Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1g4r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N VAL 347.A O no hydrogen 2.748 N/A PHE 3.A N LEU 16.A O no hydrogen 2.878 N/A LYS 4.A N GLU 349.A O no hydrogen 3.158 N/A LYS 5.A N VAL 14.A O no hydrogen 2.887 N/A LYS 5.A NZ ARG 159.A O no hydrogen 2.965 N/A SER 7.A N LEU 12.A O no hydrogen 2.993 N/A SER 7.A OG ASN 9.A O no hydrogen 2.745 N/A SER 7.A OG LEU 12.A O no hydrogen 3.254 N/A ASN 9.A ND2 ASN 156.A OD1 no hydrogen 3.371 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 3.289 N/A THR 13.A OG1 TYR 15.A OH no hydrogen 3.177 N/A VAL 14.A N LYS 5.A O no hydrogen 2.693 N/A TYR 15.A N VAL 34.A O no hydrogen 2.841 N/A TYR 15.A OH THR 13.A OG1 no hydrogen 3.177 N/A LEU 16.A N PHE 3.A O no hydrogen 2.739 N/A LYS 18.A NZ GLU 29.A OE1 no hydrogen 3.228 N/A ARG 19.A NE PHE 351.A O no hydrogen 2.603 N/A ARG 19.A NH2 ASP 350.A O no hydrogen 3.421 N/A ARG 19.A NH2 PHE 351.A O no hydrogen 3.264 N/A PHE 21.A N ARG 163.A O no hydrogen 2.826 N/A VAL 22.A N GLU 29.A OE1 no hydrogen 2.754 N/A ASP 23.A N VAL 165.A O no hydrogen 2.693 N/A HIS 24.A N LEU 27.A O no hydrogen 2.751 N/A ILE 25.A N ASP 23.A OD1 no hydrogen 2.607 N/A GLU 29.A N VAL 22.A O no hydrogen 2.788 N/A VAL 31.A N PHE 111.A O no hydrogen 3.019 N/A GLY 33.A N PHE 109.A O no hydrogen 2.846 N/A VAL 34.A N TYR 15.A O no hydrogen 3.161 N/A VAL 35.A N TYR 107.A O no hydrogen 2.732 N/A LEU 36.A N THR 13.A O no hydrogen 2.910 N/A VAL 37.A N HIS 105.A O no hydrogen 2.809 N/A TYR 41.A OH ASN 156.A OD1 no hydrogen 2.611 N/A LEU 42.A N ASP 38.A O no hydrogen 3.106 N/A LYS 43.A N PRO 39.A O no hydrogen 2.787 N/A ARG 45.A N GLU 44.A OE1 no hydrogen 3.475 N/A ARG 45.A NH1 TYR 41.A O no hydrogen 3.319 N/A ARG 45.A NH2 TYR 41.A O no hydrogen 2.739 N/A ARG 46.A N ALA 145.A O no hydrogen 2.840 N/A ARG 46.A NE GLU 146.A O no hydrogen 2.927 N/A ARG 46.A NH2 TYR 48.A OH no hydrogen 2.770 N/A VAL 47.A N PHE 81.A O no hydrogen 2.612 N/A TYR 48.A N PHE 143.A O no hydrogen 2.562 N/A TYR 48.A OH GLN 79.A OE1 no hydrogen 3.329 N/A TYR 48.A OH GLU 146.A O no hydrogen 3.391 N/A VAL 49.A N VAL 78.A O no hydrogen 2.815 N/A THR 50.A N LYS 141.A O no hydrogen 2.723 N/A LEU 51.A N ALA 76.A O no hydrogen 2.700 N/A THR 52.A N GLU 139.A O no hydrogen 2.728 N/A CYS 53.A N PHE 74.A O no hydrogen 2.694 N/A ALA 54.A N ASP 137.A O no hydrogen 3.077 N/A PHE 55.A N LYS 71.A O no hydrogen 2.835 N/A ARG 56.A N GLY 135.A O no hydrogen 2.882 N/A ARG 56.A NE ARG 59.A O no hydrogen 3.003 N/A ARG 56.A NH1 ASP 137.A OD2 no hydrogen 2.882 N/A ARG 56.A NH2 ARG 59.A O no hydrogen 3.299 N/A TYR 57.A N PHE 69.A O no hydrogen 2.768 N/A GLY 58.A N ALA 133.A O no hydrogen 2.685 N/A ARG 59.A NE LEU 65.A O no hydrogen 2.817 N/A LEU 67.A N VAL 64.A O no hydrogen 2.837 N/A THR 68.A N TYR 57.A O no hydrogen 2.943 N/A THR 68.A OG1 TYR 57.A O no hydrogen 3.411 N/A PHE 69.A N TYR 57.A O no hydrogen 3.253 N/A ARG 70.A NE ASP 72.A OD1 no hydrogen 2.985 N/A ARG 70.A NH2 ASP 72.A OD1 no hydrogen 2.929 N/A LYS 71.A N PHE 55.A O no hydrogen 2.776 N/A LEU 73.A N CYS 53.A O no hydrogen 2.840 N/A PHE 74.A N CYS 53.A O no hydrogen 3.105 N/A ALA 76.A N LEU 51.A O no hydrogen 2.867 N/A VAL 78.A N VAL 49.A O no hydrogen 2.996 N/A GLN 79.A NE2 PRO 82.A O no hydrogen 2.778 N/A SER 80.A N VAL 47.A O no hydrogen 2.757 N/A SER 80.A OG VAL 47.A O no hydrogen 2.705 N/A PHE 81.A N VAL 47.A O no hydrogen 3.102 N/A LYS 88.A N GLU 86.A O no hydrogen 2.677 N/A THR 92.A N GLN 95.A OE1 no hydrogen 2.987 N/A THR 92.A OG1 ASP 32.A OD2 no hydrogen 2.915 N/A THR 92.A OG1 GLN 95.A OE1 no hydrogen 3.426 N/A GLN 95.A N THR 92.A O no hydrogen 2.513 N/A GLN 95.A N THR 92.A OG1 no hydrogen 3.273 N/A GLN 95.A NE2 GLY 33.A O no hydrogen 2.923 N/A GLN 95.A NE2 THR 110.A OG1 no hydrogen 2.811 N/A GLU 96.A N THR 92.A O no hydrogen 3.013 N/A ARG 97.A N ARG 93.A O no hydrogen 2.921 N/A LEU 98.A N LEU 94.A O no hydrogen 3.153 N/A ILE 99.A N GLN 95.A O no hydrogen 2.918 N/A LYS 100.A N GLU 96.A O no hydrogen 3.065 N/A LYS 101.A N ARG 97.A O no hydrogen 3.254 N/A LEU 102.A N LEU 98.A O no hydrogen 2.984 N/A GLY 103.A N ILE 99.A O no hydrogen 2.857 N/A TYR 107.A N VAL 35.A O no hydrogen 2.863 N/A PHE 109.A N GLY 33.A O no hydrogen 2.956 N/A PHE 111.A N VAL 31.A O no hydrogen 2.938 N/A SER 120.A N LYS 164.A O no hydrogen 3.082 N/A VAL 121.A N VAL 136.A O no hydrogen 3.306 N/A THR 122.A N LEU 283.A O no hydrogen 2.796 N/A THR 122.A OG1 GLY 285.A O no hydrogen 2.941 N/A LEU 123.A N CYS 134.A O no hydrogen 2.842 N/A GLY 126.A N ASP 129.A OD1 no hydrogen 2.819 N/A ASP 129.A N GLY 126.A O no hydrogen 3.065 N/A LYS 132.A N TYR 57.A OH no hydrogen 2.935 N/A CYS 134.A N LEU 123.A O no hydrogen 3.180 N/A GLY 135.A N ARG 56.A O no hydrogen 3.057 N/A VAL 136.A N VAL 121.A O no hydrogen 2.651 N/A ASP 137.A N ALA 54.A O no hydrogen 3.062 N/A TYR 138.A OH PRO 118.A O no hydrogen 2.597 N/A GLU 139.A N THR 52.A O no hydrogen 2.625 N/A VAL 140.A N LEU 160.A O no hydrogen 2.804 N/A LYS 141.A N THR 50.A O no hydrogen 2.758 N/A ALA 142.A N VAL 158.A O no hydrogen 2.780 N/A PHE 143.A N TYR 48.A O no hydrogen 2.771 N/A CYS 144.A SG ASN 156.A O no hydrogen 3.374 N/A ALA 145.A N ARG 46.A O no hydrogen 2.754 N/A GLU 146.A N GLU 150.A OE2 no hydrogen 2.655 N/A GLU 150.A N ASN 147.A O no hydrogen 3.373 N/A ASN 156.A N HIS 153.A O no hydrogen 3.162 N/A SER 157.A N LYS 154.A O no hydrogen 3.437 N/A SER 157.A OG LYS 154.A O no hydrogen 3.349 N/A VAL 158.A N ALA 142.A O no hydrogen 2.675 N/A LEU 160.A N VAL 140.A O no hydrogen 2.769 N/A ILE 162.A N TYR 138.A O no hydrogen 3.040 N/A ARG 163.A N ARG 19.A O no hydrogen 3.009 N/A ARG 163.A NE ASP 20.A OD1 no hydrogen 2.883 N/A ARG 163.A NH1 ASP 291.A O no hydrogen 3.234 N/A ARG 163.A NH2 ASP 20.A OD2 no hydrogen 2.825 N/A LYS 164.A N SER 120.A OG no hydrogen 2.983 N/A LYS 164.A NZ ASP 23.A OD2 no hydrogen 2.993 N/A LYS 164.A NZ LEU 117.A O no hydrogen 2.789 N/A VAL 165.A N PHE 21.A O no hydrogen 2.940 N/A TYR 167.A N ASP 23.A O no hydrogen 2.969 N/A THR 177.A OG1 ALA 195.A O no hydrogen 3.354 N/A ALA 178.A N ALA 195.A O no hydrogen 2.904 N/A THR 180.A N LEU 193.A O no hydrogen 2.911 N/A ARG 182.A N LEU 191.A O no hydrogen 2.688 N/A ARG 182.A NH1 ASP 330.A O no hydrogen 3.325 N/A LEU 191.A N ARG 182.A O no hydrogen 2.967 N/A HIS 192.A N THR 215.A O no hydrogen 2.980 N/A HIS 192.A NE2 GLU 179.A OE1 no hydrogen 2.589 N/A LEU 193.A N THR 180.A O no hydrogen 2.865 N/A GLU 194.A N HIS 213.A O no hydrogen 2.868 N/A ALA 195.A N ALA 178.A O no hydrogen 2.880 N/A SER 196.A N ASN 211.A O no hydrogen 3.040 N/A LEU 197.A N PRO 176.A O no hydrogen 2.986 N/A ASP 198.A N SER 209.A O no hydrogen 3.321 N/A LYS 199.A N TYR 202.A OH no hydrogen 2.915 N/A LYS 199.A NZ GLU 170.A OE1 no hydrogen 3.003 N/A LYS 199.A NZ ILE 201.A O no hydrogen 2.822 N/A LYS 199.A NZ GLU 206.A OE1 no hydrogen 2.627 N/A LYS 199.A NZ GLU 206.A OE2 no hydrogen 2.928 N/A TYR 202.A N THR 338.A O no hydrogen 2.897 N/A TYR 202.A OH ASP 198.A OD1 no hydrogen 2.686 N/A TYR 202.A OH LYS 199.A O no hydrogen 3.417 N/A TYR 203.A N GLU 206.A OE2 no hydrogen 3.122 N/A TYR 203.A OH ALA 168.A O no hydrogen 2.620 N/A HIS 204.A N MET 340.A O no hydrogen 3.081 N/A GLU 206.A N TYR 203.A O no hydrogen 2.842 N/A ILE 208.A N LEU 268.A O no hydrogen 2.780 N/A SER 209.A N ASP 198.A OD1 no hydrogen 2.964 N/A VAL 210.A N TYR 266.A O no hydrogen 2.628 N/A ASN 211.A N SER 196.A O no hydrogen 2.784 N/A VAL 212.A N LYS 264.A O no hydrogen 2.902 N/A HIS 213.A N GLU 194.A O no hydrogen 2.715 N/A VAL 214.A N PHE 262.A O no hydrogen 2.715 N/A THR 215.A N HIS 192.A O no hydrogen 2.938 N/A ASN 216.A N SER 260.A O no hydrogen 2.907 N/A ASN 216.A ND2 LYS 220.A O no hydrogen 2.672 N/A ASN 216.A ND2 VAL 256.A O no hydrogen 3.497 N/A ASN 216.A ND2 ALA 257.A O no hydrogen 3.226 N/A ASN 217.A N PRO 190.A O no hydrogen 3.151 N/A THR 218.A N ASN 216.A OD1 no hydrogen 2.982 N/A THR 218.A OG1 LYS 189.A O no hydrogen 3.455 N/A THR 221.A N SER 324.A OG no hydrogen 3.134 N/A VAL 222.A N VAL 256.A O no hydrogen 2.888 N/A LYS 223.A N VAL 322.A O no hydrogen 2.751 N/A LYS 224.A NZ GLU 251.A OE1 no hydrogen 3.446 N/A ILE 225.A N ALA 252.A O no hydrogen 3.103 N/A LYS 226.A N LYS 320.A O no hydrogen 2.895 N/A ILE 227.A N GLU 250.A O no hydrogen 2.847 N/A SER 228.A N LYS 318.A O no hydrogen 3.026 N/A VAL 229.A N ALA 248.A O no hydrogen 2.806 N/A ARG 230.A N LYS 316.A O no hydrogen 2.837 N/A GLN 231.A N CYS 245.A O no hydrogen 2.862 N/A GLN 231.A NE2 ALA 282.A O no hydrogen 3.008 N/A GLN 231.A NE2 TYR 315.A OH no hydrogen 2.845 N/A TYR 232.A N SER 314.A O no hydrogen 2.867 N/A ALA 233.A N TYR 243.A O no hydrogen 2.979 N/A ASP 234.A N ILE 312.A O no hydrogen 2.919 N/A ILE 235.A N ALA 241.A O no hydrogen 2.772 N/A CYS 236.A N GLY 310.A O no hydrogen 2.773 N/A CYS 236.A SG ASP 234.A O no hydrogen 3.724 N/A ASN 239.A N LEU 237.A O no hydrogen 2.615 N/A ALA 241.A N ILE 235.A O no hydrogen 3.434 N/A TYR 243.A N ALA 233.A O no hydrogen 2.824 N/A CYS 245.A N GLN 231.A O no hydrogen 2.958 N/A CYS 245.A SG PRO 246.A O no hydrogen 3.359 N/A VAL 247.A N VAL 229.A O no hydrogen 2.964 N/A GLU 250.A N ILE 227.A O no hydrogen 2.787 N/A ALA 252.A N ILE 225.A O no hydrogen 2.907 N/A VAL 256.A N VAL 222.A O no hydrogen 3.085 N/A SER 259.A N THR 218.A O no hydrogen 3.207 N/A SER 260.A N ASN 216.A O no hydrogen 2.958 N/A SER 260.A OG ALA 257.A O no hydrogen 2.472 N/A PHE 262.A N VAL 214.A O no hydrogen 2.863 N/A LYS 264.A N VAL 212.A O no hydrogen 2.954 N/A LYS 264.A NZ ASP 254.A OD1 no hydrogen 3.040 N/A LYS 264.A NZ ASP 254.A OD2 no hydrogen 2.824 N/A TYR 266.A N VAL 210.A O no hydrogen 2.775 N/A TYR 266.A OH ASP 254.A OD2 no hydrogen 2.365 N/A LEU 268.A N ILE 208.A O no hydrogen 3.001 N/A PHE 271.A N VAL 247.A O no hydrogen 3.139 N/A GLU 277.A N GLU 277.A OE1 no hydrogen 2.598 N/A LEU 281.A N ARG 279.A O no hydrogen 2.345 N/A ALA 282.A N GLN 231.A OE1 no hydrogen 2.952 N/A LEU 283.A N THR 122.A O no hydrogen 2.771 N/A ASP 284.A N ASN 293.A O no hydrogen 2.981 N/A LYS 286.A NZ GLU 60.A OE2 no hydrogen 2.464 N/A LYS 286.A NZ ASP 61.A OD1 no hydrogen 3.238 N/A HIS 289.A N LYS 286.A O no hydrogen 3.092 N/A THR 292.A N HIS 289.A O no hydrogen 3.426 N/A THR 292.A OG1 LYS 286.A O no hydrogen 2.507 N/A THR 292.A OG1 HIS 289.A O no hydrogen 3.450 N/A ASN 293.A N ASP 284.A OD1 no hydrogen 2.745 N/A ASN 293.A ND2 ASP 284.A OD2 no hydrogen 3.087 N/A ALA 295.A N ALA 282.A O no hydrogen 3.035 N/A SER 297.A N LEU 339.A O no hydrogen 2.833 N/A THR 298.A N VAL 313.A O no hydrogen 2.765 N/A THR 298.A OG1 ILE 311.A O no hydrogen 3.424 N/A ARG 301.A NH2 ILE 25.A O no hydrogen 3.176 N/A ALA 304.A N ARG 301.A O no hydrogen 3.111 N/A ARG 306.A NH2 ASP 234.A OD2 no hydrogen 3.142 N/A ILE 308.A N ASN 305.A OD1 no hydrogen 3.282 N/A LEU 309.A N ARG 306.A O no hydrogen 3.329 N/A GLY 310.A N GLU 307.A O no hydrogen 2.871 N/A ILE 311.A N LEU 309.A O no hydrogen 2.887 N/A ILE 312.A N ASP 234.A O no hydrogen 2.873 N/A VAL 313.A N THR 298.A OG1 no hydrogen 2.758 N/A SER 314.A N TYR 232.A O no hydrogen 2.981 N/A TYR 315.A OH ALA 295.A O no hydrogen 2.588 N/A LYS 316.A N ARG 230.A O no hydrogen 2.928 N/A LYS 316.A NZ GLU 334.A OE2 no hydrogen 2.932 N/A VAL 317.A N LEU 335.A O no hydrogen 2.754 N/A LYS 318.A N SER 228.A O no hydrogen 2.845 N/A VAL 319.A N VAL 333.A O no hydrogen 2.852 N/A LYS 320.A N LYS 226.A O no hydrogen 2.851 N/A LYS 320.A NZ ASP 330.A OD2 no hydrogen 3.512 N/A LEU 321.A N VAL 331.A O no hydrogen 2.725 N/A VAL 322.A N LYS 224.A O no hydrogen 2.902 N/A VAL 323.A N SER 329.A O no hydrogen 3.050 N/A SER 324.A N THR 221.A O no hydrogen 2.791 N/A SER 328.A OG VAL 323.A O no hydrogen 3.235 N/A VAL 331.A N LEU 321.A O no hydrogen 3.159 N/A VAL 333.A N VAL 319.A O no hydrogen 2.962 N/A LEU 335.A N VAL 317.A O no hydrogen 2.778 N/A THR 338.A N GLU 200.A O no hydrogen 2.903 N/A LEU 339.A N SER 297.A OG no hydrogen 2.926 N/A MET 340.A N TYR 202.A O no hydrogen 2.800 N/A HIS 341.A N GLN 166.A O no hydrogen 2.924 N/A GLU 349.A N VAL 2.A O no hydrogen 2.753 N/A ARG 353.A NH1 ASP 20.A OD1 no hydrogen 3.209 N/A ARG 353.A NH1 ASP 291.A OD2 no hydrogen 2.919 N/A ARG 353.A NH2 VAL 161.A O no hydrogen 2.902 N/A