Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8x16_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 2.A O no hydrogen 3.565 N/A SER 1.A OG GLN 5.A OE1 no hydrogen 2.878 N/A GLU 2.A N SER 1.A OG no hydrogen 2.568 N/A GLN 5.A N GLU 2.A O no hydrogen 3.328 N/A ARG 7.A N LEU 3.A O no hydrogen 2.912 N/A GLN 8.A N ASP 4.A O no hydrogen 3.470 N/A GLU 9.A N GLN 5.A O no hydrogen 2.909 N/A ALA 10.A N LEU 6.A O no hydrogen 2.908 N/A GLU 11.A N ARG 7.A O no hydrogen 2.911 N/A GLN 12.A N GLN 8.A O no hydrogen 2.894 N/A LEU 13.A N GLU 9.A O no hydrogen 2.917 N/A LYS 14.A N ALA 10.A O no hydrogen 2.918 N/A LYS 14.A NZ GLU 11.A OE1 no hydrogen 3.444 N/A ASN 15.A N GLU 11.A O no hydrogen 2.906 N/A GLN 16.A N GLN 12.A O no hydrogen 2.889 N/A ILE 17.A N LEU 13.A O no hydrogen 2.915 N/A ARG 18.A N LYS 14.A O no hydrogen 2.911 N/A ASP 19.A N ASN 15.A O no hydrogen 2.905 N/A ALA 20.A N GLN 16.A O no hydrogen 2.897 N/A ARG 21.A N ILE 17.A O no hydrogen 2.917 N/A ARG 21.A NE ASP 257.A O no hydrogen 3.088 N/A LYS 22.A N ARG 18.A O no hydrogen 2.901 N/A ALA 23.A N ASP 19.A O no hydrogen 2.896 N/A CYS 24.A N ALA 20.A O no hydrogen 2.911 N/A CYS 24.A SG ALA 20.A O no hydrogen 3.216 N/A ALA 25.A N ARG 21.A O no hydrogen 3.090 N/A THR 33.A N LEU 29.A O no hydrogen 2.909 N/A ASN 34.A N SER 30.A O no hydrogen 2.913 N/A ILE 36.A N THR 33.A O no hydrogen 2.975 N/A ILE 42.A N ALA 304.A O no hydrogen 2.942 N/A ARG 47.A N ILE 337.A O no hydrogen 2.906 N/A ARG 47.A NE ASN 339.A OD1 no hydrogen 3.113 N/A ARG 48.A NH1 ARG 47.A O no hydrogen 2.981 N/A LEU 50.A N LEU 335.A O no hydrogen 3.026 N/A TYR 58.A N ALA 72.A O no hydrogen 2.918 N/A HIS 61.A N VAL 70.A O no hydrogen 3.402 N/A THR 64.A OG1 PRO 106.A O no hydrogen 2.430 N/A SER 66.A N GLY 63.A O no hydrogen 3.310 N/A SER 66.A OG ASP 322.A OD2 no hydrogen 3.049 N/A ARG 67.A NE ASP 82.A OD1 no hydrogen 3.330 N/A LEU 69.A N TRP 81.A O no hydrogen 2.929 N/A VAL 70.A N HIS 61.A O no hydrogen 3.370 N/A SER 71.A N ILE 79.A O no hydrogen 2.896 N/A SER 71.A OG HIS 53.A NE2 no hydrogen 2.952 N/A ALA 72.A N ALA 59.A O no hydrogen 3.284 N/A SER 73.A OG LYS 56.A O no hydrogen 3.005 N/A SER 73.A OG ASP 75.A OD2 no hydrogen 3.035 N/A GLN 74.A N LYS 56.A O no hydrogen 2.787 N/A GLY 76.A N SER 73.A O no hydrogen 3.390 N/A LYS 77.A NZ GLY 76.A O no hydrogen 3.494 N/A LEU 78.A N ILE 92.A O no hydrogen 2.920 N/A ILE 79.A N SER 71.A O no hydrogen 2.932 N/A ILE 80.A N HIS 90.A O no hydrogen 2.906 N/A TRP 81.A N LEU 69.A O no hydrogen 2.872 N/A TRP 81.A NE1 HIS 53.A NE2 no hydrogen 3.005 N/A ASP 82.A N ASN 87.A O no hydrogen 3.218 N/A SER 83.A N ARG 67.A O no hydrogen 2.866 N/A SER 83.A OG ARG 67.A O no hydrogen 2.929 N/A TYR 84.A N ASP 82.A OD1 no hydrogen 3.419 N/A THR 85.A OG1 ASP 82.A OD2 no hydrogen 2.560 N/A THR 86.A N ASP 82.A O no hydrogen 2.810 N/A THR 86.A OG1 THR 85.A O no hydrogen 2.495 N/A VAL 89.A N ILE 80.A O no hydrogen 2.718 N/A ILE 92.A N LEU 78.A O no hydrogen 2.886 N/A LEU 94.A N GLY 76.A O no hydrogen 2.986 N/A VAL 99.A N SER 97.A O no hydrogen 2.927 N/A MET 100.A N GLY 114.A O no hydrogen 2.901 N/A THR 101.A N GLY 114.A O no hydrogen 3.133 N/A CYS 102.A SG ALA 59.A O no hydrogen 3.294 N/A CYS 102.A SG VAL 70.A O no hydrogen 3.859 N/A ALA 103.A N ALA 112.A O no hydrogen 3.045 N/A TYR 104.A N HIS 61.A ND1 no hydrogen 3.065 N/A ALA 105.A N TYR 110.A O no hydrogen 3.154 N/A SER 107.A OG ASP 153.A OD1 no hydrogen 2.792 N/A GLY 108.A N ALA 105.A O no hydrogen 3.122 N/A VAL 111.A N TYR 123.A O no hydrogen 2.901 N/A ALA 112.A N ALA 103.A O no hydrogen 3.175 N/A CYS 113.A N SER 121.A O no hydrogen 2.927 N/A GLY 114.A N THR 101.A O no hydrogen 3.199 N/A LEU 116.A N TRP 98.A O no hydrogen 2.933 N/A ASN 118.A ND2 HIS 141.A O no hydrogen 3.699 N/A CYS 120.A SG CYS 113.A O no hydrogen 3.414 N/A ILE 122.A N ARG 136.A O no hydrogen 2.912 N/A TYR 123.A N VAL 111.A O no hydrogen 2.886 N/A LEU 125.A N ASN 109.A O no hydrogen 2.800 N/A LYS 126.A N ASN 124.A OD1 no hydrogen 3.197 N/A THR 127.A OG1 ASN 131.A O no hydrogen 2.524 N/A GLY 130.A N THR 127.A O no hydrogen 3.264 N/A SER 135.A N ILE 122.A O no hydrogen 2.452 N/A ARG 136.A NE ILE 170.A O no hydrogen 2.988 N/A LEU 145.A N GLY 115.A O no hydrogen 2.642 N/A SER 146.A N SER 159.A O no hydrogen 2.873 N/A SER 146.A OG SER 159.A O no hydrogen 3.417 N/A SER 146.A OG SER 159.A OG no hydrogen 2.434 N/A SER 146.A OG VAL 186.A O no hydrogen 2.755 N/A SER 146.A OG MET 187.A O no hydrogen 3.412 N/A CYS 148.A SG VAL 157.A O no hydrogen 3.572 N/A CYS 148.A SG THR 158.A OG1 no hydrogen 3.500 N/A ARG 149.A N VAL 157.A O no hydrogen 2.913 N/A ARG 149.A NH1 CYS 148.A O no hydrogen 2.678 N/A LEU 151.A N GLN 155.A O no hydrogen 3.297 N/A ILE 156.A N TRP 168.A O no hydrogen 2.928 N/A VAL 157.A N ARG 149.A O no hydrogen 2.887 N/A THR 158.A N ALA 166.A O no hydrogen 2.904 N/A SER 159.A N CYS 147.A O no hydrogen 2.907 N/A SER 159.A OG SER 146.A OG no hydrogen 2.434 N/A SER 159.A OG CYS 147.A O no hydrogen 3.243 N/A SER 160.A OG ASP 162.A OD1 no hydrogen 2.356 N/A SER 160.A OG THR 164.A O no hydrogen 3.176 N/A THR 163.A OG1 HIS 182.A O no hydrogen 3.379 N/A THR 164.A OG1 SER 160.A OG no hydrogen 3.408 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 2.203 N/A CYS 165.A N PHE 179.A O no hydrogen 2.914 N/A ALA 166.A N THR 158.A O no hydrogen 2.916 N/A LEU 167.A N THR 177.A O no hydrogen 2.912 N/A TRP 168.A N ILE 156.A O no hydrogen 2.865 N/A ASP 169.A N GLN 174.A O no hydrogen 3.152 N/A ILE 170.A N ASN 154.A O no hydrogen 2.649 N/A GLU 171.A N ASP 169.A OD1 no hydrogen 2.999 N/A THR 172.A N ASP 169.A O no hydrogen 3.199 N/A GLY 173.A N ASP 169.A O no hydrogen 2.507 N/A THR 176.A N LEU 167.A O no hydrogen 2.504 N/A THR 176.A OG1 LEU 167.A O no hydrogen 3.462 N/A THR 178.A OG1 GLN 175.A OE1 no hydrogen 3.028 N/A PHE 179.A N CYS 165.A O no hydrogen 2.880 N/A HIS 182.A NE2 SER 200.A OG no hydrogen 2.532 N/A THR 183.A N ASP 204.A OD2 no hydrogen 3.102 N/A THR 183.A OG1 ASP 204.A OD2 no hydrogen 2.630 N/A MET 187.A N GLY 201.A O no hydrogen 2.795 N/A SER 188.A N GLY 201.A O no hydrogen 2.941 N/A SER 188.A OG LEU 189.A O no hydrogen 3.453 N/A SER 190.A N VAL 199.A O no hydrogen 2.915 N/A SER 190.A OG VAL 199.A O no hydrogen 2.800 N/A ALA 192.A N LEU 197.A O no hydrogen 2.999 N/A THR 195.A N ALA 192.A O no hydrogen 2.997 N/A THR 195.A OG1 ASP 194.A O no hydrogen 2.487 N/A ARG 196.A N ASP 194.A OD1 no hydrogen 2.922 N/A PHE 198.A N TRP 210.A O no hydrogen 2.927 N/A VAL 199.A N SER 190.A O no hydrogen 2.921 N/A SER 200.A N LYS 208.A O no hydrogen 2.879 N/A SER 200.A OG HIS 182.A NE2 no hydrogen 2.532 N/A SER 200.A OG LYS 208.A O no hydrogen 3.392 N/A GLY 201.A N SER 188.A O no hydrogen 2.886 N/A ALA 202.A N SER 206.A O no hydrogen 3.455 N/A CYS 203.A N ASP 185.A O no hydrogen 2.796 N/A CYS 203.A SG ASP 185.A O no hydrogen 3.321 N/A SER 206.A OG ASP 204.A OD1 no hydrogen 2.836 N/A ALA 207.A N PHE 221.A O no hydrogen 3.225 N/A LYS 208.A N SER 200.A O no hydrogen 2.926 N/A LYS 208.A NZ THR 220.A OG1 no hydrogen 3.400 N/A LEU 209.A N GLN 219.A O no hydrogen 3.443 N/A TRP 210.A N PHE 198.A O no hydrogen 2.885 N/A TRP 210.A NE1 HIS 182.A NE2 no hydrogen 3.350 N/A VAL 212.A N ARG 196.A O no hydrogen 2.941 N/A CYS 217.A SG GLN 219.A O no hydrogen 3.899 N/A CYS 217.A SG THR 220.A OG1 no hydrogen 3.468 N/A ARG 218.A N LEU 209.A O no hydrogen 3.445 N/A ARG 218.A NE ASP 211.A OD1 no hydrogen 3.054 N/A ARG 218.A NE ASP 211.A OD2 no hydrogen 3.301 N/A ARG 218.A NH2 ASP 211.A OD2 no hydrogen 3.526 N/A GLN 219.A NE2 LEU 254.A O no hydrogen 3.018 N/A PHE 221.A N ALA 207.A O no hydrogen 3.207 N/A HIS 224.A NE2 THR 242.A OG1 no hydrogen 2.338 N/A SER 226.A OG ASP 227.A OD2 no hydrogen 3.417 N/A ILE 228.A N ALA 202.A O no hydrogen 3.165 N/A ASN 229.A N GLY 243.A O no hydrogen 2.908 N/A ASN 229.A ND2 ILE 272.A O no hydrogen 3.465 N/A CYS 232.A N ALA 241.A O no hydrogen 3.282 N/A CYS 232.A SG PHE 233.A O no hydrogen 3.439 N/A PHE 234.A N ALA 239.A O no hydrogen 2.866 N/A GLY 237.A N PHE 234.A O no hydrogen 3.044 N/A ASN 238.A N ASN 236.A OD1 no hydrogen 2.967 N/A PHE 240.A N PHE 252.A O no hydrogen 2.919 N/A ALA 241.A N CYS 232.A O no hydrogen 3.174 N/A THR 242.A N ARG 250.A O no hydrogen 2.881 N/A THR 242.A OG1 HIS 224.A NE2 no hydrogen 2.338 N/A THR 242.A OG1 ARG 250.A O no hydrogen 3.292 N/A GLY 243.A N ALA 230.A O no hydrogen 3.149 N/A SER 244.A OG ASP 227.A O no hydrogen 2.476 N/A ASP 245.A N ASP 227.A O no hydrogen 3.427 N/A THR 248.A N ASP 246.A OD1 no hydrogen 3.380 N/A THR 248.A OG1 ASP 246.A OD1 no hydrogen 2.838 N/A THR 248.A OG1 ASP 246.A OD2 no hydrogen 3.041 N/A CYS 249.A N TYR 263.A O no hydrogen 2.934 N/A CYS 249.A SG THR 242.A O no hydrogen 3.546 N/A ARG 250.A N THR 242.A O no hydrogen 2.922 N/A LEU 251.A N MET 261.A O no hydrogen 2.927 N/A PHE 252.A N PHE 240.A O no hydrogen 2.889 N/A LEU 254.A N ASN 238.A O no hydrogen 2.743 N/A ARG 255.A N ASP 253.A OD1 no hydrogen 2.769 N/A ARG 255.A NE ASP 253.A OD1 no hydrogen 3.396 N/A ASP 257.A N ASP 253.A O no hydrogen 2.931 N/A LEU 260.A N LEU 251.A O no hydrogen 2.632 N/A TYR 263.A N CYS 249.A O no hydrogen 2.856 N/A TYR 263.A OH ALA 298.A O no hydrogen 2.913 N/A GLY 271.A N ASP 289.A OD2 no hydrogen 2.825 N/A ILE 272.A N SER 244.A O no hydrogen 3.299 N/A THR 273.A N GLY 287.A O no hydrogen 2.902 N/A THR 273.A OG1 GLY 287.A O no hydrogen 3.358 N/A THR 273.A OG1 VAL 314.A O no hydrogen 2.287 N/A SER 274.A N GLY 287.A O no hydrogen 3.521 N/A SER 276.A N LEU 285.A O no hydrogen 3.083 N/A SER 276.A OG LEU 317.A O no hydrogen 3.101 N/A SER 278.A N LEU 283.A O no hydrogen 3.239 N/A SER 278.A OG LEU 283.A O no hydrogen 3.492 N/A GLY 281.A N SER 278.A OG no hydrogen 3.266 N/A ARG 282.A NE ASP 297.A OD1 no hydrogen 2.567 N/A ARG 282.A NE ASP 297.A OD2 no hydrogen 3.471 N/A ARG 282.A NH2 ASP 37.A O no hydrogen 3.005 N/A LEU 284.A N TRP 296.A O no hydrogen 2.907 N/A LEU 285.A N SER 276.A O no hydrogen 3.001 N/A ALA 286.A N ASN 294.A O no hydrogen 2.882 N/A GLY 287.A N SER 274.A O no hydrogen 2.911 N/A ASP 289.A N GLY 271.A O no hydrogen 3.030 N/A CYS 293.A N LEU 307.A O no hydrogen 2.897 N/A CYS 293.A SG ALA 286.A O no hydrogen 3.178 N/A CYS 293.A SG ASN 294.A O no hydrogen 3.478 N/A ASN 294.A N ALA 286.A O no hydrogen 2.932 N/A VAL 295.A N GLY 305.A O no hydrogen 2.875 N/A TRP 296.A N LEU 284.A O no hydrogen 2.890 N/A ASP 297.A N ASP 302.A O no hydrogen 3.107 N/A ALA 298.A N ARG 282.A O no hydrogen 2.740 N/A LEU 299.A N ASP 297.A OD2 no hydrogen 3.020 N/A LYS 300.A N ASP 297.A OD2 no hydrogen 2.477 N/A ALA 301.A N ASP 297.A O no hydrogen 3.093 N/A GLY 305.A N VAL 295.A O no hydrogen 2.927 N/A LEU 307.A N CYS 293.A O no hydrogen 2.900 N/A ARG 313.A N ASN 312.A OD1 no hydrogen 2.449 N/A SER 315.A N GLY 329.A O no hydrogen 2.898 N/A SER 315.A OG ILE 57.A O no hydrogen 2.695 N/A SER 315.A OG TYR 58.A O no hydrogen 3.531 N/A SER 315.A OG GLY 329.A O no hydrogen 2.704 N/A CYS 316.A N GLY 329.A O no hydrogen 2.901 N/A CYS 316.A SG GLY 329.A O no hydrogen 3.527 N/A GLY 318.A N ALA 327.A O no hydrogen 2.907 N/A THR 320.A N ALA 325.A O no hydrogen 3.489 N/A THR 320.A OG1 ASP 322.A OD1 no hydrogen 3.388 N/A THR 320.A OG1 ALA 325.A O no hydrogen 3.358 N/A ASP 321.A N SER 66.A OG no hydrogen 3.317 N/A GLY 323.A N THR 320.A O no hydrogen 3.366 N/A MET 324.A N THR 320.A OG1 no hydrogen 2.953 N/A MET 324.A N ASP 322.A OD1 no hydrogen 3.163 N/A VAL 326.A N TRP 338.A O no hydrogen 2.890 N/A ALA 327.A N GLY 318.A O no hydrogen 2.894 N/A THR 328.A N LYS 336.A O no hydrogen 2.911 N/A GLY 329.A N CYS 316.A O no hydrogen 2.905 N/A SER 330.A N PHE 334.A O no hydrogen 3.447 N/A SER 330.A OG ARG 313.A O no hydrogen 2.425 N/A TRP 331.A N ARG 313.A O no hydrogen 3.371 N/A SER 333.A OG ASP 332.A O no hydrogen 2.470 N/A PHE 334.A N ASP 332.A OD1 no hydrogen 3.422 N/A LEU 335.A N LEU 50.A O no hydrogen 3.122 N/A LYS 336.A N THR 328.A O no hydrogen 2.908 N/A LYS 336.A NZ GLY 309.A O no hydrogen 2.397 N/A ILE 337.A N ARG 48.A O no hydrogen 3.042 N/A TRP 338.A N VAL 326.A O no hydrogen 2.899 N/A