Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ux4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N LEU 175.A O no hydrogen 3.038 N/A GLU 5.A N LEU 173.A O no hydrogen 2.931 N/A LEU 7.A N GLY 171.A O no hydrogen 3.105 N/A LYS 8.A N TYR 16.A O no hydrogen 2.865 N/A ASN 9.A ND2 ASP 12.A OD1 no hydrogen 3.069 N/A TYR 10.A N GLN 14.A O no hydrogen 2.896 N/A ALA 13.A N TYR 10.A O no hydrogen 2.941 N/A GLN 14.A N TYR 10.A O no hydrogen 3.130 N/A GLN 14.A NE2 ALA 120.A O no hydrogen 3.387 N/A TYR 15.A OH ASN 162.A O no hydrogen 3.071 N/A TYR 16.A N LYS 8.A O no hydrogen 3.197 N/A GLY 17.A N VAL 30.A O no hydrogen 3.005 N/A GLU 18.A N GLU 5.A OE1 no hydrogen 3.117 N/A ILE 19.A N PHE 28.A O no hydrogen 2.805 N/A GLY 20.A N SER 93.A O no hydrogen 2.731 N/A ILE 21.A N GLN 26.A O no hydrogen 3.012 N/A GLY 22.A N THR 91.A O no hydrogen 2.933 N/A THR 23.A N SER 64.A OG no hydrogen 3.262 N/A THR 23.A OG1 THR 66.A OG1 no hydrogen 3.227 N/A GLN 26.A N ILE 21.A O no hydrogen 3.005 N/A GLN 26.A NE2 ASN 60.A O no hydrogen 2.979 N/A PHE 28.A N ILE 19.A O no hydrogen 2.872 N/A THR 29.A N ASP 124.A OD2 no hydrogen 3.150 N/A VAL 30.A N GLY 17.A O no hydrogen 2.870 N/A VAL 31.A N GLY 125.A O no hydrogen 3.161 N/A ASP 33.A N LEU 127.A O no hydrogen 2.875 N/A THR 34.A N THR 224.A OG1 no hydrogen 3.095 N/A THR 34.A OG1 VAL 222.A O no hydrogen 2.962 N/A THR 34.A OG1 THR 224.A OG1 no hydrogen 3.404 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.714 N/A SER 36.A OG ASP 33.A OD2 no hydrogen 2.953 N/A SER 37.A OG TYR 131.A O no hydrogen 2.621 N/A ASN 38.A ND2 VAL 136.A O no hydrogen 3.086 N/A TRP 40.A N ILE 126.A O no hydrogen 3.082 N/A VAL 41.A N GLY 108.A O no hydrogen 3.140 N/A SER 43.A N ALA 110.A O no hydrogen 2.998 N/A SER 43.A OG GLU 109.A OE1 no hydrogen 2.547 N/A ILE 44.A N TYR 59.A O no hydrogen 3.201 N/A HIS 45.A N SER 43.A OG no hydrogen 3.269 N/A CYS 46.A SG SER 43.A O no hydrogen 3.187 N/A CYS 46.A SG ILE 44.A O no hydrogen 3.702 N/A CYS 46.A SG CYS 53.A O no hydrogen 3.920 N/A ASP 50.A N LYS 47.A O no hydrogen 3.177 N/A CYS 53.A N ASP 50.A O no hydrogen 3.284 N/A TRP 54.A N ILE 51.A O no hydrogen 3.058 N/A TRP 54.A NE1 LEU 48.A O no hydrogen 2.872 N/A HIS 56.A NE2 ALA 121.A O no hydrogen 2.944 N/A HIS 57.A N ASP 124.A OD1 no hydrogen 3.500 N/A LYS 58.A NZ ALA 52.A O no hydrogen 2.973 N/A TYR 59.A N PRO 42.A O no hydrogen 2.799 N/A TYR 59.A OH ASP 90.A OD2 no hydrogen 2.480 N/A ASN 60.A N GLN 26.A OE1 no hydrogen 3.191 N/A ASP 62.A N ASN 60.A OD1 no hydrogen 3.356 N/A LYS 63.A N ASN 60.A O no hydrogen 3.177 N/A SER 64.A OG ASP 90.A OD1 no hydrogen 3.182 N/A SER 64.A OG ASP 90.A OD2 no hydrogen 2.690 N/A SER 65.A N THR 23.A O no hydrogen 3.358 N/A THR 66.A OG1 THR 23.A OG1 no hydrogen 3.227 N/A THR 66.A OG1 SER 64.A OG no hydrogen 3.217 N/A THR 66.A OG1 ASP 90.A OD1 no hydrogen 2.468 N/A VAL 68.A N GLN 89.A O no hydrogen 2.984 N/A GLY 71.A N LEU 87.A O no hydrogen 3.012 N/A THR 72.A OG1 ASN 70.A OD1 no hydrogen 2.907 N/A PHE 74.A N GLY 85.A O no hydrogen 2.651 N/A ILE 76.A N LEU 83.A O no hydrogen 2.878 N/A TYR 78.A N GLY 81.A O no hydrogen 3.124 N/A LEU 83.A N ILE 76.A O no hydrogen 3.030 N/A SER 84.A N LYS 112.A O no hydrogen 3.008 N/A GLY 85.A N PHE 74.A O no hydrogen 3.061 N/A TYR 86.A N GLU 109.A O no hydrogen 3.163 N/A LEU 87.A N THR 72.A O no hydrogen 2.776 N/A SER 88.A N PHE 107.A O no hydrogen 3.003 N/A SER 88.A OG GLU 109.A OE2 no hydrogen 2.563 N/A GLN 89.A N VAL 68.A O no hydrogen 3.182 N/A ASP 90.A N GLN 105.A O no hydrogen 3.182 N/A THR 91.A N ASP 90.A OD1 no hydrogen 2.603 N/A VAL 92.A N VAL 102.A O no hydrogen 2.868 N/A SER 93.A N GLY 20.A O no hydrogen 2.613 N/A VAL 94.A N ILE 100.A O no hydrogen 3.202 N/A CYS 96.A SG ILE 19.A O no hydrogen 3.583 N/A ILE 100.A N VAL 94.A O no hydrogen 3.138 N/A LYS 101.A NZ SER 93.A OG no hydrogen 2.675 N/A VAL 102.A N VAL 92.A O no hydrogen 2.758 N/A GLU 103.A N GLN 149.A OE1 no hydrogen 3.082 N/A GLN 105.A N ASP 90.A O no hydrogen 2.985 N/A GLN 105.A NE2 ILE 106.A O no hydrogen 3.014 N/A GLN 105.A NE2 LEU 140.A O no hydrogen 3.162 N/A PHE 107.A N SER 88.A O no hydrogen 2.827 N/A GLY 108.A N LEU 39.A O no hydrogen 2.832 N/A GLU 109.A N TYR 86.A O no hydrogen 2.738 N/A ALA 110.A N VAL 41.A O no hydrogen 2.992 N/A THR 111.A N SER 84.A O no hydrogen 2.990 N/A LYS 112.A N SER 84.A O no hydrogen 3.126 N/A ALA 120.A N VAL 117.A O no hydrogen 3.011 N/A LYS 122.A N GLN 14.A OE1 no hydrogen 2.829 N/A ASP 124.A N THR 29.A O no hydrogen 2.769 N/A ASP 124.A N THR 29.A OG1 no hydrogen 3.003 N/A GLY 125.A N THR 29.A O no hydrogen 3.064 N/A ILE 126.A N TRP 40.A O no hydrogen 3.255 N/A LEU 127.A N VAL 31.A O no hydrogen 3.037 N/A GLY 128.A N ASN 38.A O no hydrogen 2.788 N/A MET 129.A N ASP 33.A O no hydrogen 2.639 N/A GLY 130.A N SER 36.A O no hydrogen 2.822 N/A TYR 131.A N ALA 196.A O no hydrogen 3.165 N/A ILE 134.A N TYR 131.A O no hydrogen 3.478 N/A SER 135.A N PRO 132.A O no hydrogen 3.003 N/A SER 135.A OG VAL 139.A O no hydrogen 2.611 N/A VAL 136.A N ASN 38.A OD1 no hydrogen 3.033 N/A ASN 137.A ND2 SER 73.A O no hydrogen 3.656 N/A ASN 138.A N SER 135.A O no hydrogen 3.033 N/A ASN 145.A N PRO 141.A O no hydrogen 2.939 N/A ASN 145.A ND2 GLU 103.A O no hydrogen 3.336 N/A ASN 145.A ND2 LYS 104.A O no hydrogen 3.659 N/A ASN 145.A ND2 GLN 105.A OE1 no hydrogen 2.919 N/A LEU 146.A N VAL 142.A O no hydrogen 2.847 N/A MET 147.A N PHE 143.A O no hydrogen 3.114 N/A LYS 148.A N ASP 144.A O no hydrogen 3.072 N/A GLN 149.A N ASN 145.A O no hydrogen 3.036 N/A GLN 149.A NE2 GLU 103.A O no hydrogen 2.640 N/A GLN 149.A NE2 ASN 145.A OD1 no hydrogen 3.170 N/A LYS 150.A N MET 147.A O no hydrogen 3.014 N/A LEU 151.A N LEU 146.A O no hydrogen 3.240 N/A PHE 157.A N PHE 322.A O no hydrogen 2.858 N/A SER 158.A N MET 174.A O no hydrogen 2.978 N/A SER 158.A OG GLY 177.A O no hydrogen 2.824 N/A PHE 159.A N THR 320.A O no hydrogen 2.848 N/A TYR 160.A N GLU 172.A O no hydrogen 2.867 N/A ASN 162.A N GLY 170.A O no hydrogen 3.033 N/A ASN 162.A ND2 PRO 169.A O no hydrogen 3.306 N/A ARG 163.A NH2 ASP 12.A O no hydrogen 3.508 N/A ASP 164.A N ASN 162.A OD1 no hydrogen 3.009 N/A THR 166.A OG1 ASP 164.A OD1 no hydrogen 3.438 N/A GLY 167.A N ASP 164.A O no hydrogen 3.115 N/A GLU 172.A N TYR 160.A O no hydrogen 2.784 N/A LEU 173.A N GLU 5.A O no hydrogen 3.064 N/A MET 174.A N SER 158.A O no hydrogen 2.861 N/A LEU 175.A N VAL 3.A O no hydrogen 2.943 N/A GLY 176.A N ILE 156.A O no hydrogen 2.874 N/A THR 178.A OG1 TYR 183.A OH no hydrogen 3.364 N/A ASP 179.A N TYR 319.A OH no hydrogen 2.830 N/A ARG 181.A N ASP 179.A OD1 no hydrogen 3.234 N/A ARG 181.A NH2 TYR 182.A OH no hydrogen 3.448 N/A TYR 182.A N ASP 179.A O no hydrogen 3.333 N/A TYR 183.A N SER 180.A O no hydrogen 3.520 N/A TYR 183.A OH THR 178.A OG1 no hydrogen 3.364 N/A HIS 184.A N LYS 333.A O no hydrogen 2.889 N/A SER 188.A N PHE 331.A O no hydrogen 3.112 N/A SER 188.A OG TYR 275.A OH no hydrogen 2.766 N/A LEU 190.A N VAL 329.A O no hydrogen 2.732 N/A VAL 192.A N ASN 327.A O no hydrogen 3.081 N/A THR 193.A N GLN 199.A O no hydrogen 3.011 N/A THR 193.A OG1 GLU 219.A OE2 no hydrogen 2.942 N/A ALA 196.A N ARG 194.A O no hydrogen 2.855 N/A ALA 196.A N TYR 197.A O no hydrogen 3.291 N/A TRP 198.A NE1 MET 129.A O no hydrogen 2.921 N/A GLN 199.A NE2 GLU 219.A OE2 no hydrogen 3.254 N/A VAL 200.A N ALA 220.A O no hydrogen 2.582 N/A HIS 201.A ND1 GLU 219.A OE1 no hydrogen 2.964 N/A MET 202.A N CYS 218.A O no hydrogen 2.804 N/A ASP 203.A N LYS 269.A O no hydrogen 2.978 N/A GLN 204.A N LYS 269.A O no hydrogen 3.343 N/A LEU 205.A N LEU 213.A O no hydrogen 2.815 N/A GLU 206.A N THR 267.A O no hydrogen 3.013 N/A VAL 207.A N LEU 211.A O no hydrogen 2.877 N/A GLY 208.A N ILE 265.A O no hydrogen 2.864 N/A LEU 213.A N LEU 205.A O no hydrogen 2.690 N/A CYS 214.A N GLU 235.A OE1 no hydrogen 3.007 N/A CYS 214.A SG MET 202.A O no hydrogen 3.454 N/A LYS 215.A NZ THR 212.A O no hydrogen 2.873 N/A GLY 217.A N CYS 214.A O no hydrogen 3.196 N/A CYS 218.A N MET 202.A O no hydrogen 2.845 N/A ALA 220.A N VAL 200.A O no hydrogen 2.734 N/A ILE 221.A N TRP 308.A O no hydrogen 2.890 N/A VAL 222.A N TRP 198.A O no hydrogen 2.982 N/A ASP 223.A N LEU 310.A O no hydrogen 3.296 N/A THR 224.A N THR 34.A OG1 no hydrogen 2.964 N/A THR 224.A OG1 PHE 32.A O no hydrogen 2.674 N/A THR 224.A OG1 THR 34.A OG1 no hydrogen 3.404 N/A GLY 225.A N ASP 223.A OD2 no hydrogen 2.720 N/A THR 226.A OG1 ASP 223.A OD1 no hydrogen 2.434 N/A SER 227.A OG ALA 13.A O no hydrogen 2.780 N/A LEU 229.A N GLY 294.A O no hydrogen 2.994 N/A VAL 230.A N ILE 309.A O no hydrogen 3.048 N/A GLY 231.A N MET 296.A O no hydrogen 3.234 N/A VAL 233.A N ASP 299.A OD1 no hydrogen 3.113 N/A VAL 236.A N PRO 232.A O no hydrogen 2.915 N/A LYS 237.A N VAL 233.A O no hydrogen 2.918 N/A GLU 238.A N ASP 234.A O no hydrogen 3.331 N/A LEU 239.A N GLU 235.A O no hydrogen 3.236 N/A GLN 240.A N VAL 236.A O no hydrogen 2.865 N/A GLN 240.A NE2 PHE 295.A O no hydrogen 3.089 N/A LYS 241.A N LYS 237.A O no hydrogen 3.222 N/A ALA 242.A N GLU 238.A O no hydrogen 2.904 N/A ILE 243.A N LEU 239.A O no hydrogen 3.036 N/A GLY 244.A N LYS 241.A O no hydrogen 2.999 N/A ALA 245.A N GLN 240.A O no hydrogen 2.709 N/A VAL 246.A N MET 254.A O no hydrogen 2.962 N/A LEU 248.A N GLU 252.A O no hydrogen 2.489 N/A MET 254.A N VAL 246.A O no hydrogen 2.784 N/A ILE 255.A N CYS 291.A O no hydrogen 3.124 N/A CYS 257.A SG THR 289.A O no hydrogen 4.049 N/A LYS 259.A N PRO 256.A O no hydrogen 2.975 N/A LYS 259.A NZ SER 262.A OG no hydrogen 3.209 N/A SER 262.A N LYS 259.A O no hydrogen 3.396 N/A SER 262.A OG LYS 259.A O no hydrogen 3.038 N/A LEU 263.A N VAL 260.A O no hydrogen 2.898 N/A ILE 266.A N LEU 277.A O no hydrogen 3.169 N/A THR 267.A N GLU 206.A O no hydrogen 2.907 N/A PHE 268.A N TYR 275.A O no hydrogen 2.820 N/A LYS 269.A N GLN 204.A O no hydrogen 3.140 N/A LEU 270.A N GLN 273.A O no hydrogen 3.188 N/A TYR 275.A N PHE 268.A O no hydrogen 2.853 N/A TYR 275.A OH SER 188.A OG no hydrogen 2.766 N/A LEU 277.A N ILE 266.A O no hydrogen 2.822 N/A LYS 281.A N HIS 278.A O no hydrogen 2.734 N/A TYR 282.A N HIS 278.A O no hydrogen 3.304 N/A TYR 282.A OH PRO 264.A O no hydrogen 2.803 N/A LEU 284.A N LEU 292.A O no hydrogen 2.840 N/A VAL 286.A N ILE 290.A O no hydrogen 2.936 N/A ILE 290.A N VAL 286.A O no hydrogen 2.791 N/A LEU 292.A N LEU 284.A O no hydrogen 2.796 N/A SER 293.A N TYR 253.A O no hydrogen 2.788 N/A SER 293.A OG GLN 240.A OE1 no hydrogen 2.885 N/A GLY 294.A N TYR 282.A O no hydrogen 2.860 N/A PHE 295.A N SER 293.A OG no hydrogen 3.347 N/A MET 296.A N LEU 229.A O no hydrogen 2.832 N/A MET 298.A N GLY 231.A O no hydrogen 2.959 N/A GLY 305.A N PRO 301.A O no hydrogen 2.888 N/A TRP 308.A N GLU 219.A O no hydrogen 3.136 N/A ILE 309.A N VAL 230.A O no hydrogen 2.791 N/A LEU 310.A N ILE 221.A O no hydrogen 2.985 N/A ASP 312.A N THR 226.A O no hydrogen 2.770 N/A VAL 313.A N SER 227.A O no hydrogen 3.254 N/A ILE 315.A N GLY 311.A O no hydrogen 3.016 N/A GLY 316.A N ASP 312.A O no hydrogen 2.740 N/A CYS 317.A N PHE 314.A O no hydrogen 3.149 N/A TYR 318.A N PHE 314.A O no hydrogen 2.953 N/A TYR 318.A N ILE 315.A O no hydrogen 3.205 N/A TYR 318.A OH GLU 276.A O no hydrogen 2.645 N/A THR 320.A N PHE 159.A O no hydrogen 3.304 N/A THR 320.A OG1 TYR 318.A O no hydrogen 2.903 N/A VAL 321.A N GLY 330.A O no hydrogen 2.966 N/A PHE 322.A N PHE 157.A O no hydrogen 2.672 N/A ASP 323.A N ARG 328.A O no hydrogen 2.976 N/A ARG 324.A N ASN 155.A O no hydrogen 2.967 N/A ARG 324.A NH1 ASP 144.A OD1 no hydrogen 2.844 N/A ARG 324.A NH1 ASP 144.A OD2 no hydrogen 3.271 N/A ARG 324.A NH2 ASP 144.A OD2 no hydrogen 2.739 N/A GLU 325.A N ASP 323.A OD1 no hydrogen 2.948 N/A TYR 326.A N ASP 323.A OD1 no hydrogen 3.413 N/A ASN 327.A ND2 TYR 131.A OH no hydrogen 2.894 N/A ARG 328.A N ASP 323.A O no hydrogen 3.025 N/A ARG 328.A NE ASP 323.A OD2 no hydrogen 2.764 N/A VAL 329.A N LEU 190.A O no hydrogen 2.837 N/A GLY 330.A N VAL 321.A O no hydrogen 2.832 N/A PHE 331.A N SER 188.A O no hydrogen 2.973 N/A ALA 332.A N TYR 319.A O no hydrogen 3.112 N/A LYS 333.A NZ CYS 317.A O no hydrogen 3.216 N/A LYS 333.A NZ ALA 334.A O no hydrogen 3.333 N/A ALA 334.A N CYS 317.A O no hydrogen 3.303 N/A ALA 335.A N TYR 182.A O no hydrogen 2.982 N/A