Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hqt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N MET 13.A O no hydrogen 2.890 N/A LEU 7.A N GLN 11.A O no hydrogen 2.987 N/A HIS 8.A NE2 ARG 178.A O no hydrogen 2.807 N/A GLY 10.A N LEU 7.A O no hydrogen 2.941 N/A GLN 11.A NE2 THR 9.A OG1 no hydrogen 2.724 N/A MET 13.A N VAL 5.A O no hydrogen 2.927 N/A LEU 15.A N SER 3.A O no hydrogen 2.880 N/A GLY 17.A N CYS 259.A O no hydrogen 2.690 N/A LEU 18.A N HIS 42.A O no hydrogen 2.681 N/A GLY 19.A N PRO 261.A O no hydrogen 2.897 N/A THR 20.A OG1 ASP 44.A O no hydrogen 2.717 N/A SER 23.A N THR 20.A O no hydrogen 3.086 N/A GLU 24.A N LYS 22.A O no hydrogen 2.539 N/A VAL 28.A N GLU 24.A O no hydrogen 3.181 N/A LYS 29.A NZ GLU 57.A OE2 no hydrogen 2.795 N/A ALA 31.A N GLN 27.A O no hydrogen 3.198 N/A ILE 32.A N VAL 28.A O no hydrogen 2.713 N/A LYS 33.A N LYS 29.A O no hydrogen 3.192 N/A TYR 34.A N ALA 30.A O no hydrogen 3.186 N/A ALA 35.A N ALA 31.A O no hydrogen 2.855 N/A LEU 36.A N ILE 32.A O no hydrogen 2.975 N/A THR 37.A N LYS 33.A O no hydrogen 3.160 N/A THR 37.A OG1 LYS 33.A O no hydrogen 3.191 N/A VAL 38.A N TYR 34.A O no hydrogen 2.968 N/A GLY 39.A N LEU 36.A O no hydrogen 3.193 N/A TYR 40.A N ALA 35.A O no hydrogen 3.015 N/A TYR 40.A OH ILE 269.A O no hydrogen 2.576 N/A ARG 41.A NH1 LEU 36.A O no hydrogen 3.043 N/A ARG 41.A NH1 TYR 40.A O no hydrogen 2.611 N/A HIS 42.A ND1 PRO 14.A O no hydrogen 3.076 N/A ILE 43.A N PHE 75.A O no hydrogen 2.948 N/A ASP 44.A N LEU 18.A O no hydrogen 2.843 N/A CYS 45.A N THR 77.A O no hydrogen 2.837 N/A PHE 49.A N ALA 46.A O no hydrogen 3.101 N/A GLY 50.A N ALA 47.A O no hydrogen 3.040 N/A ASN 51.A ND2 THR 20.A O no hydrogen 3.053 N/A ASN 51.A ND2 SER 23.A O no hydrogen 3.067 N/A ILE 55.A N ASN 51.A O no hydrogen 3.141 N/A GLY 56.A N GLU 52.A O no hydrogen 2.915 N/A GLU 57.A N LEU 53.A O no hydrogen 3.236 N/A ALA 58.A N GLU 54.A O no hydrogen 3.242 N/A LEU 59.A N ILE 55.A O no hydrogen 3.053 N/A GLN 60.A N GLY 56.A O no hydrogen 2.895 N/A GLN 60.A NE2 GLN 102.A O no hydrogen 3.446 N/A GLU 61.A N ALA 58.A O no hydrogen 3.197 N/A THR 62.A N LEU 59.A O no hydrogen 3.449 N/A THR 62.A OG1 ALA 58.A O no hydrogen 3.288 N/A VAL 63.A N LEU 59.A O no hydrogen 2.898 N/A GLY 64.A N VAL 69.A O no hydrogen 3.189 N/A LYS 67.A NZ VAL 63.A O no hydrogen 3.208 N/A VAL 69.A N THR 62.A O no hydrogen 3.255 N/A ARG 71.A NH1 ARG 71.A O no hydrogen 2.790 N/A ARG 71.A NH1 LEU 74.A O no hydrogen 3.210 N/A ARG 71.A NH1 ASP 107.A OD1 no hydrogen 3.250 N/A ARG 71.A NH2 TYR 105.A O no hydrogen 2.727 N/A ARG 71.A NH2 ASP 107.A OD1 no hydrogen 3.164 N/A GLU 73.A N PRO 70.A O no hydrogen 2.918 N/A LEU 74.A N ARG 71.A O no hydrogen 3.177 N/A PHE 75.A N ARG 41.A O no hydrogen 2.718 N/A VAL 76.A N ASP 107.A OD1 no hydrogen 2.766 N/A THR 77.A N ILE 43.A O no hydrogen 2.979 N/A SER 78.A N LEU 108.A O no hydrogen 3.143 N/A SER 78.A OG GLU 52.A OE1 no hydrogen 2.437 N/A LYS 79.A NZ ASP 44.A OD1 no hydrogen 2.814 N/A LYS 79.A NZ CYS 45.A O no hydrogen 3.145 N/A LEU 80.A N LEU 110.A O no hydrogen 2.738 N/A TRP 81.A NE1 PRO 123.A O no hydrogen 2.655 N/A LYS 84.A N TRP 81.A O no hydrogen 3.229 N/A LYS 84.A NZ GLY 120.A O no hydrogen 3.063 N/A HIS 85.A NE2 TRP 113.A O no hydrogen 2.879 N/A VAL 90.A N HIS 86.A O no hydrogen 3.242 N/A ALA 93.A N ASP 89.A O no hydrogen 2.818 N/A LEU 94.A N VAL 90.A O no hydrogen 2.999 N/A ARG 95.A N GLU 91.A O no hydrogen 2.797 N/A LYS 96.A N PRO 92.A O no hydrogen 2.951 N/A THR 97.A N ALA 93.A O no hydrogen 3.280 N/A THR 97.A OG1 GLU 52.A OE2 no hydrogen 2.823 N/A LEU 98.A N LEU 94.A O no hydrogen 2.999 N/A ALA 99.A N ARG 95.A O no hydrogen 2.764 N/A ASP 100.A N LYS 96.A O no hydrogen 2.869 N/A LEU 101.A N THR 97.A O no hydrogen 2.743 N/A GLN 102.A N ALA 99.A O no hydrogen 2.953 N/A LEU 103.A N LEU 98.A O no hydrogen 3.054 N/A LEU 106.A N LEU 154.A O no hydrogen 3.108 N/A ASP 107.A N VAL 76.A O no hydrogen 2.932 N/A LEU 108.A N VAL 76.A O no hydrogen 3.283 N/A TYR 109.A N ALA 157.A O no hydrogen 2.932 N/A LEU 110.A N SER 78.A O no hydrogen 2.947 N/A MET 111.A N GLY 159.A O no hydrogen 3.161 N/A HIS 112.A N LEU 80.A O no hydrogen 3.030 N/A TYR 115.A OH ASP 312.A OD1 no hydrogen 2.517 N/A PHE 117.A N ASN 82.A O no hydrogen 2.818 N/A GLU 118.A N ARG 133.A O no hydrogen 3.107 N/A GLY 130.A N ASN 127.A O no hydrogen 3.003 N/A THR 131.A OG1 ASP 129.A OD2 no hydrogen 2.496 N/A ARG 133.A N PRO 125.A O no hydrogen 2.735 N/A ARG 133.A NH2 GLU 118.A OE2 no hydrogen 2.874 N/A TYR 134.A OH ASP 312.A OD2 no hydrogen 2.648 N/A ASP 135.A N ALA 116.A O no hydrogen 3.062 N/A THR 137.A N ASP 135.A OD2 no hydrogen 2.933 N/A THR 137.A OG1 ASP 135.A OD2 no hydrogen 2.696 N/A TYR 139.A OH ASP 170.A OD2 no hydrogen 2.580 N/A LYS 140.A N HIS 138.A ND1 no hydrogen 2.917 N/A LYS 140.A NZ ASP 170.A OD1 no hydrogen 3.468 N/A ASP 141.A N HIS 138.A O no hydrogen 3.204 N/A THR 142.A N HIS 138.A O no hydrogen 3.343 N/A THR 142.A OG1 HIS 85.A O no hydrogen 2.610 N/A THR 142.A OG1 HIS 138.A O no hydrogen 3.516 N/A TRP 143.A N TYR 139.A O no hydrogen 2.704 N/A TRP 143.A NE1 VAL 177.A O no hydrogen 3.168 N/A LYS 144.A N LYS 140.A O no hydrogen 3.125 N/A LYS 144.A NZ GLU 147.A OE2 no hydrogen 2.929 N/A LYS 144.A NZ VAL 174.A O no hydrogen 2.912 N/A LYS 144.A NZ SER 176.A OG no hydrogen 2.919 N/A ALA 145.A N ASP 141.A O no hydrogen 3.292 N/A LEU 146.A N THR 142.A O no hydrogen 2.926 N/A GLU 147.A N TRP 143.A O no hydrogen 2.964 N/A LEU 149.A N LEU 146.A O no hydrogen 3.085 N/A ALA 151.A N GLU 147.A O no hydrogen 3.289 N/A LYS 152.A N ALA 148.A O no hydrogen 3.119 N/A GLY 153.A N VAL 150.A O no hydrogen 3.032 N/A LEU 154.A N LEU 149.A O no hydrogen 3.025 N/A ARG 156.A N LEU 106.A O no hydrogen 3.059 N/A GLY 159.A N TYR 109.A O no hydrogen 3.157 N/A LEU 160.A N VAL 181.A O no hydrogen 2.823 N/A SER 161.A N MET 111.A O no hydrogen 2.938 N/A SER 161.A OG HIS 112.A O no hydrogen 2.833 N/A ASN 162.A N GLN 183.A O no hydrogen 3.004 N/A ASN 162.A ND2 HIS 112.A O no hydrogen 2.958 N/A SER 164.A N GLN 167.A OE1 no hydrogen 2.972 N/A SER 165.A N TYR 324.A OXT no hydrogen 2.810 N/A SER 165.A OG TYR 324.A O no hydrogen 2.796 N/A SER 165.A OG TYR 324.A OXT no hydrogen 3.444 N/A GLN 167.A NE2 LEU 317.A O no hydrogen 3.015 N/A ILE 168.A N SER 164.A O no hydrogen 2.812 N/A ASP 169.A N SER 165.A O no hydrogen 3.048 N/A ASP 170.A N ARG 166.A O no hydrogen 2.959 N/A VAL 171.A N GLN 167.A O no hydrogen 3.075 N/A LEU 172.A N ILE 168.A O no hydrogen 3.025 N/A SER 173.A N ASP 169.A O no hydrogen 3.016 N/A SER 173.A OG ASP 170.A O no hydrogen 2.773 N/A VAL 174.A N VAL 171.A O no hydrogen 3.366 N/A SER 176.A N GLU 147.A OE1 no hydrogen 2.548 N/A VAL 177.A N GLU 147.A OE1 no hydrogen 2.960 N/A ALA 180.A N LEU 158.A O no hydrogen 2.637 N/A LEU 182.A N GLU 205.A O no hydrogen 2.803 N/A GLN 183.A N LEU 160.A O no hydrogen 2.750 N/A GLN 183.A NE2 ASP 44.A OD2 no hydrogen 3.063 N/A VAL 184.A N THR 207.A O no hydrogen 2.968 N/A CYS 186.A N TYR 209.A O no hydrogen 3.254 N/A CYS 186.A SG LEU 190.A O no hydrogen 3.593 N/A CYS 186.A SG ALA 191.A O no hydrogen 3.308 N/A HIS 187.A N LEU 190.A O no hydrogen 3.289 N/A TYR 189.A OH GLU 230.A OE1 no hydrogen 2.324 N/A LEU 190.A N HIS 187.A O no hydrogen 2.742 N/A ALA 191.A N ASN 292.A OD1 no hydrogen 3.057 N/A GLN 192.A NE2 GLU 185.A O no hydrogen 3.043 N/A ILE 196.A N GLN 192.A O no hydrogen 2.682 N/A ALA 197.A N ASN 193.A O no hydrogen 2.755 N/A HIS 198.A N GLU 194.A O no hydrogen 2.883 N/A HIS 198.A NE2 ASP 169.A OD1 no hydrogen 3.216 N/A CYS 199.A N LEU 195.A O no hydrogen 2.847 N/A CYS 199.A SG LEU 195.A O no hydrogen 3.511 N/A GLN 200.A N ILE 196.A O no hydrogen 3.036 N/A ALA 201.A N ALA 197.A O no hydrogen 3.019 N/A ARG 202.A N CYS 199.A O no hydrogen 2.916 N/A ARG 202.A NE ASP 169.A OD2 no hydrogen 2.756 N/A ARG 202.A NH1 ASP 169.A OD1 no hydrogen 2.932 N/A ARG 202.A NH1 ASP 169.A OD2 no hydrogen 3.539 N/A GLY 203.A N GLN 200.A O no hydrogen 3.434 N/A LEU 204.A N CYS 199.A O no hydrogen 2.817 N/A GLU 205.A N ALA 180.A O no hydrogen 3.015 N/A THR 207.A N LEU 182.A O no hydrogen 2.796 N/A ALA 208.A N ILE 258.A O no hydrogen 2.648 N/A TYR 209.A N VAL 184.A O no hydrogen 2.995 N/A TYR 209.A OH ASN 162.A OD1 no hydrogen 2.711 N/A GLY 213.A N SER 210.A O no hydrogen 2.999 N/A ASP 216.A N SER 214.A O no hydrogen 2.472 N/A ARG 217.A N SER 214.A O no hydrogen 3.046 N/A ARG 220.A NH2 SER 215.A O no hydrogen 2.673 N/A GLU 230.A N LEU 227.A O no hydrogen 3.343 N/A GLN 234.A N GLU 230.A O no hydrogen 3.035 N/A ALA 235.A N PRO 231.A O no hydrogen 2.791 N/A LEU 236.A N VAL 232.A O no hydrogen 2.942 N/A ALA 237.A N VAL 233.A O no hydrogen 2.889 N/A GLU 238.A N GLN 234.A O no hydrogen 2.909 N/A LYS 239.A N ALA 235.A O no hydrogen 2.842 N/A LYS 239.A NZ TYR 240.A OH no hydrogen 3.279 N/A LYS 239.A NZ GLU 284.A OE2 no hydrogen 2.591 N/A TYR 240.A N LEU 236.A O no hydrogen 2.974 N/A TYR 240.A OH THR 279.A O no hydrogen 3.142 N/A TYR 240.A OH GLU 284.A OE1 no hydrogen 2.615 N/A TYR 240.A OH GLU 284.A OE2 no hydrogen 3.374 N/A ASN 241.A N GLU 238.A O no hydrogen 3.143 N/A ARG 242.A N ALA 237.A O no hydrogen 2.897 N/A ARG 242.A NE TYR 240.A O no hydrogen 3.448 N/A ARG 242.A NH1 ASP 277.A OD1 no hydrogen 2.951 N/A ARG 242.A NH1 ASP 277.A OD2 no hydrogen 3.305 N/A ARG 242.A NH2 ASP 277.A OD2 no hydrogen 2.649 N/A SER 243.A N GLN 246.A OE1 no hydrogen 2.995 N/A SER 243.A OG GLN 246.A OE1 no hydrogen 3.511 N/A GLN 246.A NE2 GLN 271.A O no hydrogen 3.109 N/A GLN 246.A NE2 GLN 274.A O no hydrogen 3.001 N/A ILE 247.A N SER 243.A O no hydrogen 3.237 N/A LEU 248.A N PRO 244.A O no hydrogen 3.154 N/A LEU 249.A N ALA 245.A O no hydrogen 2.919 N/A ARG 250.A N GLN 246.A O no hydrogen 2.806 N/A ARG 250.A NE GLN 254.A OE1 no hydrogen 3.113 N/A ARG 250.A NH1 GLN 254.A OE1 no hydrogen 3.064 N/A ARG 250.A NH2 VAL 275.A O no hydrogen 3.198 N/A TRP 251.A N ILE 247.A O no hydrogen 3.074 N/A TRP 251.A NE1 ASP 289.A OD1 no hydrogen 3.126 N/A GLN 252.A N LEU 248.A O no hydrogen 3.412 N/A GLN 252.A NE2 CYS 186.A O no hydrogen 2.848 N/A VAL 253.A N LEU 249.A O no hydrogen 2.832 N/A GLN 254.A N ARG 250.A O no hydrogen 2.729 N/A GLN 254.A NE2 PHE 280.A O no hydrogen 2.856 N/A ARG 255.A N TRP 251.A O no hydrogen 3.323 N/A ARG 255.A N GLN 252.A O no hydrogen 3.042 N/A ARG 255.A NE GLN 252.A OE1 no hydrogen 2.732 N/A ARG 255.A NH1 ALA 191.A O no hydrogen 2.858 N/A ARG 255.A NH1 GLN 252.A OE1 no hydrogen 2.828 N/A ARG 255.A NH2 ALA 191.A O no hydrogen 3.260 N/A LYS 256.A N VAL 253.A O no hydrogen 2.910 N/A VAL 257.A N GLN 252.A O no hydrogen 2.941 N/A ILE 258.A N VAL 206.A O no hydrogen 2.968 N/A CYS 259.A N LEU 15.A O no hydrogen 2.758 N/A CYS 259.A SG VAL 257.A O no hydrogen 3.942 N/A ILE 260.A N ALA 208.A O no hydrogen 3.451 N/A THR 265.A N SER 263.A OG no hydrogen 3.250 N/A ARG 268.A N THR 265.A O no hydrogen 3.055 N/A ILE 269.A N THR 265.A O no hydrogen 3.224 N/A ASN 272.A N ARG 268.A O no hydrogen 2.835 N/A ILE 273.A N PRO 270.A O no hydrogen 3.404 N/A GLN 274.A N PRO 270.A O no hydrogen 3.190 N/A GLN 274.A N GLN 271.A O no hydrogen 3.039 N/A GLN 274.A NE2 PRO 270.A O no hydrogen 2.941 N/A PHE 280.A N GLN 254.A OE1 no hydrogen 3.041 N/A SER 281.A N GLU 284.A OE1 no hydrogen 3.086 N/A MET 285.A N SER 281.A O no hydrogen 3.077 N/A LYS 286.A N PRO 282.A O no hydrogen 2.925 N/A GLN 287.A N GLU 283.A O no hydrogen 2.903 N/A LEU 288.A N GLU 284.A O no hydrogen 2.932 N/A ASP 289.A N MET 285.A O no hydrogen 2.726 N/A ALA 290.A N LYS 286.A O no hydrogen 2.923 N/A LEU 291.A N LEU 288.A O no hydrogen 3.025 N/A ASN 292.A N ASP 289.A O no hydrogen 3.166 N/A ASN 292.A ND2 ASN 294.A OD1 no hydrogen 3.664 N/A LYS 293.A N TYR 189.A O no hydrogen 3.002 N/A LEU 295.A N TYR 189.A O no hydrogen 3.180 N/A PHE 297.A N GLU 185.A OE2 no hydrogen 2.739 N/A ILE 298.A N GLU 185.A OE1 no hydrogen 2.826 N/A VAL 299.A N PHE 297.A O no hydrogen 3.028 N/A VAL 304.A N LYS 307.A O no hydrogen 2.840 N/A LYS 307.A N VAL 304.A O no hydrogen 2.928 N/A ARG 308.A NH1 THR 303.A OG1 no hydrogen 3.155 N/A ARG 311.A NE ASP 312.A OD1 no hydrogen 3.479 N/A ARG 311.A NE ASP 312.A OD2 no hydrogen 2.652 N/A ARG 311.A NH2 ASP 312.A OD1 no hydrogen 2.934 N/A HIS 315.A N ASP 312.A O no hydrogen 2.959 N/A TYR 318.A N HIS 315.A O no hydrogen 2.985 N/A