Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5f4u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N THR 2.A OG1 no hydrogen 2.456 N/A LEU 4.A N GLN 55.A OE1 no hydrogen 3.067 N/A PHE 5.A N CYS 97.A O no hydrogen 2.833 N/A CYS 6.A SG ALA 25.A O no hydrogen 3.522 N/A ALA 7.A N HIS 95.A O no hydrogen 2.746 N/A SER 8.A N VAL 27.A O no hydrogen 2.824 N/A LYS 11.A NZ TYR 13.A OH no hydrogen 2.773 N/A GLU 16.A N GLU 14.A OE2 no hydrogen 3.211 N/A VAL 17.A N SER 88.A O no hydrogen 3.109 N/A HIS 18.A N GLU 16.A OE2 no hydrogen 3.277 N/A ASN 19.A N GLU 16.A O no hydrogen 3.091 N/A ASN 19.A N GLU 16.A OE1 no hydrogen 3.082 N/A ASN 19.A ND2 GLU 16.A OE1 no hydrogen 2.692 N/A VAL 20.A N GLU 16.A O no hydrogen 3.185 N/A TRP 21.A N VAL 17.A O no hydrogen 2.823 N/A ALA 22.A N HIS 18.A O no hydrogen 2.835 N/A THR 23.A N ASN 19.A O no hydrogen 2.844 N/A THR 23.A OG1 ASN 19.A O no hydrogen 2.676 N/A THR 23.A OG1 VAL 20.A O no hydrogen 3.445 N/A ALA 25.A N TRP 21.A O no hydrogen 2.770 N/A CYS 26.A SG ALA 25.A O no hydrogen 3.121 N/A THR 29.A N SER 8.A O no hydrogen 2.886 N/A ASP 30.A N THR 29.A OG1 no hydrogen 2.607 N/A ASN 32.A ND2 ASP 30.A OD1 no hydrogen 3.358 N/A GLN 34.A N ASN 32.A O no hydrogen 2.570 N/A MET 36.A N THR 123.A O no hydrogen 2.937 N/A GLU 43.A N CYS 118.A O no hydrogen 3.083 N/A PHE 45.A N GLY 116.A O no hydrogen 3.186 N/A MET 47.A N GLY 114.A O no hydrogen 3.054 N/A TRP 48.A N ASN 46.A OD1 no hydrogen 3.451 N/A ASN 50.A ND2 TYR 331.A O no hydrogen 3.282 N/A MET 52.A N ASN 50.A OD1 no hydrogen 3.135 N/A VAL 53.A N ASN 50.A O no hydrogen 3.092 N/A GLU 54.A N GLU 54.A OE1 no hydrogen 2.426 N/A GLN 55.A N ASP 51.A O no hydrogen 3.002 N/A MET 56.A N MET 52.A O no hydrogen 2.869 N/A HIS 57.A N VAL 53.A O no hydrogen 2.739 N/A GLU 58.A N GLU 54.A O no hydrogen 2.899 N/A ASP 59.A N MET 56.A O no hydrogen 2.916 N/A ILE 60.A N MET 56.A O no hydrogen 2.781 N/A ILE 61.A N HIS 57.A O no hydrogen 2.863 N/A SER 62.A OG ASP 59.A O no hydrogen 2.501 N/A LEU 63.A N ASP 59.A O no hydrogen 2.847 N/A TRP 64.A N ILE 60.A O no hydrogen 2.840 N/A ASP 65.A N ILE 61.A O no hydrogen 2.800 N/A GLU 66.A N SER 62.A O no hydrogen 2.815 N/A SER 67.A N LEU 63.A O no hydrogen 2.822 N/A SER 67.A OG LEU 63.A O no hydrogen 2.832 N/A LYS 69.A NZ GLU 66.A O no hydrogen 2.728 N/A VAL 72.A N ILE 285.A O no hydrogen 2.893 N/A LYS 73.A N ILE 80.A O no hydrogen 3.083 N/A LEU 74.A N ARG 283.A O no hydrogen 2.807 N/A THR 75.A N SER 78.A O no hydrogen 3.145 N/A SER 78.A N THR 75.A O no hydrogen 3.249 N/A SER 78.A OG THR 75.A O no hydrogen 2.858 N/A SER 78.A OG GLY 76.A O no hydrogen 2.842 N/A GLN 82.A N CYS 71.A O no hydrogen 3.123 N/A CYS 84.A SG LYS 69.A O no hydrogen 3.716 N/A CYS 84.A SG ILE 285.A O no hydrogen 3.923 N/A LYS 86.A NZ GLU 235.A OE1 no hydrogen 3.095 N/A LYS 86.A NZ GLU 235.A OE2 no hydrogen 2.573 N/A LYS 86.A NZ ALA 287.A O no hydrogen 3.514 N/A ASP 90.A N GLU 16.A OE2 no hydrogen 2.720 N/A LEU 94.A N ILE 130.A O no hydrogen 2.749 N/A HIS 95.A N ALA 7.A O no hydrogen 2.834 N/A HIS 95.A ND1 THR 127.A O no hydrogen 2.718 N/A TYR 96.A N THR 127.A OG1 no hydrogen 3.187 N/A CYS 97.A N PHE 5.A O no hydrogen 2.747 N/A CYS 97.A SG PHE 5.A O no hydrogen 3.348 N/A CYS 97.A SG HIS 95.A O no hydrogen 3.612 N/A ALA 98.A N GLN 125.A O no hydrogen 3.307 N/A ILE 104.A N VAL 124.A O no hydrogen 2.848 N/A LEU 105.A N LYS 332.A O no hydrogen 2.772 N/A LYS 106.A N SER 122.A O no hydrogen 2.782 N/A LYS 106.A NZ CYS 107.A O no hydrogen 3.554 N/A LYS 106.A NZ ASN 108.A OD1 no hydrogen 2.525 N/A CYS 107.A N LYS 330.A O no hydrogen 3.288 N/A CYS 107.A SG ASN 120.A O no hydrogen 3.971 N/A ASN 108.A N ASN 120.A O no hydrogen 2.865 N/A ASN 108.A ND2 ASN 120.A OD1 no hydrogen 3.123 N/A LYS 110.A NZ GLU 147.A OE1 no hydrogen 3.126 N/A THR 111.A OG1 THR 111.A O no hydrogen 2.582 N/A THR 115.A N ASN 113.A OD1 no hydrogen 2.659 N/A THR 115.A OG1 ASN 113.A OD1 no hydrogen 3.171 N/A GLY 116.A N PHE 45.A O no hydrogen 2.753 N/A CYS 118.A SG ASN 120.A O no hydrogen 3.860 N/A ASN 120.A ND2 ASN 109.A OD1 no hydrogen 2.892 N/A VAL 121.A N LEU 38.A O no hydrogen 3.319 N/A SER 122.A N LYS 106.A O no hydrogen 2.715 N/A THR 123.A N MET 36.A O no hydrogen 3.068 N/A VAL 124.A N ILE 104.A O no hydrogen 2.795 N/A CYS 126.A SG GLN 125.A OE1 no hydrogen 3.037 N/A THR 127.A OG1 TYR 96.A O no hydrogen 3.437 N/A HIS 128.A N TYR 331.A OH no hydrogen 3.265 N/A HIS 128.A ND1 TYR 331.A OH no hydrogen 3.121 N/A HIS 128.A NE2 GLU 327.A OE1 no hydrogen 3.015 N/A ILE 130.A N LEU 94.A O no hydrogen 3.130 N/A SER 135.A OG LEU 138.A O no hydrogen 2.838 N/A THR 136.A N SER 229.A O no hydrogen 3.246 N/A THR 136.A OG1 GLU 224.A O no hydrogen 2.703 N/A THR 136.A OG1 THR 227.A O no hydrogen 3.003 N/A THR 136.A OG1 SER 229.A OG no hydrogen 2.766 N/A GLN 137.A N GLY 316.A O no hydrogen 2.883 N/A GLN 137.A NE2 ILE 225.A O no hydrogen 2.977 N/A LEU 138.A N THR 136.A O no hydrogen 2.408 N/A LEU 139.A N GLY 302.A O no hydrogen 3.128 N/A ASN 141.A N ASN 299.A O no hydrogen 3.026 N/A GLY 142.A N THR 301.A OG1 no hydrogen 3.280 N/A SER 143.A N GLU 327.A OE2 no hydrogen 2.496 N/A SER 143.A OG GLU 327.A OE2 no hydrogen 3.424 N/A ALA 145.A N LEU 167.A O no hydrogen 2.975 N/A ILE 150.A N HIS 166.A O no hydrogen 2.893 N/A ARG 152.A N ILE 164.A O no hydrogen 2.735 N/A ARG 152.A NH2 HIS 166.A ND1 no hydrogen 3.135 N/A SER 153.A OG THR 162.A O no hydrogen 3.496 N/A ASN 155.A N SER 153.A OG no hydrogen 3.194 N/A THR 157.A N ASN 155.A OD1 no hydrogen 3.030 N/A THR 157.A OG1 ASN 155.A OD1 no hydrogen 2.679 N/A ASN 158.A N ASN 155.A O no hydrogen 3.161 N/A ALA 160.A N ASN 158.A OD1 no hydrogen 2.928 N/A LYS 161.A N ASN 158.A O no hydrogen 3.417 N/A LYS 161.A NZ GLU 154.A OE1 no hydrogen 2.532 N/A ILE 163.A N LEU 305.A O no hydrogen 2.848 N/A ILE 164.A N ARG 152.A O no hydrogen 2.671 N/A VAL 165.A N LEU 303.A O no hydrogen 2.826 N/A HIS 166.A N ILE 150.A O no hydrogen 2.820 N/A VAL 171.A N ILE 300.A O no hydrogen 2.826 N/A ILE 173.A N SER 298.A O no hydrogen 2.879 N/A VAL 174.A N ASN 187.A O no hydrogen 2.952 N/A CYS 175.A N CYS 296.A O no hydrogen 2.847 N/A THR 176.A N HIS 185.A O no hydrogen 2.794 N/A ARG 177.A N ILE 294.A O no hydrogen 2.776 N/A ARG 177.A NE ARG 177.A O no hydrogen 3.622 N/A ARG 177.A NH1 ILE 181.A O no hydrogen 3.302 N/A ARG 177.A NH2 GLY 292.A O no hydrogen 2.402 N/A ALA 184.A N CYS 269.A O no hydrogen 2.820 N/A HIS 185.A N THR 176.A O no hydrogen 2.837 N/A CYS 186.A N LEU 267.A O no hydrogen 2.817 N/A ASN 187.A N VAL 174.A O no hydrogen 2.747 N/A ILE 188.A N ILE 265.A O no hydrogen 2.849 N/A GLU 190.A N GLY 263.A O no hydrogen 3.108 N/A SER 191.A OG ASN 189.A OD1 no hydrogen 2.929 N/A LYS 192.A N ASN 189.A OD1 no hydrogen 3.108 N/A TRP 193.A NE1 LEU 244.A O no hydrogen 2.804 N/A ASN 194.A N GLU 190.A O no hydrogen 2.858 N/A ASN 194.A ND2 TYR 254.A O no hydrogen 3.667 N/A ASN 195.A N SER 191.A O no hydrogen 2.841 N/A THR 196.A N LYS 192.A O no hydrogen 2.804 N/A THR 196.A OG1 LYS 192.A O no hydrogen 2.592 N/A LEU 197.A N TRP 193.A O no hydrogen 2.838 N/A GLN 198.A N ASN 194.A O no hydrogen 2.791 N/A GLN 198.A NE2 GLU 202.A OE2 no hydrogen 3.383 N/A LYS 199.A N ASN 195.A O no hydrogen 2.942 N/A LYS 199.A NZ GLU 169.A OE1 no hydrogen 3.404 N/A VAL 200.A N THR 196.A O no hydrogen 2.866 N/A GLY 201.A N LEU 197.A O no hydrogen 2.806 N/A GLU 202.A N GLN 198.A O no hydrogen 2.824 N/A GLU 203.A N LYS 199.A O no hydrogen 2.924 N/A LEU 204.A N VAL 200.A O no hydrogen 2.784 N/A ALA 205.A N GLY 201.A O no hydrogen 2.824 N/A LYS 206.A N GLU 202.A O no hydrogen 3.283 N/A LYS 206.A N GLU 203.A O no hydrogen 3.240 N/A HIS 207.A N LEU 204.A O no hydrogen 2.994 N/A HIS 207.A ND1 GLU 203.A O no hydrogen 3.140 N/A PHE 208.A N ALA 205.A O no hydrogen 3.288 N/A LYS 211.A NZ ASP 309.A OD1 no hydrogen 3.043 N/A THR 212.A N ASP 309.A O no hydrogen 3.411 N/A ILE 213.A N TYR 249.A O no hydrogen 2.980 N/A LYS 214.A N GLU 311.A O no hydrogen 2.866 N/A LYS 214.A NZ THR 248.A OG1 no hydrogen 2.667 N/A PHE 215.A N GLY 247.A O no hydrogen 2.850 N/A GLU 216.A N PHE 313.A O no hydrogen 3.064 N/A ILE 225.A N ASP 222.A O no hydrogen 3.012 N/A THR 226.A N ASP 222.A O no hydrogen 3.012 N/A THR 226.A OG1 ASP 222.A O no hydrogen 3.134 N/A THR 227.A OG1 LEU 223.A O no hydrogen 2.418 N/A HIS 228.A N CYS 239.A O no hydrogen 2.803 N/A SER 229.A N THR 136.A OG1 no hydrogen 3.070 N/A SER 229.A OG THR 136.A OG1 no hydrogen 2.766 N/A SER 229.A OG GLU 224.A O no hydrogen 2.506 N/A PHE 230.A N PHE 237.A O no hydrogen 2.850 N/A ASN 231.A ND2 GLY 234.A O no hydrogen 3.614 N/A CYS 232.A N GLU 235.A O no hydrogen 2.787 N/A GLU 235.A N CYS 232.A O no hydrogen 2.798 N/A PHE 237.A N PHE 230.A O no hydrogen 2.767 N/A TYR 238.A N LYS 270.A O no hydrogen 2.874 N/A TYR 238.A OH GLU 224.A OE2 no hydrogen 2.416 N/A CYS 239.A N HIS 228.A O no hydrogen 2.845 N/A ASN 240.A N GLN 268.A O no hydrogen 2.859 N/A THR 241.A OG1 GLN 137.A OE1 no hydrogen 2.818 N/A SER 242.A N ASN 240.A OD1 no hydrogen 3.213 N/A SER 242.A OG ASN 240.A OD1 no hydrogen 3.001 N/A SER 242.A OG ASP 243.A OD2 no hydrogen 3.296 N/A PHE 245.A N THR 241.A O no hydrogen 3.283 N/A GLY 247.A N PHE 215.A O no hydrogen 2.846 N/A THR 248.A N ASN 255.A O no hydrogen 2.893 N/A TYR 249.A N ILE 213.A O no hydrogen 2.778 N/A ARG 250.A N THR 253.A O no hydrogen 2.842 N/A THR 253.A N ARG 250.A O no hydrogen 2.745 N/A THR 253.A OG1 GLN 198.A OE1 no hydrogen 3.400 N/A THR 253.A OG1 TYR 254.A O no hydrogen 3.541 N/A TYR 254.A N GLN 198.A OE1 no hydrogen 2.713 N/A TYR 254.A OH HIS 256.A ND1 no hydrogen 2.973 N/A ASN 255.A N THR 248.A O no hydrogen 2.829 N/A HIS 256.A ND1 TYR 254.A OH no hydrogen 2.973 N/A THR 257.A OG1 ASN 246.A OD1 no hydrogen 2.133 N/A ILE 265.A N ILE 188.A O no hydrogen 2.785 N/A LEU 267.A N CYS 186.A O no hydrogen 2.784 N/A CYS 269.A N ALA 184.A O no hydrogen 2.834 N/A CYS 269.A SG LEU 267.A O no hydrogen 3.828 N/A LYS 270.A N TYR 238.A O no hydrogen 2.821 N/A ILE 271.A N ARG 182.A O no hydrogen 3.138 N/A LYS 272.A N PHE 236.A O no hydrogen 3.182 N/A ILE 275.A N ALA 284.A O no hydrogen 2.826 N/A ASN 276.A N GLU 224.A OE2 no hydrogen 3.378 N/A ASN 276.A ND2 GLU 224.A OE1 no hydrogen 2.843 N/A MET 277.A N GLY 282.A O no hydrogen 3.249 N/A GLN 279.A N GLN 279.A OE1 no hydrogen 2.457 N/A ARG 283.A N LEU 74.A O no hydrogen 2.844 N/A ALA 284.A N ILE 275.A O no hydrogen 2.772 N/A ILE 285.A N VAL 72.A O no hydrogen 2.785 N/A TYR 286.A N GLN 273.A O no hydrogen 3.079 N/A ILE 290.A N GLU 235.A OE2 no hydrogen 3.223 N/A ILE 294.A N ARG 177.A O no hydrogen 2.905 N/A THR 295.A OG1 CYS 175.A O no hydrogen 3.260 N/A CYS 296.A N CYS 175.A O no hydrogen 2.821 N/A CYS 296.A SG THR 295.A O no hydrogen 3.737 N/A SER 298.A N ILE 173.A O no hydrogen 2.866 N/A ILE 300.A N VAL 171.A O no hydrogen 2.788 N/A THR 301.A N LEU 139.A O no hydrogen 2.870 N/A THR 301.A OG1 LEU 139.A O no hydrogen 3.321 N/A LEU 303.A N VAL 165.A O no hydrogen 2.855 N/A LEU 304.A N GLN 137.A O no hydrogen 2.927 N/A LEU 305.A N ILE 163.A O no hydrogen 2.825 N/A LEU 306.A N ARG 314.A O no hydrogen 2.652 N/A ARG 307.A NE LEU 156.A O no hydrogen 3.372 N/A ARG 307.A NH1 GLU 311.A OE2 no hydrogen 2.892 N/A ARG 307.A NH2 LEU 156.A O no hydrogen 3.025 N/A ASP 308.A N THR 312.A O no hydrogen 3.152 N/A GLU 311.A N THR 212.A O no hydrogen 2.861 N/A PHE 313.A N LYS 214.A O no hydrogen 2.825 N/A ARG 314.A N LEU 306.A O no hydrogen 2.833 N/A ARG 314.A NE ASP 308.A OD1 no hydrogen 3.242 N/A ARG 314.A NE ASP 308.A OD2 no hydrogen 2.839 N/A ARG 314.A NH1 GLU 216.A OE2 no hydrogen 2.894 N/A ARG 314.A NH1 PRO 217.A O no hydrogen 2.582 N/A ARG 314.A NH2 GLU 216.A OE2 no hydrogen 2.774 N/A ARG 314.A NH2 ASP 308.A OD2 no hydrogen 3.253 N/A GLY 316.A N LEU 304.A O no hydrogen 2.579 N/A ASP 319.A N GLY 317.A O no hydrogen 2.722 N/A ARG 321.A N ASP 319.A OD1 no hydrogen 3.078 N/A ARG 321.A NE ASP 319.A OD1 no hydrogen 3.399 N/A ARG 321.A NE ASP 319.A OD2 no hydrogen 3.439 N/A ARG 321.A NH2 ASP 319.A OD2 no hydrogen 3.439 N/A ASN 323.A ND2 SER 135.A O no hydrogen 2.602 N/A TRP 324.A N MET 320.A O no hydrogen 2.872 N/A ARG 325.A N ARG 321.A O no hydrogen 2.761 N/A ARG 325.A NE MET 47.A O no hydrogen 3.320 N/A ARG 325.A NH1 ASP 322.A OD1 no hydrogen 3.509 N/A ARG 325.A NH2 TRP 48.A O no hydrogen 3.146 N/A SER 326.A N ASP 322.A O no hydrogen 2.753 N/A SER 326.A OG ASN 323.A O no hydrogen 2.458 N/A GLU 327.A N TRP 324.A O no hydrogen 3.260 N/A LEU 328.A N TRP 324.A O no hydrogen 2.885 N/A LYS 330.A NZ TYR 331.A OH no hydrogen 2.920 N/A TYR 331.A OH HIS 128.A ND1 no hydrogen 3.121 N/A LYS 332.A N LEU 105.A O no hydrogen 2.764 N/A LYS 332.A NZ ASN 44.A O no hydrogen 2.513 N/A VAL 334.A N ALA 103.A O no hydrogen 3.261 N/A