Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8u4p_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N GLN 1.A O no hydrogen 3.509 N/A ALA 6.A N LEU 2.A O no hydrogen 2.913 N/A GLU 7.A N ARG 3.A O no hydrogen 2.898 N/A GLN 8.A N GLN 4.A O no hydrogen 2.902 N/A LEU 9.A N GLU 5.A O no hydrogen 2.905 N/A LYS 10.A N ALA 6.A O no hydrogen 2.914 N/A ASN 11.A N GLU 7.A O no hydrogen 2.895 N/A GLN 12.A N GLN 8.A O no hydrogen 2.904 N/A ILE 13.A N LEU 9.A O no hydrogen 2.905 N/A ARG 14.A N LYS 10.A O no hydrogen 2.910 N/A ASP 15.A N ASN 11.A O no hydrogen 2.893 N/A ALA 16.A N GLN 12.A O no hydrogen 2.902 N/A ARG 17.A N ILE 13.A O no hydrogen 2.901 N/A ARG 17.A NH2 THR 216.A O no hydrogen 2.650 N/A LYS 18.A N ARG 14.A O no hydrogen 2.906 N/A ALA 19.A N ASP 15.A O no hydrogen 2.898 N/A CYS 20.A N ALA 16.A O no hydrogen 3.325 N/A CYS 20.A SG ALA 16.A O no hydrogen 3.705 N/A ALA 21.A N LYS 18.A O no hydrogen 3.271 N/A GLN 27.A N THR 24.A O no hydrogen 3.291 N/A GLN 27.A N THR 24.A OG1 no hydrogen 3.208 N/A ILE 28.A N LEU 25.A O no hydrogen 3.197 N/A THR 29.A N LEU 25.A O no hydrogen 2.930 N/A ILE 38.A N ALA 300.A O no hydrogen 2.807 N/A THR 42.A OG1 ILE 333.A O no hydrogen 3.412 N/A ARG 43.A N ILE 333.A O no hydrogen 2.878 N/A ARG 44.A NE SER 79.A O no hydrogen 3.301 N/A ARG 44.A NE TYR 80.A O no hydrogen 3.085 N/A ARG 44.A NH2 TYR 80.A O no hydrogen 2.584 N/A HIS 49.A NE2 SER 67.A OG no hydrogen 2.564 N/A LEU 50.A N ASP 71.A OD2 no hydrogen 3.372 N/A TYR 54.A N ALA 68.A O no hydrogen 2.974 N/A HIS 57.A N VAL 66.A O no hydrogen 3.093 N/A GLY 59.A N LEU 64.A O no hydrogen 2.709 N/A THR 60.A OG1 PRO 102.A O no hydrogen 2.846 N/A SER 62.A N GLY 59.A O no hydrogen 3.298 N/A SER 62.A OG ASP 318.A OD2 no hydrogen 2.961 N/A ARG 63.A N ASP 61.A OD1 no hydrogen 3.156 N/A ARG 63.A NE ASP 78.A OD1 no hydrogen 2.965 N/A ARG 63.A NE ASP 78.A OD2 no hydrogen 3.482 N/A LEU 64.A N ASP 61.A OD1 no hydrogen 3.345 N/A VAL 66.A N HIS 57.A O no hydrogen 3.123 N/A SER 67.A N ILE 75.A O no hydrogen 2.901 N/A SER 67.A OG HIS 49.A NE2 no hydrogen 2.564 N/A ALA 68.A N ALA 55.A O no hydrogen 3.243 N/A SER 69.A N LYS 73.A O no hydrogen 2.994 N/A SER 69.A OG LYS 52.A O no hydrogen 2.768 N/A SER 69.A OG ASP 71.A OD1 no hydrogen 3.162 N/A GLN 70.A N LYS 52.A O no hydrogen 3.049 N/A LEU 74.A N ILE 88.A O no hydrogen 2.948 N/A ILE 75.A N SER 67.A O no hydrogen 2.915 N/A ILE 76.A N HIS 86.A O no hydrogen 2.881 N/A TRP 77.A N LEU 65.A O no hydrogen 2.895 N/A TRP 77.A NE1 SER 67.A OG no hydrogen 2.843 N/A SER 79.A N ARG 63.A O no hydrogen 3.008 N/A SER 79.A OG ARG 63.A O no hydrogen 2.477 N/A THR 81.A OG1 ASN 83.A OD1 no hydrogen 2.470 N/A THR 82.A N ASP 78.A O no hydrogen 2.752 N/A LYS 84.A NZ ARG 47.A O no hydrogen 3.548 N/A VAL 85.A N ILE 76.A O no hydrogen 2.783 N/A HIS 86.A N ILE 76.A O no hydrogen 2.952 N/A ILE 88.A N LEU 74.A O no hydrogen 2.876 N/A LEU 90.A N GLY 72.A O no hydrogen 2.985 N/A ARG 91.A NH1 GLU 133.A OE2 no hydrogen 2.619 N/A MET 96.A N GLY 110.A O no hydrogen 2.907 N/A THR 97.A N GLY 110.A O no hydrogen 3.374 N/A CYS 98.A SG VAL 66.A O no hydrogen 3.804 N/A ALA 99.A N ALA 108.A O no hydrogen 3.078 N/A ALA 101.A N TYR 106.A O no hydrogen 3.155 N/A SER 103.A OG ASP 149.A OD1 no hydrogen 3.105 N/A SER 103.A OG ASP 149.A OD2 no hydrogen 2.971 N/A GLY 104.A N ALA 101.A O no hydrogen 3.042 N/A VAL 107.A N TYR 119.A O no hydrogen 2.937 N/A ALA 108.A N ALA 99.A O no hydrogen 3.249 N/A CYS 109.A N SER 117.A O no hydrogen 2.932 N/A CYS 109.A SG THR 97.A O no hydrogen 3.654 N/A LEU 112.A N TRP 94.A O no hydrogen 2.988 N/A ASN 114.A N GLY 111.A O no hydrogen 3.396 N/A CYS 116.A N LEU 134.A O no hydrogen 2.929 N/A CYS 116.A SG CYS 109.A O no hydrogen 3.689 N/A SER 117.A N CYS 109.A O no hydrogen 2.883 N/A ILE 118.A N ARG 132.A O no hydrogen 2.892 N/A TYR 119.A N VAL 107.A O no hydrogen 2.874 N/A ASN 120.A N ARG 129.A O no hydrogen 3.058 N/A LEU 121.A N ASN 105.A O no hydrogen 2.749 N/A THR 123.A N LEU 121.A O no hydrogen 2.761 N/A GLY 126.A N THR 123.A O no hydrogen 3.292 N/A SER 131.A N ILE 118.A O no hydrogen 2.735 N/A ARG 132.A N ILE 118.A O no hydrogen 2.950 N/A LEU 134.A N CYS 116.A O no hydrogen 2.873 N/A HIS 137.A NE2 THR 154.A OG1 no hydrogen 2.916 N/A THR 138.A OG1 ASP 158.A OD2 no hydrogen 2.877 N/A LEU 141.A N GLY 111.A O no hydrogen 3.225 N/A SER 142.A N SER 155.A O no hydrogen 3.117 N/A SER 142.A OG SER 155.A O no hydrogen 3.154 N/A SER 142.A OG SER 155.A OG no hydrogen 2.986 N/A SER 142.A OG VAL 182.A O no hydrogen 2.717 N/A CYS 143.A SG LEU 185.A O no hydrogen 3.736 N/A CYS 144.A SG THR 97.A OG1 no hydrogen 3.777 N/A ARG 145.A N VAL 153.A O no hydrogen 2.891 N/A ARG 145.A NH1 CYS 98.A O no hydrogen 3.038 N/A ARG 145.A NH1 CYS 144.A O no hydrogen 3.424 N/A LEU 147.A N GLN 151.A O no hydrogen 3.072 N/A ASP 148.A N GLN 151.A O no hydrogen 3.454 N/A ASN 150.A N ASP 148.A OD1 no hydrogen 2.578 N/A GLN 151.A NE2 ASP 148.A OD2 no hydrogen 2.673 N/A VAL 153.A N ARG 145.A O no hydrogen 2.909 N/A THR 154.A N ALA 162.A O no hydrogen 2.906 N/A THR 154.A OG1 HIS 137.A NE2 no hydrogen 2.916 N/A SER 155.A N CYS 143.A O no hydrogen 2.924 N/A SER 155.A OG SER 142.A OG no hydrogen 2.986 N/A SER 156.A N THR 160.A O no hydrogen 2.956 N/A SER 156.A OG TYR 140.A O no hydrogen 3.322 N/A GLY 157.A N TYR 140.A O no hydrogen 2.613 N/A THR 159.A OG1 ASP 158.A O no hydrogen 2.516 N/A THR 160.A OG1 ASP 158.A OD1 no hydrogen 2.370 N/A THR 160.A OG1 ASP 158.A OD2 no hydrogen 3.033 N/A CYS 161.A N PHE 175.A O no hydrogen 2.946 N/A ALA 162.A N THR 154.A O no hydrogen 2.886 N/A LEU 163.A N THR 173.A O no hydrogen 2.874 N/A TRP 164.A N ILE 152.A O no hydrogen 3.036 N/A TRP 164.A NE1 THR 154.A OG1 no hydrogen 2.973 N/A ILE 166.A N ASN 150.A O no hydrogen 3.296 N/A GLY 169.A N ASP 165.A O no hydrogen 2.673 N/A THR 172.A N LEU 163.A O no hydrogen 2.777 N/A THR 173.A N LEU 163.A O no hydrogen 2.955 N/A THR 174.A OG1 GLN 171.A OE1 no hydrogen 3.122 N/A PHE 175.A N CYS 161.A O no hydrogen 2.869 N/A HIS 178.A ND1 ASP 200.A OD2 no hydrogen 3.198 N/A HIS 178.A NE2 SER 196.A OG no hydrogen 2.887 N/A THR 179.A N ASP 200.A OD2 no hydrogen 3.064 N/A MET 183.A N GLY 197.A O no hydrogen 3.142 N/A SER 186.A N VAL 195.A O no hydrogen 3.324 N/A ALA 188.A N LEU 193.A O no hydrogen 3.063 N/A THR 191.A N ALA 188.A O no hydrogen 3.028 N/A THR 191.A OG1 ASP 190.A O no hydrogen 2.494 N/A ARG 192.A N ASP 190.A OD1 no hydrogen 3.138 N/A PHE 194.A N TRP 206.A O no hydrogen 2.948 N/A VAL 195.A N SER 186.A O no hydrogen 3.113 N/A SER 196.A N LYS 204.A O no hydrogen 2.922 N/A SER 196.A OG HIS 178.A NE2 no hydrogen 2.887 N/A ALA 198.A N SER 202.A O no hydrogen 3.338 N/A CYS 199.A N ASP 181.A O no hydrogen 2.644 N/A CYS 199.A SG ASP 181.A O no hydrogen 3.522 N/A SER 202.A OG ASP 200.A OD1 no hydrogen 2.391 N/A ALA 203.A N PHE 217.A O no hydrogen 2.900 N/A LYS 204.A N SER 196.A O no hydrogen 2.914 N/A LEU 205.A N GLN 215.A O no hydrogen 2.928 N/A TRP 206.A N PHE 194.A O no hydrogen 2.868 N/A TRP 206.A NE1 SER 196.A OG no hydrogen 2.339 N/A VAL 208.A N ARG 192.A O no hydrogen 3.508 N/A ARG 209.A N ASP 207.A OD1 no hydrogen 3.155 N/A ARG 209.A NH1 GLN 151.A OE1 no hydrogen 3.496 N/A GLU 210.A N ASP 207.A OD1 no hydrogen 3.463 N/A GLY 211.A N ASP 207.A O no hydrogen 2.857 N/A CYS 213.A SG LEU 205.A O no hydrogen 3.740 N/A CYS 213.A SG GLN 215.A O no hydrogen 3.491 N/A ARG 214.A N LEU 205.A O no hydrogen 2.857 N/A ARG 214.A NE ASP 207.A OD2 no hydrogen 2.957 N/A ARG 214.A NH2 ASP 207.A OD2 no hydrogen 2.524 N/A GLN 215.A NE2 LEU 250.A O no hydrogen 3.151 N/A PHE 217.A N ALA 203.A O no hydrogen 2.887 N/A HIS 220.A NE2 THR 238.A OG1 no hydrogen 2.789 N/A ILE 224.A N ALA 198.A O no hydrogen 3.368 N/A ASN 225.A N GLY 239.A O no hydrogen 2.911 N/A ASN 225.A ND2 ILE 268.A O no hydrogen 3.415 N/A ALA 226.A N GLY 239.A O no hydrogen 3.443 N/A CYS 228.A N ALA 237.A O no hydrogen 3.141 N/A CYS 228.A SG PHE 229.A O no hydrogen 3.775 N/A PHE 230.A N ALA 235.A O no hydrogen 2.616 N/A GLY 233.A N PHE 230.A O no hydrogen 2.906 N/A ASN 234.A N ASN 232.A OD1 no hydrogen 3.139 N/A PHE 236.A N PHE 248.A O no hydrogen 2.931 N/A ALA 237.A N CYS 228.A O no hydrogen 2.924 N/A THR 238.A N ARG 246.A O no hydrogen 2.890 N/A THR 238.A OG1 HIS 220.A NE2 no hydrogen 2.789 N/A GLY 239.A N ALA 226.A O no hydrogen 3.345 N/A SER 240.A N THR 244.A O no hydrogen 3.428 N/A SER 240.A OG HIS 220.A ND1 no hydrogen 2.867 N/A SER 240.A OG ASP 242.A OD1 no hydrogen 2.245 N/A ASP 241.A N ASP 223.A O no hydrogen 2.986 N/A THR 244.A OG1 TYR 259.A O no hydrogen 3.229 N/A CYS 245.A N TYR 259.A O no hydrogen 2.929 N/A ARG 246.A N THR 238.A O no hydrogen 2.922 N/A ARG 246.A NH1 GLU 255.A OE2 no hydrogen 2.324 N/A LEU 247.A N MET 257.A O no hydrogen 2.914 N/A PHE 248.A N PHE 236.A O no hydrogen 2.888 N/A LEU 250.A N ASN 234.A O no hydrogen 3.399 N/A ALA 252.A N ASP 249.A OD1 no hydrogen 2.727 N/A ASP 253.A N ASP 249.A O no hydrogen 2.904 N/A GLN 254.A NE2 ARG 17.A O no hydrogen 3.237 N/A GLN 254.A NE2 ALA 252.A O no hydrogen 2.817 N/A LEU 256.A N LEU 247.A O no hydrogen 2.835 N/A THR 258.A OG1 CYS 245.A O no hydrogen 3.400 N/A TYR 259.A N CYS 245.A O no hydrogen 2.860 N/A TYR 259.A OH ALA 294.A O no hydrogen 2.802 N/A ASN 263.A N HIS 261.A ND1 no hydrogen 3.118 N/A ILE 264.A N HIS 261.A O no hydrogen 3.433 N/A CYS 266.A SG ASP 286.A OD2 no hydrogen 3.092 N/A ILE 268.A N SER 240.A O no hydrogen 2.988 N/A THR 269.A N GLY 283.A O no hydrogen 2.883 N/A THR 269.A OG1 GLY 283.A O no hydrogen 3.308 N/A THR 269.A OG1 VAL 310.A O no hydrogen 2.484 N/A SER 272.A N LEU 281.A O no hydrogen 2.905 N/A SER 272.A OG VAL 271.A O no hydrogen 2.804 N/A LYS 275.A NZ ASP 317.A O no hydrogen 3.417 N/A GLY 277.A N SER 274.A O no hydrogen 3.321 N/A ARG 278.A NE ASP 293.A OD1 no hydrogen 2.726 N/A ARG 278.A NH2 ASP 293.A OD1 no hydrogen 3.462 N/A ARG 278.A NH2 ASP 293.A OD2 no hydrogen 3.263 N/A LEU 280.A N TRP 292.A O no hydrogen 3.518 N/A ALA 282.A N ASN 290.A O no hydrogen 2.928 N/A GLY 283.A N SER 270.A O no hydrogen 2.888 N/A TYR 284.A N ASN 288.A O no hydrogen 3.047 N/A CYS 289.A N LEU 303.A O no hydrogen 2.924 N/A CYS 289.A SG ALA 282.A O no hydrogen 3.135 N/A CYS 289.A SG ASN 290.A O no hydrogen 3.954 N/A ASN 290.A N ALA 282.A O no hydrogen 2.888 N/A VAL 291.A N GLY 301.A O no hydrogen 2.906 N/A TRP 292.A N LEU 280.A O no hydrogen 3.193 N/A TRP 292.A NE1 TYR 284.A OH no hydrogen 3.021 N/A ALA 294.A N ARG 278.A O no hydrogen 2.976 N/A ALA 297.A N ASP 293.A O no hydrogen 2.849 N/A ALA 300.A N VAL 291.A O no hydrogen 2.859 N/A LEU 303.A N CYS 289.A O no hydrogen 2.865 N/A HIS 306.A NE2 THR 324.A OG1 no hydrogen 2.860 N/A ARG 309.A N ASN 308.A OD1 no hydrogen 2.763 N/A SER 311.A N GLY 325.A O no hydrogen 2.900 N/A SER 311.A OG ILE 53.A O no hydrogen 2.331 N/A SER 311.A OG GLY 325.A O no hydrogen 3.071 N/A CYS 312.A N GLY 325.A O no hydrogen 2.926 N/A CYS 312.A SG GLY 325.A O no hydrogen 3.406 N/A GLY 314.A N ALA 323.A O no hydrogen 2.919 N/A THR 316.A N ALA 321.A O no hydrogen 3.356 N/A THR 316.A OG1 ASP 318.A OD1 no hydrogen 3.210 N/A THR 316.A OG1 ALA 321.A O no hydrogen 3.395 N/A GLY 319.A N THR 316.A O no hydrogen 3.141 N/A MET 320.A N THR 316.A OG1 no hydrogen 2.958 N/A MET 320.A N ASP 318.A OD1 no hydrogen 3.121 N/A ALA 321.A N THR 316.A OG1 no hydrogen 3.424 N/A VAL 322.A N TRP 334.A O no hydrogen 2.941 N/A ALA 323.A N GLY 314.A O no hydrogen 2.885 N/A THR 324.A N LYS 332.A O no hydrogen 2.913 N/A THR 324.A OG1 HIS 306.A NE2 no hydrogen 2.860 N/A GLY 325.A N CYS 312.A O no hydrogen 2.896 N/A SER 326.A OG HIS 306.A ND1 no hydrogen 2.612 N/A TRP 327.A N ARG 309.A O no hydrogen 2.882 N/A ASP 328.A N SER 326.A OG no hydrogen 3.300 N/A SER 329.A N SER 326.A O no hydrogen 3.466 N/A SER 329.A OG HIS 49.A O no hydrogen 3.447 N/A SER 329.A OG ASP 328.A O no hydrogen 2.381 N/A LEU 331.A N LEU 46.A O no hydrogen 3.144 N/A LYS 332.A N THR 324.A O no hydrogen 2.918 N/A LYS 332.A NZ GLY 305.A O no hydrogen 2.326 N/A ILE 333.A N ARG 44.A O no hydrogen 3.254 N/A TRP 334.A N VAL 322.A O no hydrogen 2.861 N/A TRP 334.A NE1 THR 324.A OG1 no hydrogen 2.999 N/A