Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8szi_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N GLU 1.A O no hydrogen 2.916 N/A ARG 6.A N LEU 2.A O no hydrogen 2.922 N/A GLN 7.A N ASP 3.A O no hydrogen 2.919 N/A GLU 8.A N GLN 4.A O no hydrogen 2.917 N/A ALA 9.A N LEU 5.A O no hydrogen 2.920 N/A GLU 10.A N ARG 6.A O no hydrogen 2.928 N/A GLN 11.A N GLN 7.A O no hydrogen 2.930 N/A GLN 11.A NE2 GLN 11.A O no hydrogen 3.444 N/A LEU 12.A N GLU 8.A O no hydrogen 2.922 N/A LYS 13.A N ALA 9.A O no hydrogen 2.931 N/A ASN 14.A N GLU 10.A O no hydrogen 2.925 N/A GLN 15.A N GLN 11.A O no hydrogen 2.928 N/A ILE 16.A N LEU 12.A O no hydrogen 2.944 N/A ARG 17.A N LYS 13.A O no hydrogen 2.920 N/A ASP 18.A N ASN 14.A O no hydrogen 2.910 N/A ALA 19.A N GLN 15.A O no hydrogen 2.946 N/A ARG 20.A N ILE 16.A O no hydrogen 2.947 N/A ARG 20.A NH2 THR 219.A O no hydrogen 3.085 N/A LYS 21.A N ARG 17.A O no hydrogen 2.896 N/A ALA 22.A N ASP 18.A O no hydrogen 2.924 N/A CYS 23.A N ALA 19.A O no hydrogen 2.959 N/A CYS 23.A SG ALA 19.A O no hydrogen 3.479 N/A ALA 24.A N LYS 21.A O no hydrogen 3.107 N/A GLN 30.A N THR 27.A O no hydrogen 2.963 N/A ILE 31.A N THR 27.A O no hydrogen 3.428 N/A THR 32.A N LEU 28.A O no hydrogen 3.176 N/A THR 32.A N SER 29.A O no hydrogen 3.066 N/A ASN 33.A N GLN 30.A O no hydrogen 3.401 N/A ILE 41.A N ALA 303.A O no hydrogen 2.399 N/A ARG 44.A N ASN 338.A O no hydrogen 2.964 N/A ARG 46.A N ILE 336.A O no hydrogen 3.076 N/A THR 48.A OG1 LEU 334.A O no hydrogen 3.563 N/A LEU 49.A N LEU 334.A O no hydrogen 3.028 N/A TYR 57.A N ALA 71.A O no hydrogen 3.135 N/A HIS 60.A N VAL 69.A O no hydrogen 3.163 N/A SER 65.A N GLY 62.A O no hydrogen 3.418 N/A SER 65.A OG ASP 64.A O no hydrogen 2.661 N/A SER 65.A OG ASP 321.A OD2 no hydrogen 3.537 N/A ARG 66.A N ASP 64.A OD1 no hydrogen 3.410 N/A ARG 66.A NE ASP 81.A OD1 no hydrogen 3.349 N/A VAL 69.A N HIS 60.A O no hydrogen 3.280 N/A SER 70.A N ILE 78.A O no hydrogen 3.343 N/A SER 70.A OG HIS 52.A NE2 no hydrogen 3.368 N/A SER 72.A OG HIS 52.A ND1 no hydrogen 3.365 N/A SER 72.A OG ASP 74.A O no hydrogen 3.399 N/A GLN 73.A N LYS 55.A O no hydrogen 3.126 N/A LYS 76.A N ASP 74.A O no hydrogen 2.729 N/A LYS 76.A NZ GLY 75.A O no hydrogen 3.332 N/A ILE 79.A N HIS 89.A O no hydrogen 3.158 N/A TRP 80.A N LEU 68.A O no hydrogen 2.901 N/A TRP 80.A NE1 SER 70.A OG no hydrogen 2.686 N/A SER 82.A N ARG 66.A O no hydrogen 2.997 N/A THR 84.A OG1 ASN 86.A OD1 no hydrogen 2.435 N/A LYS 87.A NZ ARG 50.A O no hydrogen 3.116 N/A VAL 88.A N ILE 79.A O no hydrogen 3.125 N/A ILE 91.A N LEU 77.A O no hydrogen 3.352 N/A ARG 94.A NH2 GLU 136.A OE2 no hydrogen 2.944 N/A MET 99.A N GLY 113.A O no hydrogen 2.625 N/A CYS 101.A SG VAL 69.A O no hydrogen 3.478 N/A ALA 104.A N TYR 109.A O no hydrogen 3.006 N/A ALA 111.A N ALA 102.A O no hydrogen 3.279 N/A CYS 112.A SG ALA 111.A O no hydrogen 3.124 N/A ASN 117.A N GLY 114.A O no hydrogen 3.110 N/A CYS 119.A N LEU 137.A O no hydrogen 3.262 N/A CYS 119.A SG CYS 112.A O no hydrogen 3.753 N/A ILE 121.A N ARG 135.A O no hydrogen 3.248 N/A TYR 122.A N VAL 110.A O no hydrogen 3.278 N/A ASN 123.A N ARG 132.A O no hydrogen 3.389 N/A LEU 124.A N TYR 122.A O no hydrogen 2.932 N/A LYS 125.A N ASN 108.A O no hydrogen 3.200 N/A ASN 130.A N ARG 127.A O no hydrogen 3.259 N/A SER 134.A N ILE 121.A O no hydrogen 2.811 N/A LEU 137.A N CYS 119.A O no hydrogen 2.884 N/A THR 141.A OG1 ASP 161.A OD2 no hydrogen 3.302 N/A LEU 144.A N GLY 114.A O no hydrogen 3.285 N/A SER 145.A N SER 158.A O no hydrogen 2.980 N/A SER 145.A OG VAL 185.A O no hydrogen 2.597 N/A CYS 146.A N SER 158.A O no hydrogen 3.347 N/A CYS 146.A SG LEU 188.A O no hydrogen 3.734 N/A ARG 148.A N VAL 156.A O no hydrogen 2.965 N/A ARG 148.A NH1 CYS 101.A O no hydrogen 3.061 N/A LEU 150.A N GLN 154.A O no hydrogen 3.193 N/A ASP 151.A N GLN 154.A O no hydrogen 3.293 N/A VAL 156.A N ARG 148.A O no hydrogen 3.174 N/A THR 157.A N ALA 165.A O no hydrogen 3.171 N/A THR 157.A OG1 HIS 140.A NE2 no hydrogen 3.255 N/A SER 158.A N CYS 146.A O no hydrogen 3.026 N/A SER 159.A N THR 163.A O no hydrogen 3.407 N/A SER 159.A OG HIS 140.A ND1 no hydrogen 2.801 N/A SER 159.A OG THR 163.A O no hydrogen 3.292 N/A GLY 160.A N TYR 143.A O no hydrogen 2.624 N/A ASP 161.A N SER 159.A OG no hydrogen 3.313 N/A THR 162.A OG1 ASP 161.A O no hydrogen 2.543 N/A THR 163.A OG1 ASP 161.A O no hydrogen 3.363 N/A THR 163.A OG1 THR 162.A O no hydrogen 2.783 N/A CYS 164.A N PHE 178.A O no hydrogen 3.276 N/A ALA 165.A N THR 157.A O no hydrogen 3.026 N/A LEU 166.A N THR 176.A O no hydrogen 3.129 N/A TRP 167.A N ILE 155.A O no hydrogen 2.907 N/A TRP 167.A NE1 THR 157.A OG1 no hydrogen 2.945 N/A ILE 169.A N ASN 153.A O no hydrogen 3.174 N/A THR 171.A OG1 ASP 168.A OD2 no hydrogen 2.932 N/A GLY 172.A N ASP 168.A O no hydrogen 2.620 N/A THR 175.A N LEU 166.A O no hydrogen 3.098 N/A PHE 178.A N CYS 164.A O no hydrogen 2.918 N/A THR 182.A OG1 ASP 203.A OD2 no hydrogen 2.863 N/A MET 186.A N GLY 200.A O no hydrogen 2.747 N/A SER 187.A N GLY 200.A O no hydrogen 3.462 N/A SER 189.A N VAL 198.A O no hydrogen 3.190 N/A ALA 191.A N LEU 196.A O no hydrogen 2.992 N/A THR 194.A N ALA 191.A O no hydrogen 3.041 N/A THR 194.A OG1 ASP 193.A O no hydrogen 2.492 N/A ARG 195.A N ASP 193.A OD1 no hydrogen 3.250 N/A VAL 198.A N SER 189.A O no hydrogen 3.065 N/A GLY 200.A N SER 187.A O no hydrogen 3.383 N/A CYS 202.A N ASP 184.A O no hydrogen 2.932 N/A CYS 202.A SG ASP 184.A O no hydrogen 3.331 N/A SER 205.A OG ALA 204.A O no hydrogen 2.614 N/A ALA 206.A N PHE 220.A O no hydrogen 2.901 N/A LYS 207.A N SER 199.A O no hydrogen 3.343 N/A LEU 208.A N GLN 218.A O no hydrogen 3.337 N/A TRP 209.A N PHE 197.A O no hydrogen 3.116 N/A TRP 209.A NE1 SER 199.A OG no hydrogen 2.864 N/A VAL 211.A N ARG 195.A O no hydrogen 3.172 N/A GLY 214.A N ASP 210.A O no hydrogen 3.045 N/A MET 215.A N ASP 210.A OD1 no hydrogen 2.954 N/A CYS 216.A SG GLN 218.A O no hydrogen 3.358 N/A ARG 217.A NH2 ASP 210.A OD2 no hydrogen 2.966 N/A PHE 220.A N ALA 206.A O no hydrogen 2.805 N/A HIS 223.A NE2 THR 241.A OG1 no hydrogen 2.447 N/A SER 225.A OG GLU 224.A O no hydrogen 2.760 N/A ASN 228.A N GLY 242.A O no hydrogen 2.945 N/A ASN 228.A ND2 ASP 244.A OD1 no hydrogen 2.575 N/A ASN 228.A ND2 ILE 271.A O no hydrogen 2.997 N/A ALA 229.A N GLY 242.A O no hydrogen 3.444 N/A CYS 231.A N ALA 240.A O no hydrogen 3.376 N/A CYS 231.A SG VAL 274.A O no hydrogen 3.706 N/A PHE 233.A N ALA 238.A O no hydrogen 2.610 N/A GLY 236.A N PHE 233.A O no hydrogen 2.938 N/A ASN 237.A N ASN 235.A OD1 no hydrogen 2.861 N/A PHE 239.A N PHE 251.A O no hydrogen 3.055 N/A ALA 240.A N CYS 231.A O no hydrogen 3.060 N/A THR 241.A N ARG 249.A O no hydrogen 3.022 N/A THR 241.A OG1 HIS 223.A NE2 no hydrogen 2.447 N/A GLY 242.A N ALA 229.A O no hydrogen 3.184 N/A SER 243.A OG HIS 223.A ND1 no hydrogen 3.272 N/A ASP 244.A N ASP 226.A O no hydrogen 3.048 N/A ASP 245.A N SER 243.A OG no hydrogen 2.964 N/A CYS 248.A N TYR 262.A O no hydrogen 3.076 N/A ARG 249.A NE GLU 258.A OE2 no hydrogen 2.714 N/A PHE 251.A N PHE 239.A O no hydrogen 2.981 N/A LEU 253.A N ASN 237.A O no hydrogen 3.285 N/A ASP 256.A N ASP 252.A O no hydrogen 3.022 N/A LEU 259.A N LEU 250.A O no hydrogen 3.015 N/A THR 261.A OG1 THR 261.A O no hydrogen 2.635 N/A TYR 262.A N CYS 248.A O no hydrogen 2.630 N/A TYR 262.A OH ALA 297.A O no hydrogen 2.815 N/A ASN 266.A N HIS 264.A ND1 no hydrogen 3.127 N/A CYS 269.A SG GLY 270.A O no hydrogen 4.023 N/A ILE 271.A N SER 243.A O no hydrogen 2.869 N/A THR 272.A N GLY 286.A O no hydrogen 2.955 N/A THR 272.A OG1 VAL 313.A O no hydrogen 2.652 N/A SER 273.A OG THR 272.A O no hydrogen 2.839 N/A SER 273.A OG SER 314.A O no hydrogen 2.839 N/A SER 275.A N LEU 284.A O no hydrogen 2.921 N/A SER 277.A N LEU 282.A O no hydrogen 2.876 N/A SER 277.A OG LYS 278.A O no hydrogen 3.302 N/A SER 279.A OG LYS 278.A O no hydrogen 2.375 N/A GLY 280.A N SER 277.A O no hydrogen 3.092 N/A ARG 281.A NE ASP 296.A OD1 no hydrogen 3.011 N/A ARG 281.A NE ASP 296.A OD2 no hydrogen 3.464 N/A ARG 281.A NH2 ASP 36.A O no hydrogen 3.309 N/A LEU 283.A N TRP 295.A O no hydrogen 3.450 N/A LEU 284.A N SER 275.A O no hydrogen 2.818 N/A ALA 285.A N ASN 293.A O no hydrogen 3.080 N/A GLY 286.A N SER 273.A O no hydrogen 2.762 N/A TYR 287.A N ASN 291.A O no hydrogen 3.207 N/A ASN 291.A ND2 ASP 289.A O no hydrogen 3.641 N/A CYS 292.A N LEU 306.A O no hydrogen 3.008 N/A CYS 292.A SG ALA 285.A O no hydrogen 3.232 N/A CYS 292.A SG ASN 293.A O no hydrogen 4.036 N/A ASN 293.A N ALA 285.A O no hydrogen 3.032 N/A VAL 294.A N GLY 304.A O no hydrogen 3.255 N/A TRP 295.A N LEU 283.A O no hydrogen 2.826 N/A ALA 297.A N ARG 281.A O no hydrogen 3.162 N/A LEU 298.A N ASP 296.A OD1 no hydrogen 3.122 N/A LYS 299.A NZ ASP 36.A O no hydrogen 3.423 N/A LYS 299.A NZ ASP 296.A OD2 no hydrogen 3.563 N/A ALA 300.A N ASP 296.A O no hydrogen 2.845 N/A ALA 303.A N VAL 294.A O no hydrogen 3.164 N/A LEU 306.A N CYS 292.A O no hydrogen 2.871 N/A ARG 312.A N ASN 311.A OD1 no hydrogen 2.952 N/A SER 314.A N GLY 328.A O no hydrogen 3.050 N/A SER 314.A OG ILE 56.A O no hydrogen 2.901 N/A CYS 315.A N GLY 328.A O no hydrogen 3.423 N/A GLY 317.A N ALA 326.A O no hydrogen 3.104 N/A THR 319.A N ALA 324.A O no hydrogen 3.467 N/A THR 319.A OG1 ASP 321.A OD1 no hydrogen 2.922 N/A GLY 322.A N THR 319.A O no hydrogen 3.219 N/A MET 323.A N THR 319.A OG1 no hydrogen 2.973 N/A ALA 324.A N THR 319.A OG1 no hydrogen 3.410 N/A VAL 325.A N TRP 337.A O no hydrogen 3.057 N/A ALA 326.A N GLY 317.A O no hydrogen 3.123 N/A THR 327.A N LYS 335.A O no hydrogen 3.040 N/A GLY 328.A N CYS 315.A O no hydrogen 2.703 N/A SER 329.A OG HIS 309.A ND1 no hydrogen 2.628 N/A SER 329.A OG ASP 331.A OD1 no hydrogen 2.210 N/A TRP 330.A N ARG 312.A O no hydrogen 2.736 N/A SER 332.A OG HIS 52.A O no hydrogen 3.358 N/A LEU 334.A N LEU 49.A O no hydrogen 3.347 N/A LYS 335.A N THR 327.A O no hydrogen 3.312 N/A ILE 336.A N ARG 47.A O no hydrogen 3.235 N/A TRP 337.A N VAL 325.A O no hydrogen 2.717 N/A ASN 338.A N ARG 44.A O no hydrogen 3.097 N/A