Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8fye_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NE ASP 1.A O no hydrogen 3.120 N/A ARG 4.A NH2 ASP 1.A O no hydrogen 3.456 N/A GLN 5.A N GLN 2.A O no hydrogen 3.077 N/A ALA 7.A N LEU 3.A O no hydrogen 2.919 N/A GLU 8.A N ARG 4.A O no hydrogen 3.427 N/A LEU 10.A N GLU 6.A O no hydrogen 2.883 N/A LYS 11.A N ALA 7.A O no hydrogen 2.939 N/A ASN 12.A N GLU 8.A O no hydrogen 2.886 N/A GLN 13.A N GLN 9.A O no hydrogen 2.887 N/A ILE 14.A N LEU 10.A O no hydrogen 2.905 N/A ARG 15.A N LYS 11.A O no hydrogen 2.930 N/A ARG 15.A NH1 ASN 12.A OD1 no hydrogen 2.894 N/A ARG 15.A NH2 ASN 12.A OD1 no hydrogen 2.582 N/A ASP 16.A N ASN 12.A O no hydrogen 2.871 N/A ALA 17.A N GLN 13.A O no hydrogen 2.919 N/A ARG 18.A N ILE 14.A O no hydrogen 2.923 N/A ARG 18.A NE ASP 254.A OD2 no hydrogen 3.374 N/A ARG 18.A NH2 THR 217.A O no hydrogen 2.554 N/A ARG 18.A NH2 ASP 254.A OD2 no hydrogen 3.282 N/A LYS 19.A N ARG 15.A O no hydrogen 2.893 N/A ALA 20.A N ASP 16.A O no hydrogen 2.887 N/A CYS 21.A N ALA 17.A O no hydrogen 2.935 N/A CYS 21.A SG ALA 17.A O no hydrogen 3.574 N/A ALA 22.A N LYS 19.A O no hydrogen 3.086 N/A GLN 28.A N THR 25.A OG1 no hydrogen 3.320 N/A ILE 29.A N THR 25.A O no hydrogen 3.171 N/A THR 30.A N LEU 26.A O no hydrogen 3.065 N/A THR 30.A OG1 LEU 26.A O no hydrogen 2.891 N/A THR 30.A OG1 LEU 296.A O no hydrogen 2.386 N/A ASN 31.A N GLN 28.A O no hydrogen 3.409 N/A VAL 36.A N ASP 294.A OD2 no hydrogen 3.396 N/A ILE 39.A N ALA 301.A O no hydrogen 3.207 N/A ARG 44.A N ILE 334.A O no hydrogen 2.600 N/A ARG 44.A NE ARG 42.A O no hydrogen 3.165 N/A ARG 45.A NE SER 80.A O no hydrogen 3.371 N/A ARG 45.A NE TYR 81.A O no hydrogen 3.041 N/A ARG 45.A NH2 TYR 81.A O no hydrogen 2.611 N/A LEU 47.A N LEU 332.A O no hydrogen 2.863 N/A HIS 50.A NE2 SER 68.A OG no hydrogen 2.333 N/A LEU 51.A N ASP 72.A OD2 no hydrogen 2.925 N/A ILE 54.A N SER 327.A O no hydrogen 3.388 N/A TYR 55.A N ALA 69.A O no hydrogen 2.907 N/A ALA 56.A N ALA 69.A O no hydrogen 3.417 N/A HIS 58.A N VAL 67.A O no hydrogen 2.980 N/A TRP 59.A NE1 GLY 315.A O no hydrogen 2.839 N/A GLY 60.A N LEU 65.A O no hydrogen 2.808 N/A THR 61.A OG1 PRO 103.A O no hydrogen 2.668 N/A SER 63.A N GLY 60.A O no hydrogen 2.956 N/A SER 63.A OG THR 61.A O no hydrogen 3.502 N/A ARG 64.A N ASP 62.A OD1 no hydrogen 3.153 N/A ARG 64.A NE ASP 79.A OD1 no hydrogen 2.738 N/A ARG 64.A NH2 ASP 79.A OD1 no hydrogen 3.069 N/A ARG 64.A NH2 ASP 79.A OD2 no hydrogen 2.536 N/A LEU 65.A N ASP 62.A OD1 no hydrogen 3.122 N/A LEU 66.A N TRP 78.A O no hydrogen 2.922 N/A VAL 67.A N HIS 58.A O no hydrogen 3.053 N/A SER 68.A N ILE 76.A O no hydrogen 2.914 N/A SER 68.A OG HIS 50.A NE2 no hydrogen 2.333 N/A ALA 69.A N ALA 56.A O no hydrogen 2.912 N/A SER 70.A OG HIS 50.A ND1 no hydrogen 2.739 N/A SER 70.A OG ASP 72.A OD1 no hydrogen 2.373 N/A GLN 71.A N LYS 53.A O no hydrogen 3.060 N/A GLY 73.A N SER 70.A O no hydrogen 3.397 N/A LEU 75.A N ILE 89.A O no hydrogen 2.912 N/A ILE 76.A N SER 68.A O no hydrogen 2.928 N/A ILE 77.A N HIS 87.A O no hydrogen 2.872 N/A TRP 78.A N LEU 66.A O no hydrogen 2.852 N/A TRP 78.A NE1 SER 68.A OG no hydrogen 3.005 N/A ASP 79.A N ASN 84.A O no hydrogen 2.603 N/A SER 80.A N ARG 64.A O no hydrogen 2.818 N/A SER 80.A OG ARG 64.A O no hydrogen 2.468 N/A THR 82.A OG1 ASP 79.A OD2 no hydrogen 2.958 N/A ASN 84.A N ASP 79.A O no hydrogen 3.199 N/A LYS 85.A NZ ARG 48.A O no hydrogen 3.335 N/A VAL 86.A N ILE 77.A O no hydrogen 2.575 N/A HIS 87.A N ILE 77.A O no hydrogen 2.964 N/A ILE 89.A N LEU 75.A O no hydrogen 2.878 N/A LEU 91.A N GLY 73.A O no hydrogen 2.888 N/A SER 93.A OG ASP 114.A OD1 no hydrogen 3.111 N/A VAL 96.A N SER 94.A O no hydrogen 3.141 N/A MET 97.A N GLY 111.A O no hydrogen 2.891 N/A THR 98.A N GLY 111.A O no hydrogen 3.061 N/A CYS 99.A SG VAL 67.A O no hydrogen 4.016 N/A ALA 100.A N ALA 109.A O no hydrogen 3.109 N/A TYR 101.A N HIS 58.A ND1 no hydrogen 2.924 N/A ALA 102.A N TYR 107.A O no hydrogen 2.951 N/A SER 104.A OG ASP 150.A OD1 no hydrogen 2.632 N/A SER 104.A OG ASP 150.A OD2 no hydrogen 2.917 N/A GLY 105.A N ALA 102.A O no hydrogen 2.854 N/A ASN 106.A N SER 104.A OG no hydrogen 3.384 N/A ASN 106.A ND2 SER 104.A O no hydrogen 3.552 N/A VAL 108.A N TYR 120.A O no hydrogen 2.940 N/A ALA 109.A N ALA 100.A O no hydrogen 2.559 N/A CYS 110.A N SER 118.A O no hydrogen 2.919 N/A CYS 110.A SG THR 98.A O no hydrogen 3.585 N/A GLY 111.A N THR 98.A O no hydrogen 3.231 N/A LEU 113.A N TRP 95.A O no hydrogen 2.895 N/A CYS 117.A N LEU 135.A O no hydrogen 2.935 N/A CYS 117.A SG CYS 110.A O no hydrogen 3.739 N/A SER 118.A N CYS 110.A O no hydrogen 2.868 N/A ILE 119.A N ARG 133.A O no hydrogen 2.853 N/A TYR 120.A N VAL 108.A O no hydrogen 2.857 N/A ASN 121.A N ARG 130.A O no hydrogen 2.852 N/A ASN 121.A ND2 LYS 123.A O no hydrogen 3.424 N/A LEU 122.A N ASN 106.A O no hydrogen 2.708 N/A ARG 125.A N THR 124.A OG1 no hydrogen 2.732 N/A GLY 127.A N THR 124.A O no hydrogen 3.343 N/A ARG 130.A N ASN 121.A O no hydrogen 3.327 N/A SER 132.A N ILE 119.A O no hydrogen 2.676 N/A ARG 133.A N ILE 119.A O no hydrogen 2.952 N/A LEU 135.A N CYS 117.A O no hydrogen 2.854 N/A HIS 138.A NE2 THR 155.A OG1 no hydrogen 3.148 N/A THR 139.A N ASP 159.A OD2 no hydrogen 2.998 N/A THR 139.A OG1 ASP 159.A OD2 no hydrogen 2.945 N/A LEU 142.A N GLY 112.A O no hydrogen 2.823 N/A SER 143.A N SER 156.A O no hydrogen 2.912 N/A SER 143.A OG SER 156.A O no hydrogen 3.089 N/A SER 143.A OG SER 156.A OG no hydrogen 3.043 N/A SER 143.A OG VAL 183.A O no hydrogen 2.328 N/A CYS 144.A N SER 156.A O no hydrogen 3.285 N/A CYS 144.A SG LEU 186.A O no hydrogen 3.693 N/A CYS 145.A SG THR 98.A OG1 no hydrogen 3.610 N/A ARG 146.A N VAL 154.A O no hydrogen 2.781 N/A ARG 146.A NH1 CYS 99.A O no hydrogen 3.322 N/A ARG 146.A NH1 CYS 145.A O no hydrogen 2.601 N/A LEU 148.A N GLN 152.A O no hydrogen 2.955 N/A ASP 149.A N GLN 152.A O no hydrogen 3.238 N/A ILE 153.A N TRP 165.A O no hydrogen 2.975 N/A VAL 154.A N ARG 146.A O no hydrogen 2.854 N/A THR 155.A N ALA 163.A O no hydrogen 2.890 N/A THR 155.A OG1 HIS 138.A NE2 no hydrogen 3.148 N/A THR 155.A OG1 ALA 163.A O no hydrogen 3.471 N/A SER 156.A N CYS 144.A O no hydrogen 2.913 N/A SER 156.A OG SER 143.A OG no hydrogen 3.043 N/A SER 157.A N THR 161.A O no hydrogen 2.972 N/A SER 157.A OG HIS 138.A ND1 no hydrogen 2.752 N/A SER 157.A OG ASP 159.A OD1 no hydrogen 2.665 N/A SER 157.A OG THR 161.A O no hydrogen 3.515 N/A GLY 158.A N TYR 141.A O no hydrogen 2.664 N/A THR 160.A OG1 ASP 159.A O no hydrogen 2.466 N/A THR 161.A OG1 ASP 159.A O no hydrogen 3.560 N/A CYS 162.A N PHE 176.A O no hydrogen 2.945 N/A ALA 163.A N THR 155.A O no hydrogen 2.862 N/A LEU 164.A N THR 174.A O no hydrogen 2.849 N/A TRP 165.A N ILE 153.A O no hydrogen 2.853 N/A TRP 165.A NE1 THR 155.A OG1 no hydrogen 2.333 N/A ASP 166.A N GLN 171.A O no hydrogen 3.243 N/A ILE 167.A N ASN 151.A O no hydrogen 2.671 N/A THR 169.A N ASP 166.A OD2 no hydrogen 3.393 N/A THR 169.A OG1 ASP 166.A O no hydrogen 3.515 N/A THR 169.A OG1 ASP 166.A OD2 no hydrogen 3.175 N/A GLY 170.A N ASP 166.A O no hydrogen 2.652 N/A THR 174.A N LEU 164.A O no hydrogen 2.975 N/A THR 175.A OG1 CYS 162.A O no hydrogen 3.487 N/A PHE 176.A N CYS 162.A O no hydrogen 2.859 N/A HIS 179.A ND1 ASP 201.A OD2 no hydrogen 3.240 N/A HIS 179.A NE2 SER 197.A O no hydrogen 3.016 N/A HIS 179.A NE2 SER 197.A OG no hydrogen 3.000 N/A THR 180.A N ASP 201.A OD2 no hydrogen 2.822 N/A THR 180.A OG1 ASP 201.A OD2 no hydrogen 3.344 N/A MET 184.A N GLY 198.A O no hydrogen 2.899 N/A SER 185.A N GLY 198.A O no hydrogen 3.201 N/A SER 185.A OG GLY 198.A O no hydrogen 3.459 N/A SER 187.A N VAL 196.A O no hydrogen 3.086 N/A ALA 189.A N LEU 194.A O no hydrogen 2.981 N/A THR 192.A N ALA 189.A O no hydrogen 2.877 N/A THR 192.A OG1 ASP 191.A O no hydrogen 2.484 N/A ARG 193.A N ASP 191.A OD1 no hydrogen 3.009 N/A PHE 195.A N TRP 207.A O no hydrogen 2.952 N/A VAL 196.A N SER 187.A O no hydrogen 3.069 N/A SER 197.A N LYS 205.A O no hydrogen 2.907 N/A SER 197.A OG HIS 179.A NE2 no hydrogen 3.000 N/A SER 197.A OG LYS 205.A O no hydrogen 3.561 N/A GLY 198.A N SER 185.A OG no hydrogen 3.116 N/A ALA 199.A N SER 203.A O no hydrogen 3.301 N/A CYS 200.A SG ASP 182.A O no hydrogen 3.353 N/A SER 203.A N ASP 201.A OD1 no hydrogen 3.207 N/A SER 203.A OG ASP 201.A OD1 no hydrogen 2.598 N/A ALA 204.A N PHE 218.A O no hydrogen 2.917 N/A LYS 205.A N SER 197.A O no hydrogen 2.908 N/A LEU 206.A N GLN 216.A O no hydrogen 2.894 N/A TRP 207.A N PHE 195.A O no hydrogen 2.844 N/A TRP 207.A NE1 SER 197.A OG no hydrogen 2.375 N/A ASP 208.A N MET 213.A O no hydrogen 3.398 N/A VAL 209.A N ARG 193.A O no hydrogen 3.477 N/A ARG 210.A NH1 GLN 152.A OE1 no hydrogen 3.497 N/A GLY 212.A N ASP 208.A O no hydrogen 2.880 N/A CYS 214.A SG GLN 216.A O no hydrogen 3.655 N/A ARG 215.A N LEU 206.A O no hydrogen 2.649 N/A GLN 216.A NE2 LEU 251.A O no hydrogen 2.866 N/A PHE 218.A N ALA 204.A O no hydrogen 2.877 N/A HIS 221.A NE2 THR 239.A OG1 no hydrogen 2.406 N/A SER 223.A OG ASP 224.A OD1 no hydrogen 2.458 N/A ILE 225.A N ALA 199.A O no hydrogen 3.060 N/A ASN 226.A N GLY 240.A O no hydrogen 2.873 N/A ASN 226.A ND2 ASP 242.A OD1 no hydrogen 2.370 N/A ASN 226.A ND2 ILE 269.A O no hydrogen 3.178 N/A ALA 227.A N GLY 240.A O no hydrogen 3.188 N/A CYS 229.A N ALA 238.A O no hydrogen 3.048 N/A CYS 229.A SG PHE 230.A O no hydrogen 3.609 N/A PHE 230.A N SER 187.A OG no hydrogen 2.964 N/A PHE 231.A N ALA 236.A O no hydrogen 2.593 N/A GLY 234.A N PHE 231.A O no hydrogen 2.717 N/A PHE 237.A N PHE 249.A O no hydrogen 2.928 N/A ALA 238.A N CYS 229.A O no hydrogen 2.885 N/A THR 239.A N ARG 247.A O no hydrogen 2.878 N/A THR 239.A OG1 HIS 221.A NE2 no hydrogen 2.406 N/A THR 239.A OG1 ARG 247.A O no hydrogen 3.352 N/A GLY 240.A N ALA 227.A O no hydrogen 2.986 N/A SER 241.A N THR 245.A O no hydrogen 3.464 N/A SER 241.A OG HIS 221.A ND1 no hydrogen 2.983 N/A ASP 242.A N ASP 224.A O no hydrogen 3.013 N/A ASP 243.A N SER 241.A OG no hydrogen 3.021 N/A THR 245.A OG1 CYS 246.A O no hydrogen 3.392 N/A THR 245.A OG1 TYR 260.A O no hydrogen 3.234 N/A CYS 246.A N TYR 260.A O no hydrogen 2.917 N/A ARG 247.A N THR 239.A O no hydrogen 2.899 N/A ARG 247.A NE HIS 221.A ND1 no hydrogen 3.498 N/A ARG 247.A NH1 GLU 256.A OE1 no hydrogen 3.203 N/A ARG 247.A NH1 GLU 256.A OE2 no hydrogen 2.691 N/A LEU 248.A N MET 258.A O no hydrogen 2.854 N/A PHE 249.A N PHE 237.A O no hydrogen 2.877 N/A ASP 250.A N GLN 255.A O no hydrogen 3.002 N/A LEU 251.A N ASN 235.A O no hydrogen 2.818 N/A ARG 252.A N ASP 250.A OD2 no hydrogen 2.982 N/A ALA 253.A N ASP 250.A OD2 no hydrogen 3.070 N/A GLN 255.A NE2 ARG 18.A O no hydrogen 3.079 N/A GLN 255.A NE2 ALA 253.A O no hydrogen 3.529 N/A LEU 257.A N LEU 248.A O no hydrogen 2.642 N/A MET 258.A N LEU 248.A O no hydrogen 3.012 N/A THR 259.A OG1 GLU 256.A OE2 no hydrogen 2.797 N/A TYR 260.A N CYS 246.A O no hydrogen 2.849 N/A TYR 260.A OH ALA 295.A O no hydrogen 2.344 N/A ASN 264.A N HIS 262.A ND1 no hydrogen 3.255 N/A ILE 269.A N SER 241.A O no hydrogen 2.863 N/A THR 270.A N GLY 284.A O no hydrogen 2.892 N/A SER 273.A N LEU 282.A O no hydrogen 2.930 N/A SER 275.A N LEU 280.A O no hydrogen 2.998 N/A LYS 276.A NZ ASP 318.A O no hydrogen 3.026 N/A GLY 278.A N SER 275.A O no hydrogen 3.134 N/A ARG 279.A NH2 ASP 34.A O no hydrogen 3.280 N/A LEU 280.A N SER 275.A OG no hydrogen 3.241 N/A LEU 281.A N TRP 293.A O no hydrogen 2.900 N/A LEU 282.A N SER 273.A O no hydrogen 2.802 N/A ALA 283.A N ASN 291.A O no hydrogen 2.929 N/A GLY 284.A N SER 271.A O no hydrogen 2.884 N/A TYR 285.A N ASN 289.A O no hydrogen 2.920 N/A ASP 286.A N GLY 268.A O no hydrogen 3.269 N/A ASN 291.A N ALA 283.A O no hydrogen 2.881 N/A VAL 292.A N GLY 302.A O no hydrogen 2.874 N/A TRP 293.A N LEU 281.A O no hydrogen 2.860 N/A ASP 294.A N ASP 299.A O no hydrogen 2.753 N/A ALA 295.A N ARG 279.A O no hydrogen 2.681 N/A LYS 297.A N ASP 294.A O no hydrogen 2.927 N/A LYS 297.A NZ THR 30.A O no hydrogen 2.975 N/A LYS 297.A NZ ASN 31.A O no hydrogen 3.506 N/A LYS 297.A NZ ILE 33.A O no hydrogen 3.108 N/A ALA 298.A N ASP 294.A O no hydrogen 2.759 N/A ALA 301.A N VAL 292.A O no hydrogen 2.554 N/A GLY 302.A N VAL 292.A O no hydrogen 2.976 N/A LEU 304.A N CYS 290.A O no hydrogen 2.850 N/A HIS 307.A NE2 THR 325.A O no hydrogen 2.853 N/A HIS 307.A NE2 THR 325.A OG1 no hydrogen 2.650 N/A ASP 308.A N ASP 329.A OD2 no hydrogen 2.724 N/A SER 312.A N GLY 326.A O no hydrogen 2.996 N/A SER 312.A OG ILE 54.A O no hydrogen 2.236 N/A SER 312.A OG GLY 326.A O no hydrogen 3.210 N/A CYS 313.A N GLY 326.A O no hydrogen 2.917 N/A CYS 313.A SG GLY 326.A O no hydrogen 3.268 N/A GLY 315.A N ALA 324.A O no hydrogen 2.913 N/A THR 317.A N ALA 322.A O no hydrogen 3.122 N/A THR 317.A OG1 ASP 319.A OD1 no hydrogen 2.524 N/A THR 317.A OG1 ALA 322.A O no hydrogen 3.376 N/A GLY 320.A N THR 317.A O no hydrogen 2.986 N/A MET 321.A N ASP 319.A OD1 no hydrogen 3.130 N/A ALA 324.A N GLY 315.A O no hydrogen 2.878 N/A THR 325.A N LYS 333.A O no hydrogen 2.907 N/A THR 325.A OG1 HIS 307.A NE2 no hydrogen 2.650 N/A GLY 326.A N CYS 313.A O no hydrogen 2.891 N/A SER 327.A N PHE 331.A O no hydrogen 3.459 N/A SER 327.A OG HIS 307.A ND1 no hydrogen 2.920 N/A TRP 328.A N ARG 310.A O no hydrogen 2.880 N/A SER 330.A N SER 327.A O no hydrogen 3.404 N/A SER 330.A OG ASP 329.A O no hydrogen 2.366 N/A PHE 331.A N ASP 329.A OD1 no hydrogen 3.239 N/A LEU 332.A N LEU 47.A O no hydrogen 2.967 N/A LYS 333.A N THR 325.A O no hydrogen 2.901 N/A LYS 333.A NZ GLY 306.A O no hydrogen 2.623 N/A ILE 334.A N ARG 45.A O no hydrogen 2.881 N/A TRP 335.A N VAL 323.A O no hydrogen 2.879 N/A TRP 335.A NE1 THR 325.A OG1 no hydrogen 2.651 N/A