Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a5g_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 143.A O no hydrogen 2.730 N/A ILE 1.A N ASP 196.A OD2 no hydrogen 2.715 N/A VAL 2.A N ASP 191.A O no hydrogen 2.790 N/A SER 5.A N VAL 154.A O no hydrogen 3.083 N/A ALA 7.A N LEU 152.A O no hydrogen 2.808 N/A MET 11.A N GLU 8.A O no hydrogen 3.248 N/A GLN 15.A N SER 12.A O no hydrogen 2.997 N/A VAL 16.A N ALA 30.A O no hydrogen 3.187 N/A MET 17.A N ARG 62.A O no hydrogen 2.785 N/A LEU 18.A N CYS 28.A O no hydrogen 2.754 N/A PHE 19.A N LEU 60.A O no hydrogen 2.770 N/A ARG 20.A N GLU 25.A O no hydrogen 2.690 N/A ARG 20.A NH1 GLU 25.A OE2 no hydrogen 2.796 N/A LYS 21.A N ASP 58.A O no hydrogen 3.407 N/A GLN 24.A NE2 LYS 21.A O no hydrogen 3.420 N/A GLU 25.A N ARG 20.A O no hydrogen 3.124 N/A LEU 27.A N LEU 18.A O no hydrogen 2.986 N/A CYS 28.A SG LEU 27.A O no hydrogen 3.181 N/A GLY 29.A N SER 197.A O no hydrogen 2.714 N/A SER 31.A N LEU 39.A O no hydrogen 2.860 N/A SER 31.A OG GLN 213.A OE1 no hydrogen 2.401 N/A LEU 32.A N TRP 14.A O no hydrogen 2.635 N/A ILE 33.A N TRP 37.A O no hydrogen 3.018 N/A ARG 36.A N SER 34.A OG no hydrogen 3.088 N/A ARG 36.A NH1 GLU 82.A OE1 no hydrogen 2.970 N/A ARG 36.A NH2 GLU 82.A OE1 no hydrogen 3.139 N/A VAL 38.A N MET 103.A O no hydrogen 3.001 N/A LEU 39.A N SER 31.A O no hydrogen 3.028 N/A THR 40.A N ALA 101.A O no hydrogen 2.986 N/A THR 40.A OG1 GLY 29.A O no hydrogen 3.031 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.829 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.635 N/A HIS 43.A NE2 SER 197.A OG no hydrogen 2.975 N/A CYS 44.A N ALA 41.A O no hydrogen 3.064 N/A LEU 45.A N ALA 42.A O no hydrogen 2.928 N/A LEU 46.A N ALA 42.A O no hydrogen 3.009 N/A ASN 57.A ND2 THR 55I.A OG1 no hydrogen 3.264 N/A ASP 58.A N THR 55I.A O no hydrogen 2.863 N/A LEU 60.A N PHE 19.A O no hydrogen 3.042 N/A VAL 61.A N SER 79.A O no hydrogen 2.839 N/A ARG 62.A N MET 17.A O no hydrogen 3.027 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 3.083 N/A ARG 62.A NH2 GLU 76.A OE1 no hydrogen 3.155 N/A ARG 62.A NH2 GLU 76.A OE2 no hydrogen 2.841 N/A ILE 63.A N LYS 77.A O no hydrogen 2.672 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.863 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 2.540 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 2.858 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 2.997 N/A HIS 66.A N GLU 72.A OE2 no hydrogen 3.056 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.641 N/A ARG 68.A N SER 150.A O no hydrogen 2.945 N/A ARG 68.A NE PRO 149.A O no hydrogen 2.534 N/A ARG 68.A NH2 PRO 149.A O no hydrogen 3.493 N/A ARG 70.A NH1 SER 67.A OG no hydrogen 3.276 N/A ARG 70.A NH1 SER 150.A OG no hydrogen 3.063 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.788 N/A ILE 75.A N GLU 72.A O no hydrogen 2.850 N/A GLU 76.A N GLU 72.A O no hydrogen 3.007 N/A LYS 77.A N ILE 63.A O no hydrogen 2.738 N/A SER 79.A N VAL 61.A O no hydrogen 2.659 N/A GLU 82.A N LYS 104.A O no hydrogen 2.619 N/A LYS 83.A N LYS 104.A O no hydrogen 3.363 N/A ILE 84.A N GLU 56.A OE1 no hydrogen 2.742 N/A TYR 85.A N LEU 102.A O no hydrogen 2.880 N/A HIS 87.A N ILE 100.A O no hydrogen 3.214 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.807 N/A TYR 90.A N HIS 87.A O no hydrogen 3.175 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.471 N/A ASN 91.A N ASP 97.A O no hydrogen 2.865 N/A ARG 93.A N ASN 91.A OD1 no hydrogen 3.164 N/A ASN 95.A ND2 ARG 172.A O no hydrogen 2.519 N/A LEU 96.A N ASN 91.A O no hydrogen 2.983 N/A ARG 98.A NH1 ARG 89.A O no hydrogen 2.552 N/A ILE 100.A N ARG 98.A O no hydrogen 2.936 N/A ALA 101.A N THR 40.A O no hydrogen 2.941 N/A LEU 102.A N TYR 85.A O no hydrogen 2.654 N/A MET 103.A N VAL 38.A O no hydrogen 2.895 N/A LYS 104.A N LYS 83.A O no hydrogen 2.911 N/A LYS 104.A NZ GLU 82.A OE1 no hydrogen 2.698 N/A LYS 104.A NZ GLU 82.A OE2 no hydrogen 2.641 N/A LEU 105.A N ARG 36.A O no hydrogen 2.738 N/A LYS 106.A N MET 80.A O no hydrogen 3.042 N/A VAL 109.A N ASP 35.A O no hydrogen 2.758 N/A SER 112.A N ILE 115.A O no hydrogen 2.942 N/A HIS 116.A N PRO 13.A O no hydrogen 3.060 N/A VAL 118.A N LEU 32.A O no hydrogen 3.106 N/A CYS 119.A N TRP 211.A O no hydrogen 3.166 N/A THR 125.A N ASP 122.A OD2 no hydrogen 3.359 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.665 N/A THR 125.A OG1 ASP 122.A OD2 no hydrogen 3.563 N/A ALA 126.A N ASP 122.A O no hydrogen 2.993 N/A LEU 130.A N ALA 126.A O no hydrogen 2.999 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.890 N/A GLN 131.A NE2 SER 128B.A O no hydrogen 2.356 N/A GLY 133.A N ILE 159.A O no hydrogen 2.656 N/A TYR 134.A N GLN 131.A O no hydrogen 2.765 N/A LYS 135.A NZ TYR 182A.A OH no hydrogen 3.439 N/A GLY 136.A N LEU 157.A O no hydrogen 3.190 N/A ARG 137.A N VAL 202.A O no hydrogen 2.958 N/A ARG 137.A NE ASN 156.A OD1 no hydrogen 3.041 N/A VAL 138.A N VAL 155.A O no hydrogen 2.819 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.456 N/A GLY 140.A N GLN 153.A O no hydrogen 3.209 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 3.004 N/A GLY 142.A N ASP 196.A OD1 no hydrogen 2.763 N/A ASN 143.A N GLU 194.A O no hydrogen 2.942 N/A LEU 144.A N GLY 147.A O no hydrogen 2.535 N/A LEU 152.A N HIS 66.A O no hydrogen 2.738 N/A GLN 153.A N GLY 140.A O no hydrogen 3.394 N/A VAL 154.A N SER 5.A O no hydrogen 2.941 N/A VAL 155.A N VAL 138.A O no hydrogen 3.109 N/A LEU 157.A N GLY 136.A O no hydrogen 2.922 N/A ILE 159.A N TYR 134.A O no hydrogen 2.849 N/A VAL 160.A N CYS 179.A O no hydrogen 3.162 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.558 N/A ARG 162.A NH1 MET 177.A O no hydrogen 2.141 N/A ARG 162.A NH2 MET 177.A O no hydrogen 2.727 N/A CYS 165.A N GLU 161.A O no hydrogen 3.032 N/A CYS 165.A SG VAL 160.A O no hydrogen 3.582 N/A CYS 165.A SG GLU 161.A O no hydrogen 3.453 N/A LYS 166.A N ARG 162.A O no hydrogen 2.865 N/A ASP 167.A N PRO 163.A O no hydrogen 2.951 N/A SER 168.A N CYS 165.A O no hydrogen 3.351 N/A SER 168.A OG CYS 165.A O no hydrogen 2.964 N/A THR 169.A N LYS 166.A O no hydrogen 3.263 N/A THR 169.A OG1 GLU 221.A OE1 no hydrogen 3.155 N/A ILE 171.A N THR 169.A OG1 no hydrogen 3.158 N/A ARG 172.A NE GLU 94A.A OE1 no hydrogen 3.289 N/A ARG 172.A NE GLU 94A.A OE2 no hydrogen 2.871 N/A ARG 172.A NH2 GLU 94A.A OE1 no hydrogen 2.972 N/A THR 174.A OG1 ASP 97.A OD1 no hydrogen 2.589 N/A ASN 176.A N THR 174.A OG1 no hydrogen 3.294 N/A ASN 176.A ND2 ASP 97.A OD1 no hydrogen 3.146 N/A PHE 178.A N TYR 232.A O no hydrogen 3.113 N/A ALA 180.A N GLY 230.A O no hydrogen 2.911 N/A GLY 181.A N PRO 158.A O no hydrogen 3.120 N/A LYS 183.A N GLU 186B.A OE1 no hydrogen 2.597 N/A LYS 183.A NZ GLU 161.A OE1 no hydrogen 2.543 N/A LYS 183.A NZ GLU 161.A OE2 no hydrogen 3.233 N/A ARG 189.A NE ASP 224.A OD2 no hydrogen 2.197 N/A ARG 189.A NH1 ASP 226.A OD2 no hydrogen 3.069 N/A ARG 189.A NH2 ASP 224.A O no hydrogen 2.094 N/A ARG 189.A NH2 ASP 226.A OD1 no hydrogen 3.098 N/A ARG 189.A NH2 ASP 226.A OD2 no hydrogen 3.489 N/A GLY 190.A N ASP 224.A OD1 no hydrogen 3.115 N/A ASP 191.A N VAL 2.A O no hydrogen 3.162 N/A ALA 192.A N ASP 191.A OD1 no hydrogen 2.833 N/A CYS 193.A N ASP 196.A OD2 no hydrogen 2.843 N/A CYS 193.A SG LYS 145.A O no hydrogen 3.853 N/A CYS 193.A SG GLU 194.A OE1 no hydrogen 3.519 N/A ASP 196.A N CYS 193.A O no hydrogen 2.965 N/A SER 197.A OG HIS 43.A NE2 no hydrogen 2.975 N/A GLY 198.A N VAL 217.A O no hydrogen 3.112 N/A GLY 199.A N ASP 196.A O no hydrogen 3.084 N/A PHE 201.A N GLY 215.A O no hydrogen 2.979 N/A VAL 202.A N ARG 137.A O no hydrogen 2.929 N/A MET 203.A N TYR 212.A O no hydrogen 2.947 N/A SER 205.A N ARG 210.A O no hydrogen 2.673 N/A ASN 209.A N SER 205.A O no hydrogen 2.852 N/A TYR 212.A N MET 203.A O no hydrogen 2.745 N/A TYR 212.A OH ASN 208B.A OD1 no hydrogen 2.851 N/A GLN 213.A N CYS 119.A O no hydrogen 2.796 N/A GLN 213.A NE2 GLY 215.A O no hydrogen 2.801 N/A MET 214.A N PHE 201.A O no hydrogen 2.852 N/A GLY 215.A N PHE 201.A O no hydrogen 3.178 N/A ILE 216.A N THR 233.A O no hydrogen 3.280 N/A VAL 217.A N GLY 199.A O no hydrogen 2.767 N/A SER 218.A N PHE 231.A O no hydrogen 2.976 N/A SER 218.A OG ASP 99.A OD2 no hydrogen 2.632 N/A TRP 219.A N PHE 231.A O no hydrogen 3.237 N/A CYS 223.A N GLU 146.A OE1 no hydrogen 3.401 N/A CYS 223.A SG GLU 194.A OE1 no hydrogen 3.404 N/A ASP 224.A N ASP 191.A OD2 no hydrogen 3.135 N/A LYS 228.A N ARG 225A.A O no hydrogen 3.288 N/A LYS 228.A NZ SER 168.A O no hydrogen 2.859 N/A LYS 228.A NZ GLU 221.A OE1 no hydrogen 2.803 N/A GLY 230.A N ALA 180.A O no hydrogen 3.193 N/A PHE 231.A N TRP 219.A O no hydrogen 2.999 N/A TYR 232.A N PHE 178.A O no hydrogen 2.912 N/A THR 233.A N ILE 216.A O no hydrogen 2.905 N/A THR 233.A OG1 ASP 99.A O no hydrogen 2.625 N/A HIS 234.A N ASN 176.A O no hydrogen 2.991 N/A VAL 235.A N MET 214.A O no hydrogen 3.287 N/A ARG 237.A N HIS 234.A ND1 no hydrogen 3.171 N/A ARG 237.A NE ASN 176.A OD1 no hydrogen 3.064 N/A ARG 237.A NH2 ASN 176.A OD1 no hydrogen 3.197 N/A LEU 238.A N VAL 235.A O no hydrogen 3.000 N/A LYS 239.A N PHE 236.A O no hydrogen 3.140 N/A LYS 239.A NZ PRO 121.A O no hydrogen 3.028 N/A LYS 239.A NZ GLN 243.A OE1 no hydrogen 3.526 N/A ILE 242.A N LEU 238.A O no hydrogen 3.245 N/A GLN 243.A N LYS 239.A O no hydrogen 2.608 N/A LYS 244.A N LYS 240.A O no hydrogen 2.920 N/A VAL 245.A N TRP 241.A O no hydrogen 3.067 N/A ILE 246.A N ILE 242.A O no hydrogen 3.206 N/A ASP 247.A N GLN 243.A O no hydrogen 3.136 N/A GLN 248.A N LYS 244.A O no hydrogen 3.251 N/A PHE 249.A N VAL 245.A O no hydrogen 2.878 N/A SER 22A.A OG LYS 21.A O no hydrogen 3.307 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.720 N/A ARG 73A.A N TYR 71.A O no hydrogen 2.856 N/A GLU 94A.A N ASN 91.A OD1 no hydrogen 3.113 N/A ALA 127A.A N ARG 123.A O no hydrogen 3.154 N/A TYR 182A.A OH ASN 156.A O no hydrogen 3.421 N/A PHE 207A.A N SER 205.A OG no hydrogen 3.125 N/A ARG 225A.A NE GLU 146.A OE1 no hydrogen 2.640 N/A ARG 225A.A NE GLU 146.A OE2 no hydrogen 2.935 N/A ARG 225A.A NH2 GLU 146.A OE2 no hydrogen 2.549 N/A SER 128B.A N GLU 124.A O no hydrogen 2.965 N/A SER 128B.A OG GLU 124.A O no hydrogen 2.614 N/A LEU 129C.A N THR 125.A O no hydrogen 2.985 N/A TRP 50D.A N TYR 47A.A O no hydrogen 3.025 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.641 N/A LYS 52F.A N TYR 47A.A O no hydrogen 3.025 N/A LYS 52F.A NZ HIS 43.A O no hydrogen 3.254 N/A PHE 54H.A N LEU 45.A O no hydrogen 2.537 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.576 N/A THR 55I.A OG1 ASP 58.A OD2 no hydrogen 2.862 N/A