Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cir_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ TYR 30.A O no hydrogen 3.437 N/A LEU 6.A N VAL 28.A O no hydrogen 2.670 N/A ILE 8.A N TYR 26.A O no hydrogen 2.706 N/A GLU 9.A N MET 88.A O no hydrogen 3.183 N/A VAL 10.A N ALA 24.A O no hydrogen 2.731 N/A VAL 11.A N VAL 90.A O no hydrogen 3.100 N/A ARG 12.A N HIS 22.A O no hydrogen 3.132 N/A ARG 12.A NE ASP 101.A OD1 no hydrogen 2.086 N/A ARG 12.A NH1 TYR 26.A OH no hydrogen 3.453 N/A ARG 12.A NH2 ASP 50.A OD2 no hydrogen 3.311 N/A ARG 12.A NH2 ASP 101.A OD2 no hydrogen 2.954 N/A TYR 13.A N ASP 101.A OD1 no hydrogen 3.252 N/A ASN 14.A N ASP 18.A OD1 no hydrogen 3.161 N/A GLU 16.A N ASN 14.A OD1 no hydrogen 2.804 N/A VAL 17.A N ASN 14.A O no hydrogen 3.000 N/A ASP 18.A N ASN 14.A O no hydrogen 2.745 N/A HIS 22.A N ARG 12.A O no hydrogen 3.049 N/A SER 23.A OG GLU 9.A OE2 no hydrogen 2.673 N/A ALA 24.A N VAL 10.A O no hydrogen 2.795 N/A TYR 26.A N ILE 8.A O no hydrogen 2.759 N/A VAL 28.A N LEU 6.A O no hydrogen 2.734 N/A ASP 31.A N THR 34.A OG1 no hydrogen 3.373 N/A THR 33.A N ASP 31.A OD2 no hydrogen 2.701 N/A THR 33.A OG1 ASP 31.A OD1 no hydrogen 2.962 N/A THR 33.A OG1 ASP 31.A OD2 no hydrogen 2.839 N/A THR 34.A N ASP 31.A O no hydrogen 3.047 N/A THR 34.A OG1 ASP 31.A OD2 no hydrogen 2.821 N/A SER 35.A OG ASP 38.A OD2 no hydrogen 2.325 N/A LEU 36.A N THR 79.A O no hydrogen 2.575 N/A LEU 37.A N ALA 76.A O no hydrogen 3.185 N/A ASP 38.A N SER 35.A OG no hydrogen 3.332 N/A ALA 39.A N SER 35.A O no hydrogen 2.747 N/A LEU 40.A N LEU 36.A O no hydrogen 2.768 N/A GLY 41.A N LEU 37.A O no hydrogen 3.132 N/A TYR 42.A N ASP 38.A O no hydrogen 3.199 N/A ILE 43.A N ALA 39.A O no hydrogen 3.421 N/A LYS 44.A N LEU 40.A O no hydrogen 3.255 N/A LYS 44.A NZ PRO 49.A O no hydrogen 2.419 N/A LYS 44.A NZ LEU 51.A O no hydrogen 2.811 N/A ASP 45.A N GLY 41.A O no hydrogen 3.073 N/A ASN 46.A N TYR 42.A O no hydrogen 2.948 N/A ASN 46.A N ILE 43.A O no hydrogen 2.887 N/A LEU 47.A N ILE 43.A O no hydrogen 2.579 N/A ALA 48.A N ILE 43.A O no hydrogen 3.154 N/A LEU 51.A N ALA 48.A O no hydrogen 3.051 N/A SER 52.A OG ASP 50.A O no hydrogen 3.378 N/A ARG 54.A NH1 VAL 104.A O no hydrogen 2.687 N/A ARG 54.A NH2 VAL 104.A O no hydrogen 2.785 N/A CYS 62.A SG SER 64.A OG no hydrogen 2.900 N/A MET 67.A N LYS 74.A O no hydrogen 2.962 N/A MET 68.A N GLU 91.A O no hydrogen 2.663 N/A VAL 69.A N VAL 72.A O no hydrogen 2.851 N/A ASN 70.A N LYS 89.A O no hydrogen 2.773 N/A ASN 70.A ND2 GLY 87.A O no hydrogen 3.455 N/A VAL 72.A N VAL 69.A O no hydrogen 3.040 N/A LYS 74.A N MET 67.A O no hydrogen 2.889 N/A LYS 78.A N LEU 75.A O no hydrogen 3.058 N/A THR 79.A N ALA 76.A O no hydrogen 3.005 N/A THR 79.A OG1 LEU 75.A O no hydrogen 2.572 N/A ASP 83.A N PHE 80.A O no hydrogen 3.128 N/A TYR 84.A N LEU 81.A O no hydrogen 2.727 N/A GLY 87.A N TYR 84.A O no hydrogen 3.248 N/A LYS 89.A N ASN 70.A OD1 no hydrogen 3.080 N/A LYS 89.A NZ GLU 91.A OE1 no hydrogen 3.153 N/A VAL 90.A N GLU 9.A O no hydrogen 3.061 N/A GLU 91.A N MET 68.A O no hydrogen 2.827 N/A ASN 95.A ND2 TYR 155.A O no hydrogen 3.265 N/A GLU 99.A N VAL 103.A O no hydrogen 3.268 N/A ARG 100.A N VAL 103.A O no hydrogen 3.385 N/A ARG 100.A NE ASP 101.A OD2 no hydrogen 2.129 N/A ARG 100.A NH2 ASP 50.A O no hydrogen 2.328 N/A ASP 101.A N TYR 13.A O no hydrogen 2.893 N/A LEU 102.A N SER 52.A O no hydrogen 3.388 N/A VAL 103.A N ARG 100.A O no hydrogen 2.731 N/A ASP 105.A N PRO 97.A O no hydrogen 3.424 N/A THR 107.A N ASP 105.A OD1 no hydrogen 2.878 N/A THR 107.A OG1 ASP 105.A OD1 no hydrogen 3.011 N/A HIS 108.A NE2 PHE 167.A O no hydrogen 3.240 N/A ILE 110.A N MET 106.A O no hydrogen 3.204 N/A GLU 111.A N THR 107.A O no hydrogen 2.955 N/A SER 112.A N HIS 108.A O no hydrogen 2.863 N/A SER 112.A OG HIS 108.A O no hydrogen 3.159 N/A SER 112.A OG ILE 168.A O no hydrogen 2.774 N/A LEU 113.A N PHE 109.A O no hydrogen 3.187 N/A GLU 114.A N ILE 110.A O no hydrogen 2.929 N/A ALA 115.A N GLU 111.A O no hydrogen 2.826 N/A LYS 117.A N GLU 114.A O no hydrogen 3.103 N/A TYR 119.A N LYS 117.A O no hydrogen 2.880 N/A ASN 123.A ND2 ASN 132.A OD1 no hydrogen 3.345 N/A ASN 123.A ND2 ARG 184.A O no hydrogen 3.234 N/A ARG 125.A N ASN 123.A OD1 no hydrogen 2.948 N/A ARG 125.A NE GLY 130.A O no hydrogen 2.675 N/A ARG 125.A NH2 THR 131.A O no hydrogen 3.169 N/A THR 126.A OG1 ASP 128.A OD1 no hydrogen 3.010 N/A THR 126.A OG1 ASP 128.A OD2 no hydrogen 3.063 N/A GLY 130.A N ALA 127.A O no hydrogen 3.135 N/A GLN 134.A NE2 TYR 142.A OH no hydrogen 2.847 N/A THR 135.A N GLN 138.A OE1 no hydrogen 2.635 N/A GLN 138.A N THR 135.A OG1 no hydrogen 3.123 N/A MET 139.A N THR 135.A O no hydrogen 2.907 N/A ALA 140.A N PRO 136.A O no hydrogen 2.722 N/A LYS 141.A N GLN 138.A O no hydrogen 3.128 N/A HIS 143.A N MET 139.A O no hydrogen 2.964 N/A GLN 144.A NE2 HIS 217.A O no hydrogen 3.107 N/A SER 146.A N HIS 143.A O no hydrogen 2.975 N/A SER 146.A OG HIS 143.A O no hydrogen 2.361 N/A GLY 147.A N GLN 144.A O no hydrogen 3.336 N/A CYS 148.A SG ASN 150.A OD1 no hydrogen 4.032 N/A TYR 155.A N GLY 152.A O no hydrogen 3.138 N/A TYR 155.A OH ILE 168.A O no hydrogen 2.897 N/A ALA 156.A N GLY 152.A O no hydrogen 3.440 N/A ALA 157.A N CYS 154.A O no hydrogen 3.043 N/A CYS 158.A N CYS 154.A O no hydrogen 3.150 N/A PHE 161.A N CYS 158.A O no hydrogen 2.991 N/A GLY 162.A N CYS 158.A O no hydrogen 3.168 N/A LEU 163.A N PRO 159.A O no hydrogen 2.886 N/A LEU 163.A N GLN 160.A O no hydrogen 3.233 N/A ASN 164.A ND2 ASN 199.A OD1 no hydrogen 3.010 N/A GLU 166.A N ASN 164.A OD1 no hydrogen 3.137 N/A PHE 167.A N ASN 164.A O no hydrogen 2.919 N/A ILE 168.A N ASN 199.A O no hydrogen 2.894 N/A ALA 172.A N TYR 155.A OH no hydrogen 2.950 N/A ILE 173.A N GLY 169.A O no hydrogen 3.080 N/A THR 174.A N PRO 170.A O no hydrogen 2.671 N/A THR 174.A OG1 PRO 170.A O no hydrogen 2.995 N/A LEU 175.A N ALA 171.A O no hydrogen 2.689 N/A ALA 176.A N ALA 172.A O no hydrogen 3.050 N/A HIS 177.A N ILE 173.A O no hydrogen 2.867 N/A HIS 177.A NE2 GLN 226.A OE1 no hydrogen 3.038 N/A ARG 178.A N THR 174.A O no hydrogen 2.837 N/A TYR 179.A N LEU 175.A O no hydrogen 3.371 N/A ASN 180.A N ALA 176.A O no hydrogen 2.834 N/A GLU 181.A N HIS 177.A O no hydrogen 2.949 N/A ASP 182.A N TYR 179.A O no hydrogen 3.263 N/A SER 183.A OG GLN 134.A OE1 no hydrogen 3.131 N/A ARG 184.A N ASP 182.A OD2 no hydrogen 3.225 N/A ARG 184.A NE ASP 182.A OD2 no hydrogen 3.190 N/A ARG 184.A NH2 ASP 182.A OD1 no hydrogen 2.956 N/A ASP 185.A N ASP 182.A O no hydrogen 2.646 N/A HIS 186.A N ILE 121.A O no hydrogen 3.194 N/A GLY 187.A N ASP 185.A OD1 no hydrogen 2.627 N/A GLU 190.A N GLY 187.A O no hydrogen 3.022 N/A ARG 191.A N LYS 188.A O no hydrogen 2.996 N/A ARG 191.A NE LYS 117.A O no hydrogen 3.022 N/A ARG 191.A NH1 ASN 180.A OD1 no hydrogen 3.358 N/A ARG 191.A NH1 ASP 185.A OD1 no hydrogen 3.289 N/A ARG 191.A NH1 ASP 185.A OD2 no hydrogen 3.318 N/A ARG 191.A NH2 TYR 119.A O no hydrogen 2.885 N/A ARG 191.A NH2 ASP 185.A OD2 no hydrogen 2.648 N/A MET 192.A N LYS 188.A O no hydrogen 3.175 N/A LEU 195.A N ARG 191.A O no hydrogen 3.331 N/A ASN 196.A N MET 192.A O no hydrogen 2.875 N/A ASN 196.A ND2 ASP 234.A OD1 no hydrogen 3.376 N/A SER 197.A N GLN 194.A O no hydrogen 3.062 N/A SER 197.A OG GLN 194.A O no hydrogen 2.652 N/A GLY 200.A N SER 197.A O no hydrogen 2.949 N/A VAL 201.A N LEU 195.A O no hydrogen 3.106 N/A SER 203.A OG GLN 198.A O no hydrogen 2.240 N/A CYS 204.A N VAL 201.A O no hydrogen 3.372 N/A SER 211.A OG ASP 219.A OD1 no hydrogen 2.491 N/A VAL 213.A N TYR 209.A O no hydrogen 3.005 N/A VAL 213.A N CYS 210.A O no hydrogen 2.755 N/A CYS 214.A N CYS 210.A O no hydrogen 3.237 N/A LYS 216.A NZ ALA 60.A O no hydrogen 3.006 N/A ALA 221.A N SER 211.A OG no hydrogen 2.732 N/A ALA 222.A N ASP 219.A O no hydrogen 3.140 N/A ALA 222.A N ASP 219.A OD1 no hydrogen 3.317 N/A ILE 224.A N PRO 220.A O no hydrogen 2.702 N/A GLN 225.A N ALA 221.A O no hydrogen 2.817 N/A GLN 226.A N ALA 222.A O no hydrogen 2.580 N/A GLY 227.A N ALA 223.A O no hydrogen 2.480 N/A LYS 228.A N ILE 224.A O no hydrogen 2.737 N/A LYS 228.A NZ CYS 204.A O no hydrogen 2.682 N/A VAL 229.A N GLN 225.A O no hydrogen 3.212 N/A GLU 230.A N GLN 226.A O no hydrogen 3.230 N/A SER 231.A N GLY 227.A O no hydrogen 2.903 N/A SER 231.A OG ASN 196.A OD1 no hydrogen 2.444 N/A SER 232.A N LYS 228.A O no hydrogen 2.517 N/A SER 232.A OG LYS 228.A O no hydrogen 2.734 N/A LYS 233.A N VAL 229.A O no hydrogen 2.918 N/A ASP 234.A N GLU 230.A O no hydrogen 2.697 N/A PHE 235.A N SER 231.A O no hydrogen 2.805 N/A ILE 237.A N LYS 233.A O no hydrogen 3.323 N/A ALA 238.A N ASP 234.A O no hydrogen 3.045 N/A THR 239.A N PHE 235.A O no hydrogen 3.104 N/A THR 239.A N LEU 236.A O no hydrogen 2.884 N/A THR 239.A OG1 PHE 235.A O no hydrogen 3.174 N/A LEU 240.A N ILE 237.A O no hydrogen 2.521 N/A LYS 241.A N ALA 238.A O no hydrogen 3.207 N/A