Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ian_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLY 2.A O no hydrogen 3.218 N/A TYR 9.A N GLU 234.A O no hydrogen 2.872 N/A TYR 9.A OH ASP 154.A OD1 no hydrogen 2.571 N/A TYR 9.A OH THR 232.A OG1 no hydrogen 3.191 N/A LYS 10.A NZ ASP 12.A OD1 no hydrogen 2.524 N/A LYS 10.A NZ ASP 12.A OD2 no hydrogen 3.267 N/A TYR 13.A N SER 84.A OG no hydrogen 3.185 N/A GLU 15.A N LYS 82.A O no hydrogen 3.174 N/A CYS 19.A N GLU 56.A O no hydrogen 3.086 N/A ILE 20.A N VAL 87.A O no hydrogen 2.868 N/A ILE 21.A N ARG 58.A O no hydrogen 3.059 N/A ILE 22.A N VAL 89.A O no hydrogen 2.810 N/A ASN 23.A N LYS 60.A O no hydrogen 2.759 N/A ASN 23.A ND2 ASP 40.A OD1 no hydrogen 2.756 N/A ASN 24.A N LEU 91.A O no hydrogen 3.053 N/A ASN 24.A ND2 LEU 63.A O no hydrogen 3.127 N/A ASN 24.A ND2 PHE 100.A O no hydrogen 3.437 N/A LYS 25.A N ASP 62.A OD1 no hydrogen 2.883 N/A ASN 26.A N ASP 62.A OD1 no hydrogen 2.998 N/A ASN 26.A ND2 SER 35.A OG.A no hydrogen 2.747 N/A HIS 28.A N THR 102.A O no hydrogen 2.868 N/A THR 31.A N HIS 28.A O no hydrogen 3.110 N/A THR 31.A OG1 HIS 28.A O no hydrogen 2.796 N/A GLY 32.A N LYS 29.A O no hydrogen 3.102 N/A SER 35.A OG.A LYS 25.A O no hydrogen 3.120 N/A ARG 36.A N LYS 25.A O no hydrogen 2.865 N/A ARG 36.A NH1 ASN 24.A O no hydrogen 3.004 N/A ARG 36.A NH1 THR 39.A OG1 no hydrogen 3.167 N/A THR 39.A N ARG 36.A O no hydrogen 3.198 N/A THR 39.A OG1 ASN 23.A OD1 no hydrogen 2.523 N/A ASP 42.A N GLY 38.A O no hydrogen 3.486 N/A ALA 43.A N THR 39.A O no hydrogen 2.852 N/A ALA 44.A N ASP 40.A O no hydrogen 2.896 N/A ASN 45.A N VAL 41.A O no hydrogen 3.040 N/A LEU 46.A N ASP 42.A O no hydrogen 2.998 N/A ARG 47.A N ALA 43.A O no hydrogen 3.032 N/A ARG 47.A NH1 ASN 59.A OD1 no hydrogen 2.868 N/A GLU 48.A N ALA 44.A O no hydrogen 2.987 N/A THR 49.A N ASN 45.A O no hydrogen 2.721 N/A THR 49.A OG1 ASN 45.A O no hydrogen 2.955 N/A PHE 50.A N LEU 46.A O no hydrogen 2.705 N/A ARG 51.A N ARG 47.A O no hydrogen 2.876 N/A ARG 51.A NE GLU 48.A OE1 no hydrogen 3.369 N/A ARG 51.A NE GLU 48.A OE2 no hydrogen 3.159 N/A ARG 51.A NH2 GLU 48.A OE1 no hydrogen 2.924 N/A ASN 52.A N GLU 48.A O no hydrogen 3.165 N/A LEU 53.A N PHE 50.A O no hydrogen 3.185 N/A LYS 54.A N ARG 51.A O no hydrogen 2.888 N/A TYR 55.A N PHE 50.A O no hydrogen 3.178 N/A TYR 55.A OH SER 85.A OG no hydrogen 2.570 N/A GLU 56.A N GLY 17.A O no hydrogen 2.984 N/A ARG 58.A N CYS 19.A O no hydrogen 2.891 N/A ARG 58.A NE GLU 56.A OE2 no hydrogen 3.261 N/A ARG 58.A NH1 GLU 78.A OE2 no hydrogen 2.994 N/A ARG 58.A NH2 GLU 56.A OE2 no hydrogen 3.358 N/A ARG 58.A NH2 GLU 78.A OE1 no hydrogen 3.294 N/A LYS 60.A N ILE 21.A O no hydrogen 2.731 N/A ASP 62.A N ASN 23.A O no hydrogen 2.843 N/A LEU 63.A N ASN 24.A OD1 no hydrogen 2.691 N/A THR 64.A N GLU 67.A OE1 no hydrogen 2.744 N/A THR 64.A OG1 GLU 66.A OE1 no hydrogen 3.252 N/A THR 64.A OG1 GLU 67.A OE1 no hydrogen 3.269 N/A ARG 65.A N ASN 103.A OD1 no hydrogen 2.959 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.548 N/A GLU 67.A N THR 64.A OG1 no hydrogen 3.328 N/A ILE 68.A N THR 64.A O no hydrogen 2.767 N/A VAL 69.A N ARG 65.A O no hydrogen 3.417 N/A GLU 70.A N GLU 66.A O no hydrogen 2.902 N/A LEU 71.A N GLU 67.A O no hydrogen 2.814 N/A MET 72.A N ILE 68.A O no hydrogen 2.984 N/A ARG 73.A N VAL 69.A O no hydrogen 2.790 N/A ASP 74.A N GLU 70.A O no hydrogen 2.859 N/A VAL 75.A N LEU 71.A O no hydrogen 2.837 N/A SER 76.A N MET 72.A O no hydrogen 2.848 N/A SER 76.A OG MET 72.A O no hydrogen 3.425 N/A SER 76.A OG ARG 73.A O no hydrogen 2.979 N/A LYS 77.A N ARG 73.A O no hydrogen 3.253 N/A LYS 77.A N ASP 74.A O no hydrogen 3.153 N/A LYS 77.A NZ.A ARG 119.A O no hydrogen 3.376 N/A GLU 78.A N VAL 75.A O no hydrogen 3.419 N/A HIS 80.A N SER 122.A OG no hydrogen 2.764 N/A HIS 80.A NE2 VAL 75.A O no hydrogen 2.810 N/A SER 81.A N ASP 79.A OD1 no hydrogen 3.267 N/A SER 81.A OG ASP 79.A OD1 no hydrogen 2.425 N/A ARG 83.A N HIS 80.A O no hydrogen 2.852 N/A ARG 83.A NE GLU 15.A OE2 no hydrogen 3.424 N/A ARG 83.A NH1 GLU 78.A OE1 no hydrogen 3.474 N/A SER 84.A N GLU 15.A O no hydrogen 2.767 N/A SER 84.A OG GLU 15.A O no hydrogen 3.423 N/A SER 85.A N MET 16.A O no hydrogen 2.779 N/A SER 85.A OG MET 16.A O no hydrogen 2.963 N/A SER 85.A OG TYR 55.A OH no hydrogen 2.570 N/A PHE 86.A N PRO 127.A O no hydrogen 3.063 N/A VAL 87.A N LEU 18.A O no hydrogen 2.862 N/A CYS 88.A N LEU 129.A O no hydrogen 2.862 N/A VAL 89.A N ILE 20.A O no hydrogen 2.592 N/A LEU 90.A N ILE 131.A O.A no hydrogen 2.763 N/A LEU 90.A N ILE 131.A O.B no hydrogen 2.784 N/A LEU 91.A N ILE 22.A O no hydrogen 2.873 N/A SER 92.A N GLN 133.A O no hydrogen 3.001 N/A SER 92.A OG HIS 93.A O no hydrogen 3.519 N/A SER 92.A OG PHE 100.A O no hydrogen 2.660 N/A HIS 93.A NE2 THR 34.A O no hydrogen 3.042 N/A GLU 95.A N ILE 98.A O no hydrogen 3.267 N/A ILE 98.A N GLU 95.A O no hydrogen 2.889 N/A ILE 99.A N VAL 106.A O no hydrogen 2.813 N/A PHE 100.A N HIS 93.A O no hydrogen 3.114 N/A THR 102.A N LEU 63.A O no hydrogen 2.866 N/A THR 102.A OG1 LEU 63.A O no hydrogen 3.429 N/A ASN 103.A ND2 GLU 66.A OE1 no hydrogen 3.426 N/A GLY 104.A N GLY 101.A O no hydrogen 3.209 N/A VAL 106.A N ILE 99.A O no hydrogen 2.676 N/A LEU 108.A N GLY 97.A O no hydrogen 2.778 N/A THR 112.A N LEU 108.A O no hydrogen 2.896 N/A THR 112.A OG1 LEU 108.A O no hydrogen 3.463 N/A THR 112.A OG1 LYS 109.A O no hydrogen 3.212 N/A ASN 113.A N LYS 109.A O no hydrogen 2.775 N/A PHE 114.A N ILE 111.A O no hydrogen 3.168 N/A PHE 115.A N THR 112.A O no hydrogen 2.762 N/A ARG 116.A N ASN 113.A O no hydrogen 2.977 N/A ARG 116.A NE ASP 118.A OD1 no hydrogen 3.359 N/A ARG 116.A NH2 ASP 118.A OD2 no hydrogen 3.460 N/A GLY 117.A N VAL 151.A O no hydrogen 3.064 N/A ARG 119.A N ARG 116.A O no hydrogen 2.642 N/A CYS 120.A N ARG 116.A O no hydrogen 3.021 N/A CYS 120.A SG SER 76.A O no hydrogen 3.706 N/A LEU 123.A N CYS 120.A O no hydrogen 2.889 N/A THR 124.A N ARG 121.A O no hydrogen 2.862 N/A THR 124.A OG1 GLY 117.A O no hydrogen 2.627 N/A THR 124.A OG1 CYS 120.A O no hydrogen 3.566 N/A THR 124.A OG1 ARG 121.A O no hydrogen 3.002 N/A LYS 126.A N LEU 123.A O no hydrogen 2.964 N/A LYS 126.A NZ HIS 80.A O no hydrogen 2.831 N/A LYS 126.A NZ SER 81.A O no hydrogen 3.301 N/A LYS 126.A NZ ARG 83.A O no hydrogen 2.855 N/A LYS 126.A NZ SER 122.A O no hydrogen 3.037 N/A LYS 128.A N ASP 154.A O no hydrogen 2.848 N/A LYS 128.A NZ LEU 123.A O no hydrogen 2.869 N/A LYS 128.A NZ LYS 126.A O no hydrogen 3.167 N/A LEU 129.A N PHE 86.A O no hydrogen 2.634 N/A PHE 130.A N LEU 156.A O no hydrogen 2.870 N/A ILE 131.A N.A CYS 88.A O no hydrogen 2.772 N/A ILE 131.A N.B CYS 88.A O no hydrogen 2.775 N/A ILE 132.A N ALA 158.A O no hydrogen 3.066 N/A GLN 133.A N LEU 90.A O no hydrogen 2.906 N/A CYS 135.A SG GLY 137.A O no hydrogen 2.839 N/A CYS 135.A SG TYR 165.A O no hydrogen 3.660 N/A ARG 136.A N TYR 165.A O no hydrogen 2.958 N/A ARG 136.A NH1 THR 161.A O no hydrogen 3.011 N/A ARG 136.A NH2 GLU 96.A OE2 no hydrogen 3.267 N/A GLU 139.A N GLY 164.A O no hydrogen 3.078 N/A CYS 142.A SG.B GLY 143.A O no hydrogen 3.435 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.986 N/A LYS 148.A NZ HIS 147.A O no hydrogen 3.529 N/A ALA 153.A N PRO 150.A O no hydrogen 3.229 N/A ASP 154.A N MET 230.A O no hydrogen 3.024 N/A LEU 156.A N LYS 128.A O no hydrogen 2.961 N/A TYR 157.A N ASN 228.A O no hydrogen 2.722 N/A ALA 158.A N PHE 130.A O no hydrogen 2.849 N/A TYR 159.A N CYS 226.A O no hydrogen 2.643 N/A SER 160.A N ILE 132.A O no hydrogen 3.044 N/A SER 160.A OG ALA 134.A O no hydrogen 3.491 N/A SER 160.A OG SER 167.A OG no hydrogen 2.357 N/A THR 161.A OG1 TYR 166.A O no hydrogen 2.921 N/A TYR 165.A N ALA 162.A O no hydrogen 3.151 N/A TYR 166.A N GLU 139.A O no hydrogen 2.893 N/A SER 167.A OG SER 160.A OG no hydrogen 2.357 N/A TRP 168.A N GLN 223.A OE1 no hydrogen 2.810 N/A ARG 169.A NH2 SER 37.A O no hydrogen 2.540 N/A ASN 170.A N GLY 174.A O no hydrogen 3.008 N/A LYS 172.A N ASN 170.A OD1 no hydrogen 2.801 N/A ASP 173.A N ASN 170.A OD1 no hydrogen 2.859 N/A GLY 174.A N ASN 170.A O no hydrogen 2.935 N/A SER 175.A N ASP 42.A OD1 no hydrogen 2.973 N/A SER 175.A N ASP 42.A OD2 no hydrogen 2.938 N/A SER 175.A OG ASP 42.A OD2 no hydrogen 2.776 N/A ILE 178.A N SER 175.A OG no hydrogen 3.246 N/A GLN 179.A N SER 175.A O no hydrogen 2.903 N/A GLN 179.A NE2 GLY 174.A O no hydrogen 2.781 N/A SER 180.A N TRP 176.A O no hydrogen 3.118 N/A SER 180.A OG TRP 176.A O no hydrogen 2.730 N/A LEU 181.A N PHE 177.A O no hydrogen 2.776 N/A CYS 182.A N ILE 178.A O no hydrogen 2.936 N/A CYS 182.A SG ILE 178.A O no hydrogen 3.310 N/A ALA 183.A N GLN 179.A O no hydrogen 2.990 N/A MET 184.A N SER 180.A O no hydrogen 2.938 N/A LEU 185.A N LEU 181.A O no hydrogen 3.044 N/A LYS 186.A N CYS 182.A O no hydrogen 2.993 N/A GLN 187.A N ALA 183.A O no hydrogen 3.084 N/A TYR 188.A N MET 184.A O no hydrogen 3.063 N/A TYR 188.A N LEU 185.A O no hydrogen 3.204 N/A ALA 189.A N LEU 185.A O no hydrogen 2.916 N/A ASP 190.A N ASP 190.A OD1 no hydrogen 2.581 N/A LYS 191.A N TYR 188.A O no hydrogen 2.991 N/A LEU 192.A N TYR 188.A O no hydrogen 2.890 N/A PHE 194.A N LEU 235.A O no hydrogen 2.866 N/A ILE 197.A N GLU 193.A O no hydrogen 3.099 N/A LEU 198.A N PHE 194.A O no hydrogen 2.909 N/A THR 199.A N MET 195.A O no hydrogen 3.003 N/A THR 199.A OG1 MET 195.A O no hydrogen 3.018 N/A ARG 200.A N HIS 196.A O no hydrogen 3.243 N/A VAL 201.A N ILE 197.A O no hydrogen 2.831 N/A ASN 202.A N LEU 198.A O no hydrogen 2.637 N/A ARG 203.A N THR 199.A O no hydrogen 3.003 N/A LYS 204.A N ARG 200.A O no hydrogen 2.878 N/A LYS 204.A NZ.B GLU 208.A OE1 no hydrogen 3.082 N/A VAL 205.A N VAL 201.A O no hydrogen 2.975 N/A ALA 206.A N ASN 202.A O no hydrogen 2.872 N/A THR 207.A N ARG 203.A O no hydrogen 2.825 N/A THR 207.A N LYS 204.A O no hydrogen 3.057 N/A THR 207.A OG1 ARG 203.A O no hydrogen 2.430 N/A THR 207.A OG1 LYS 204.A O no hydrogen 3.458 N/A GLU 208.A N LYS 204.A O no hydrogen 2.815 N/A SER 211.A N LYS 221.A O no hydrogen 2.985 N/A SER 211.A OG PHE 218.A O no hydrogen 2.755 N/A SER 213.A N HIS 219.A ND1 no hydrogen 3.460 N/A SER 213.A OG ASP 215.A O no hydrogen 3.319 N/A ASP 215.A N SER 213.A OG no hydrogen 2.771 N/A THR 217.A N ASP 215.A OD1 no hydrogen 3.097 N/A THR 217.A OG1 ASP 215.A OD1 no hydrogen 3.445 N/A PHE 218.A N ASP 215.A O no hydrogen 2.829 N/A HIS 219.A N ALA 216.A O no hydrogen 3.439 N/A ALA 220.A N SER 211.A O no hydrogen 3.104 N/A LYS 221.A N SER 211.A OG no hydrogen 2.949 N/A LYS 222.A N ASP 141.A O no hydrogen 2.732 N/A LYS 222.A NZ ALA 206.A O no hydrogen 3.135 N/A LYS 222.A NZ PHE 209.A O no hydrogen 2.451 N/A GLN 223.A NE2 SER 160.A O no hydrogen 2.339 N/A CYS 226.A N TYR 159.A O no hydrogen 2.860 N/A CYS 226.A SG ASN 228.A OD1 no hydrogen 3.274 N/A ASN 228.A N TYR 157.A O no hydrogen 2.729 N/A MET 230.A N PHE 155.A O no hydrogen 2.905 N/A LEU 231.A N SER 229.A OG no hydrogen 3.235 N/A THR 232.A N TYR 9.A OH no hydrogen 2.886 N/A THR 232.A OG1 TYR 9.A OH no hydrogen 3.191 N/A THR 232.A OG1 ASP 154.A OD1 no hydrogen 2.635 N/A GLU 234.A N ASN 7.A O no hydrogen 2.992 N/A LEU 235.A N GLU 193.A OE2 no hydrogen 3.047 N/A TYR 236.A OH GLU 234.A OE1 no hydrogen 3.121 N/A