogen 2.850 N/A VAL 180.A N THR 98.A O no hydrogen 2.897 N/A GLY 181.A N VAL 170.A O no hydrogen 2.877 N/A SER 182.A N SER 96.A O no hydrogen 2.875 N/A HIS 189.A N GLU 185.A O no hydrogen 2.437 N/A HIS 189.A NE2 THR 98.A OG1 no hydrogen 2.438 N/A ARG 190.A N ILE 186.A O no hydrogen 2.903 N/A ARG 190.A NH2 GLU 205.A OE1 no hydrogen 3.379 N/A THR 191.A N GLY 187.A O no hydrogen 2.920 N/A THR 191.A OG1 GLY 187.A O no hydrogen 3.081 N/A THR 191.A OG1 GLN 188.A O no hydrogen 2.947 N/A LYS 192.A N GLN 188.A O no hydrogen 2.908 N/A LYS 192.A NZ GLU 195.A OE1 no hydrogen 2.716 N/A ILE 193.A N HIS 189.A O no hydrogen 2.883 N/A GLU 194.A N ARG 190.A O no hydrogen 2.915 N/A GLU 195.A N THR 191.A O no hydrogen 2.908 N/A LEU 196.A N LYS 192.A O no hydrogen 2.912 N/A ARG 197.A N ILE 193.A O no hydrogen 2.888 N/A GLN 198.A N GLU 194.A O no hydrogen 2.934 N/A HIS 199.A N GLU 195.A O no hydrogen 2.914 N/A HIS 199.A NE2 ILE 158.A O no hydrogen 3.016 N/A LEU 200.A N LEU 196.A O no hydrogen 2.895 N/A TRP 203.A N LEU 200.A O no hydrogen 3.344 N/A HIS 207.A ND1 SER 96.A OG no hydrogen 2.968 N/A TRP 211.A N PRO 208.A O no hydrogen 3.034 N/A GLN 214.A N THR 323.A OG1 no hydrogen 3.129 N/A GLN 214.A NE2 THR 212.A O no hydrogen 2.589 N/A GLN 214.A NE2 THR 323.A O no hydrogen 2.845 N/A THR 225.A N ASP 228.A OD2 no hydrogen 3.103 N/A VAL 226.A N GLU 263.A O no hydrogen 2.952 N/A ASN 227.A N LEU 261.A O no hydrogen 2.985 N/A ASP 228.A N THR 225.A OG1 no hydrogen 3.048 N/A ILE 229.A N THR 225.A O no hydrogen 3.016 N/A GLN 230.A N VAL 226.A O no hydrogen 2.894 N/A LYS 231.A N ASN 227.A O no hydrogen 2.920 N/A LEU 232.A N ASP 228.A O no hydrogen 2.911 N/A VAL 233.A N ILE 229.A O no hydrogen 2.875 N/A GLY 234.A N GLN 230.A O no hydrogen 2.920 N/A LYS 235.A N LYS 231.A O no hydrogen 2.898 N/A LYS 235.A NZ VAL 217.A O no hydrogen 2.655 N/A LEU 236.A N LEU 232.A O no hydrogen 2.885 N/A ASN 237.A N VAL 233.A O no hydrogen 2.857 N/A TRP 238.A N GLY 234.A O no hydrogen 2.939 N/A ALA 239.A N LYS 235.A O no hydrogen 2.879 N/A SER 240.A N LEU 236.A O no hydrogen 2.900 N/A SER 240.A OG ASN 237.A O no hydrogen 2.553 N/A GLN 241.A N TRP 238.A O no hydrogen 3.222 N/A GLN 241.A NE2 TRP 238.A O no hydrogen 3.332 N/A ILE 242.A N ALA 239.A O no hydrogen 2.949 N/A TYR 243.A N ALA 239.A O no hydrogen 2.761 N/A TYR 243.A OH GLU 284.A O no hydrogen 2.944 N/A LYS 247.A N ASN 278.A OD1 no hydrogen 3.261 N/A GLN 250.A N GLU 274.A OE2 no hydrogen 2.677 N/A LEU 251.A N GLU 274.A OE1 no hydrogen 2.950 N/A SER 252.A N VAL 248.A O no hydrogen 2.913 N/A SER 252.A OG VAL 248.A O no hydrogen 3.018 N/A LYS 253.A N ARG 249.A O no hydrogen 2.901 N/A LEU 254.A N LEU 251.A O no hydrogen 3.211 N/A LEU 255.A N SER 252.A O no hydrogen 3.111 N/A ARG 256.A N LYS 253.A O no hydrogen 3.443 N/A THR 258.A OG1 THR 258.A O no hydrogen 2.514 N/A GLU 263.A N ALA 260.A O no hydrogen 3.114 N/A ILE 265.A N TRP 224.A O no hydrogen 2.669 N/A THR 268.A OG1 GLU 270.A OE1 no hydrogen 3.352 N/A GLU 270.A N GLU 270.A OE1 no hydrogen 2.634 N/A ALA 271.A N THR 268.A OG1 no hydrogen 3.396 N/A GLU 272.A N THR 268.A O no hydrogen 3.043 N/A LEU 273.A N GLU 269.A O no hydrogen 2.913 N/A GLU 274.A N GLU 270.A O no hydrogen 2.921 N/A LEU 275.A N ALA 271.A O no hydrogen 2.905 N/A ALA 276.A N GLU 272.A O no hydrogen 2.900 N/A GLU 277.A N LEU 273.A O no hydrogen 2.893 N/A ASN 278.A N GLU 274.A O no hydrogen 2.925 N/A ASN 278.A ND2 LYS 247.A O no hydrogen 2.847 N/A ARG 279.A N LEU 275.A O no hydrogen 2.934 N/A ARG 279.A NH1 LEU 218.A O no hydrogen 3.089 N/A ARG 279.A NH1 PRO 219.A O no hydrogen 3.269 N/A ARG 279.A NH2 PRO 219.A O no hydrogen 2.693 N/A GLU 280.A N ALA 276.A O no hydrogen 2.937 N/A ILE 281.A N GLU 277.A O no hydrogen 2.923 N/A LEU 282.A N ASN 278.A O no hydrogen 2.908 N/A LYS 283.A N ARG 279.A O no hydrogen 2.946 N/A LYS 283.A N GLU 280.A O no hydrogen 3.244 N/A GLU 284.A N ILE 281.A O no hydrogen 3.158 N/A ASP 292.A N GLN 315.A OE1 no hydrogen 2.989 N/A SER 294.A N ASP 292.A OD1 no hydrogen 3.113 N/A SER 294.A OG ASP 292.A OD1 no hydrogen 2.717 N/A SER 294.A OG ASP 292.A OD2 no hydrogen 3.093 N/A LYS 295.A N ASP 292.A O no hydrogen 3.120 N/A LYS 295.A NZ GLU 316.A OE2 no hydrogen 2.573 N/A ILE 298.A N TYR 314.A O no hydrogen 2.882 N/A ALA 299.A N LYS 360.A O no hydrogen 2.916 N/A GLU 300.A N GLN 312.A O no hydrogen 2.874 N/A GLN 302.A N THR 310.A O no hydrogen 2.880 N/A GLN 302.A NE2 GLN 312.A OE1 no hydrogen 2.755 N/A LYS 303.A NZ ASP 336.A OD2 no hydrogen 2.421 N/A GLN 304.A N GLN 308.A O no hydrogen 2.912 N/A GLN 304.A NE2 THR 310.A OG1 no hydrogen 3.051 N/A GLN 304.A NE2 LYS 396.A O no hydrogen 3.159 N/A GLN 308.A N GLY 305.A O no hydrogen 3.067 N/A GLN 308.A NE2 GLY 305.A O no hydrogen 3.559 N/A TRP 309.A N TYR 326.A O no hydrogen 2.900 N/A TRP 309.A NE1 GLN 339.A OE1 no hydrogen 2.928 N/A THR 310.A N GLN 302.A O no hydrogen 2.948 N/A THR 310.A OG1 GLN 302.A O no hydrogen 3.429 N/A THR 310.A OG1 GLN 302.A OE1 no hydrogen 2.660 N/A TYR 311.A N GLY 324.A O no hydrogen 2.920 N/A GLN 312.A N GLU 300.A O no hydrogen 2.922 N/A GLN 312.A NE2 GLN 302.A OE1 no hydrogen 2.907 N/A ILE 313.A N LYS 322.A O no hydrogen 2.819 N/A TYR 314.A N ILE 298.A O no hydrogen 2.913 N/A TYR 314.A OH GLU 300.A OE2 no hydrogen 2.981 N/A GLN 315.A NE2 ASP 292.A O no hydrogen 2.948 N/A LYS 319.A N GLU 316.A O no hydrogen 3.048 N/A LYS 319.A NZ HIS 287.A O no hydrogen 2.685 N/A ASN 320.A ND2 TYR 399.A OH no hydrogen 3.310 N/A LEU 321.A N ILE 313.A O no hydrogen 2.753 N/A LYS 322.A N ILE 313.A O no hydrogen 2.975 N/A LYS 322.A NZ TYR 311.A OH no hydrogen 3.130 N/A LYS 322.A NZ THR 323.A O no hydrogen 3.115 N/A LYS 322.A NZ GLU 350.A OE1 no hydrogen 3.555 N/A THR 323.A OG1 GLN 214.A O no hydrogen 3.542 N/A GLY 324.A N TYR 311.A O no hydrogen 2.919 N/A LYS 325.A NZ GLN 308.A OE1 no hydrogen 2.867 N/A ASN 335.A N ALA 332.A O no hydrogen 3.262 N/A ASN 335.A ND2 TYR 377.A OH no hydrogen 2.776 N/A LYS 338.A N ASN 335.A OD1 no hydrogen 2.944 N/A LYS 338.A NZ GLY 331.A O no hydrogen 2.980 N/A GLN 339.A N ASN 335.A O no hydrogen 3.315 N/A GLN 339.A NE2 ALA 332.A O no hydrogen 2.480 N/A LEU 340.A N ASP 336.A O no hydrogen 2.899 N/A THR 341.A N VAL 337.A O no hydrogen 2.897 N/A THR 341.A OG1 VAL 337.A O no hydrogen 2.667 N/A GLU 342.A N LYS 338.A O no hydrogen 2.943 N/A ALA 343.A N GLN 339.A O no hydrogen 2.893 N/A VAL 344.A N LEU 340.A O no hydrogen 2.863 N/A GLN 345.A N THR 341.A O no hydrogen 2.975 N/A GLN 345.A NE2 THR 341.A O no hydrogen 3.344 N/A GLN 345.A NE2 TYR 377.A O no hydrogen 3.259 N/A LYS 346.A N GLU 342.A O no hydrogen 2.919 N/A ILE 347.A N ALA 343.A O no hydrogen 2.900 N/A THR 348.A N VAL 344.A O no hydrogen 2.904 N/A THR 348.A OG1 VAL 344.A O no hydrogen 2.534 N/A THR 349.A N GLN 345.A O no hydrogen 2.923 N/A THR 349.A OG1 GLN 345.A O no hydrogen 3.087 N/A GLU 350.A N LYS 346.A O no hydrogen 2.925 N/A SER 351.A N ILE 347.A O no hydrogen 2.912 N/A SER 351.A OG LYS 357.A O no hydrogen 3.030 N/A ILE 352.A N THR 348.A O no hydrogen 2.899 N/A VAL 353.A N THR 349.A O no hydrogen 2.934 N/A ILE 354.A N GLU 350.A O no hydrogen 2.915 N/A TRP 355.A N SER 351.A O no hydrogen 2.911 N/A GLY 356.A N ILE 352.A O no hydrogen 2.906 N/A LYS 357.A NZ PRO 293.A O no hydrogen 3.276 N/A LYS 357.A NZ LYS 295.A O no hydrogen 2.495 N/A LYS 360.A N LEU 297.A O no hydrogen 2.610 N/A PHE 361.A N GLU 385.A O no hydrogen 2.912 N/A LYS 362.A N ALA 299.A O no hydrogen 2.860 N/A LYS 362.A NZ GLU 300.A OE2 no hydrogen 3.302 N/A LYS 362.A NZ TYR 314.A OH no hydrogen 3.354 N/A LEU 363.A N GLU 387.A O no hydrogen 2.875 N/A GLU 368.A N GLU 368.A OE1 no hydrogen 2.720 N/A TRP 370.A N GLN 366.A O no hydrogen 3.186 N/A GLU 371.A N LYS 367.A O no hydrogen 2.898 N/A THR 372.A N GLU 368.A O no hydrogen 2.930 N/A THR 372.A N THR 369.A O no hydrogen 3.077 N/A THR 372.A OG1 GLU 368.A O no hydrogen 2.513 N/A TRP 373.A N THR 369.A O no hydrogen 3.000 N/A TRP 373.A N TRP 370.A O no hydrogen 3.013 N/A TRP 374.A N TRP 370.A O no hydrogen 2.899 N/A GLU 376.A N TRP 373.A O no hydrogen 3.082 N/A TYR 377.A N TRP 374.A O no hydrogen 3.302 N/A TRP 378.A NE1 TRP 382.A O no hydrogen 2.888 N/A GLN 379.A N GLN 345.A OE1 no hydrogen 2.820 N/A GLN 379.A NE2 LYS 60.A O no hydrogen 3.145 N/A GLU 387.A N PHE 361.A O no hydrogen 2.870 N/A VAL 389.A N LEU 363.A O no hydrogen 3.197 N/A ASN 390.A ND2 GLN 366.A OE1 no hydrogen 3.019 N/A TRP 398.A N VAL 395.A O no hydrogen 2.935 N/A TYR 399.A N VAL 395.A O no hydrogen 3.298 N/A TYR 399.A N LYS 396.A O no hydrogen 2.954 N/A GLN 400.A N LEU 397.A O no hydrogen 3.190 N/A