Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2puq_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLN 134.A O no hydrogen 3.100 N/A ILE 1.A N ASP 191.A OD2 no hydrogen 2.305 N/A VAL 2.A N ASP 186.A O no hydrogen 2.969 N/A LYS 5.A N VAL 147.A O no hydrogen 2.846 N/A CYS 7.A N LEU 145.A O no hydrogen 2.616 N/A CYS 7.A SG PRO 8.A O no hydrogen 3.710 N/A LYS 9.A NZ ASP 65.A OD1 no hydrogen 3.014 N/A LYS 9.A NZ ASP 65.A OD2 no hydrogen 2.734 N/A GLU 11.A N PRO 8.A O no hydrogen 3.135 N/A GLN 15.A N CYS 12.A O no hydrogen 2.834 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.216 N/A VAL 16.A N GLY 28.A O no hydrogen 3.016 N/A LEU 17.A N VAL 55.A O no hydrogen 3.102 N/A LEU 18.A N CYS 26.A O no hydrogen 3.033 N/A LEU 19.A N ILE 53.A O no hydrogen 2.893 N/A VAL 20.A N ALA 23.A O no hydrogen 2.807 N/A ASN 21.A N ASN 51.A O no hydrogen 3.414 N/A ALA 23.A N VAL 20.A O no hydrogen 2.912 N/A GLN 24.A NE2 TRP 132.A O no hydrogen 3.266 N/A LEU 25.A N LEU 18.A O no hydrogen 2.955 N/A CYS 26.A N LEU 18.A O no hydrogen 3.484 N/A CYS 26.A SG LEU 25.A O no hydrogen 3.004 N/A CYS 26.A SG SER 192.A O no hydrogen 3.533 N/A GLY 27.A N SER 192.A O no hydrogen 2.795 N/A GLY 28.A N VAL 16.A O no hydrogen 3.136 N/A THR 29.A N VAL 37.A O no hydrogen 2.850 N/A LEU 30.A N TRP 14.A O no hydrogen 2.849 N/A ILE 31.A N TRP 35.A O no hydrogen 2.868 N/A ASN 32.A N TRP 35.A O no hydrogen 3.322 N/A ILE 34.A N ASN 32.A OD1 no hydrogen 3.309 N/A TRP 35.A N ASN 32.A O no hydrogen 3.179 N/A VAL 36.A N LEU 94.A O no hydrogen 2.869 N/A VAL 37.A N THR 29.A O no hydrogen 2.737 N/A SER 38.A N ALA 92.A O no hydrogen 2.802 N/A SER 38.A OG GLY 27.A O no hydrogen 2.855 N/A HIS 41.A N ASP 90.A OD1 no hydrogen 2.967 N/A HIS 41.A ND1 ASP 90.A OD1 no hydrogen 3.173 N/A HIS 41.A ND1 ASP 90.A OD2 no hydrogen 2.698 N/A CYS 42.A N ALA 39.A O no hydrogen 3.220 N/A CYS 42.A SG ALA 39.A O no hydrogen 3.485 N/A PHE 43.A N ALA 40.A O no hydrogen 3.189 N/A ASP 44.A N HIS 41.A O no hydrogen 3.440 N/A ILE 53.A N LEU 19.A O no hydrogen 3.091 N/A ALA 54.A N ARG 71.A O no hydrogen 2.894 N/A VAL 55.A N LEU 17.A O no hydrogen 2.670 N/A LEU 56.A N GLN 69.A O no hydrogen 2.970 N/A HIS 59.A N GLU 58.A OE1 no hydrogen 2.667 N/A LEU 61.A N LEU 143.A O no hydrogen 2.680 N/A SER 62.A N ASP 60.A OD1 no hydrogen 2.985 N/A SER 62.A OG ASP 60.A OD1 no hydrogen 2.881 N/A ASP 65.A N GLU 68.A OE2 no hydrogen 3.268 N/A ASP 67.A N ASP 65.A OD1 no hydrogen 3.090 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.737 N/A GLN 69.A N LEU 56.A O no hydrogen 2.795 N/A GLN 69.A NE2 VAL 101.A O no hydrogen 2.702 N/A ARG 71.A N ALA 54.A O no hydrogen 3.051 N/A ARG 71.A NE GLN 98.A O no hydrogen 3.240 N/A ARG 71.A NE PRO 99.A O no hydrogen 2.912 N/A ARG 71.A NH1 SER 70.A O no hydrogen 2.875 N/A ARG 71.A NH2 PRO 99.A O no hydrogen 3.127 N/A VAL 73.A N LEU 52.A O no hydrogen 3.117 N/A ALA 74.A N ARG 95.A O no hydrogen 2.724 N/A GLN 75.A N ARG 95.A O no hydrogen 3.209 N/A GLN 75.A NE2 ARG 244.A O no hydrogen 3.323 N/A GLN 75.A NE2 GLY 246.A O no hydrogen 3.145 N/A VAL 76.A N VAL 247.A O no hydrogen 2.708 N/A ILE 77.A N LEU 93.A O no hydrogen 2.679 N/A ILE 78.A N LEU 249.A O no hydrogen 2.860 N/A SER 80.A OG ALA 251.A O no hydrogen 3.491 N/A TYR 82.A N PRO 79.A O no hydrogen 3.349 N/A TYR 82.A OH ASP 44.A OD1 no hydrogen 3.023 N/A TYR 82.A OH ASP 44.A OD2 no hydrogen 3.243 N/A GLY 85.A N ASP 44.A OD2 no hydrogen 3.032 N/A THR 86.A N VAL 83.A O no hydrogen 3.041 N/A THR 86.A OG1 VAL 83.A O no hydrogen 2.866 N/A HIS 89.A ND1 TYR 231.A OH no hydrogen 2.705 N/A ILE 91.A N HIS 89.A O no hydrogen 2.983 N/A ALA 92.A N SER 38.A O no hydrogen 3.029 N/A LEU 93.A N ILE 77.A O no hydrogen 2.623 N/A LEU 94.A N VAL 36.A O no hydrogen 2.750 N/A ARG 95.A N GLN 75.A O no hydrogen 2.862 N/A ARG 95.A NH2 GLN 75.A OE1 no hydrogen 3.375 N/A LEU 96.A N ILE 34.A O no hydrogen 2.951 N/A HIS 97.A N ARG 72.A O no hydrogen 2.863 N/A VAL 100.A N THR 33.A O no hydrogen 2.842 N/A VAL 101.A N GLN 69.A OE1 no hydrogen 2.739 N/A THR 103.A N VAL 106.A O no hydrogen 2.885 N/A VAL 106.A N THR 103.A O no hydrogen 2.997 N/A VAL 107.A N PRO 13.A O no hydrogen 3.189 N/A LEU 109.A N LEU 30.A O no hydrogen 2.703 N/A CYS 110.A SG TRP 204.A O no hydrogen 3.861 N/A ARG 114.A NE GLU 118.A OE2 no hydrogen 3.245 N/A SER 117.A N GLU 113.A O no hydrogen 3.072 N/A SER 117.A N ARG 114.A O no hydrogen 2.936 N/A GLU 118.A N ARG 114.A O no hydrogen 2.779 N/A ARG 119.A N THR 115.A O no hydrogen 2.917 N/A THR 120.A N PHE 116.A O no hydrogen 2.856 N/A LEU 121.A N PHE 116.A O no hydrogen 3.146 N/A PHE 123.A N THR 120.A O no hydrogen 2.965 N/A SER 127.A N VAL 150.A O no hydrogen 2.884 N/A SER 127.A OG THR 198.A OG1 no hydrogen 3.087 N/A LEU 128.A N ALA 197.A O no hydrogen 2.949 N/A VAL 129.A N LEU 148.A O no hydrogen 2.943 N/A SER 130.A OG GLN 15.A OE1 no hydrogen 2.629 N/A GLY 131.A N MET 146.A O no hydrogen 2.767 N/A TRP 132.A NE1 HIS 59.A O no hydrogen 3.104 N/A GLY 133.A N ASP 191.A OD1 no hydrogen 2.949 N/A GLN 134.A N LYS 189.A O no hydrogen 2.842 N/A GLN 134.A NE2 LEU 136.A O no hydrogen 3.116 N/A GLN 134.A NE2 ASP 137.A O no hydrogen 2.609 N/A LEU 135.A N ALA 140.A O no hydrogen 2.818 N/A GLY 139.A N LEU 136.A O no hydrogen 2.855 N/A ALA 142.A N TRP 132.A O no hydrogen 3.134 N/A ALA 142.A N GLY 133.A O no hydrogen 3.160 N/A LEU 145.A N HIS 59.A O no hydrogen 3.079 N/A MET 146.A N GLY 131.A O no hydrogen 2.838 N/A VAL 147.A N LYS 5.A O no hydrogen 2.751 N/A LEU 148.A N VAL 129.A O no hydrogen 2.706 N/A VAL 150.A N SER 127.A O no hydrogen 2.921 N/A ARG 152.A N ARG 125.A O no hydrogen 2.972 N/A LEU 153.A N CYS 177.A O no hydrogen 3.051 N/A CYS 158.A N MET 154.A O no hydrogen 3.154 N/A LEU 159.A N THR 155.A O no hydrogen 2.766 N/A GLN 160.A N GLN 156.A O no hydrogen 2.993 N/A GLN 161.A N ASP 157.A O no hydrogen 2.959 N/A SER 162.A N CYS 158.A O no hydrogen 3.232 N/A SER 162.A OG CYS 158.A O no hydrogen 2.694 N/A ARG 163.A N GLY 220.A O no hydrogen 3.269 N/A SER 168.A N VAL 165.A O no hydrogen 3.404 N/A SER 168.A OG VAL 165.A O no hydrogen 3.483 N/A THR 172.A OG1 ASN 88.A OD1 no hydrogen 2.934 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.930 N/A TYR 174.A N THR 172.A OG1 no hydrogen 3.136 N/A MET 175.A N THR 172.A O no hydrogen 3.288 N/A PHE 176.A N TYR 225.A O no hydrogen 2.986 N/A ALA 178.A N GLY 223.A O no hydrogen 2.969 N/A GLY 179.A N PRO 151.A O no hydrogen 2.993 N/A TYR 180.A OH ASN 149.A O no hydrogen 3.358 N/A SER 184.A OG ASP 182.A OD1 no hydrogen 2.596 N/A ASP 186.A N VAL 2.A O no hydrogen 3.196 N/A SER 187.A N ASP 186.A OD1 no hydrogen 2.644 N/A CYS 188.A N ASP 191.A OD2 no hydrogen 3.096 N/A ASP 191.A N CYS 188.A O no hydrogen 3.222 N/A SER 192.A OG HIS 41.A NE2 no hydrogen 2.588 N/A GLY 193.A N VAL 210.A O no hydrogen 3.167 N/A GLY 194.A N ASP 191.A O no hydrogen 2.984 N/A HIS 196.A N GLY 208.A O no hydrogen 2.652 N/A HIS 196.A ND1 THR 207.A OG1 no hydrogen 2.635 N/A ALA 197.A N LEU 128.A O no hydrogen 2.971 N/A THR 198.A N TYR 205.A O no hydrogen 3.052 N/A THR 198.A OG1 SER 127.A OG no hydrogen 3.087 N/A THR 198.A OG1 THR 207.A OG1 no hydrogen 2.396 N/A TYR 200.A N THR 203.A O no hydrogen 2.884 N/A THR 203.A N TYR 200.A O no hydrogen 3.078 N/A LEU 206.A N CYS 110.A O no hydrogen 3.039 N/A THR 207.A N HIS 196.A O no hydrogen 2.937 N/A THR 207.A OG1 HIS 196.A ND1 no hydrogen 2.635 N/A THR 207.A OG1 HIS 196.A O no hydrogen 3.180 N/A THR 207.A OG1 THR 198.A OG1 no hydrogen 2.396 N/A GLY 208.A N HIS 196.A O no hydrogen 2.993 N/A ILE 209.A N THR 226.A O no hydrogen 3.090 N/A VAL 210.A N GLY 194.A O no hydrogen 2.767 N/A SER 211.A OG ASP 90.A OD2 no hydrogen 2.622 N/A TRP 212.A N VAL 224.A O no hydrogen 3.281 N/A ALA 217.A N ASP 186.A OD2 no hydrogen 3.115 N/A THR 218.A OG1 GLN 214.A O no hydrogen 2.609 N/A GLY 220.A N SER 181.A O no hydrogen 2.764 N/A HIS 221.A N THR 218.A O no hydrogen 3.252 N/A VAL 224.A N TRP 212.A O no hydrogen 3.095 N/A TYR 225.A N PHE 176.A O no hydrogen 2.757 N/A THR 226.A N ILE 209.A O no hydrogen 2.951 N/A THR 226.A OG1 ASP 90.A O no hydrogen 2.814 N/A ARG 227.A N TYR 174.A O no hydrogen 3.000 N/A ARG 227.A NE GLU 173.A O no hydrogen 3.052 N/A ARG 227.A NE MET 175.A O no hydrogen 3.219 N/A VAL 228.A N THR 207.A O no hydrogen 3.113 N/A GLN 230.A N ARG 227.A O no hydrogen 3.265 N/A GLN 230.A NE2 GLU 173.A O no hydrogen 2.813 N/A TYR 231.A N VAL 228.A O no hydrogen 3.004 N/A TYR 231.A OH HIS 89.A ND1 no hydrogen 2.705 N/A TRP 234.A NE1 PRO 252.A O no hydrogen 2.882 N/A LEU 235.A N TYR 231.A O no hydrogen 2.717 N/A GLN 236.A N ILE 232.A O no hydrogen 3.004 N/A LYS 237.A N GLU 233.A O no hydrogen 2.998 N/A LEU 238.A N TRP 234.A O no hydrogen 3.215 N/A MET 239.A N LEU 235.A O no hydrogen 3.101 N/A ARG 240.A N GLN 236.A O no hydrogen 3.140 N/A SER 241.A OG LYS 237.A O no hydrogen 3.324 N/A SER 241.A OG LEU 238.A O no hydrogen 3.420 N/A LEU 249.A N VAL 76.A O no hydrogen 2.655 N/A ALA 251.A N ILE 78.A O no hydrogen 3.160 N/A PHE 253.A N SER 80.A OG no hydrogen 3.229 N/A