Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a4w_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 142.A O no hydrogen 3.441 N/A ILE 1.A N ASN 143.A O no hydrogen 2.983 N/A ILE 1.A N ASP 196.A OD1 no hydrogen 3.566 N/A ILE 1.A N ASP 196.A OD2 no hydrogen 2.484 N/A VAL 2.A N ASP 191.A O no hydrogen 2.826 N/A SER 5.A N VAL 154.A O no hydrogen 2.860 N/A ALA 7.A N LEU 152.A O no hydrogen 2.715 N/A MET 11.A N GLU 8.A O no hydrogen 3.093 N/A GLN 15.A N SER 12.A O no hydrogen 2.967 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.382 N/A VAL 16.A N ALA 30.A O no hydrogen 2.985 N/A MET 17.A N ARG 62.A O no hydrogen 2.865 N/A LEU 18.A N CYS 28.A O no hydrogen 2.763 N/A PHE 19.A N LEU 60.A O no hydrogen 2.961 N/A ARG 20.A N GLU 25.A O no hydrogen 2.713 N/A ARG 20.A NH1 GLU 25.A OE2 no hydrogen 3.046 N/A LYS 21.A N ASP 58.A O no hydrogen 3.254 N/A LYS 21.A NZ ASN 57.A O no hydrogen 2.883 N/A GLN 24.A NE2 LYS 21.A O no hydrogen 3.327 N/A LEU 27.A N LEU 18.A O no hydrogen 2.512 N/A CYS 28.A N LEU 18.A O no hydrogen 3.375 N/A CYS 28.A SG LEU 27.A O no hydrogen 3.021 N/A GLY 29.A N SER 197.A O no hydrogen 2.788 N/A SER 31.A N LEU 39.A O no hydrogen 2.836 N/A SER 31.A OG GLN 213.A OE1 no hydrogen 2.550 N/A LEU 32.A N TRP 14.A O no hydrogen 2.876 N/A ILE 33.A N TRP 37.A O no hydrogen 3.141 N/A SER 34.A OG ASP 35.A OD1 no hydrogen 3.507 N/A ARG 36.A N SER 34.A OG no hydrogen 3.169 N/A ARG 36.A NH1 GLU 82.A OE1 no hydrogen 2.282 N/A VAL 38.A N MET 103.A O no hydrogen 2.733 N/A LEU 39.A N SER 31.A O no hydrogen 2.795 N/A THR 40.A N ALA 101.A O no hydrogen 3.027 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.861 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.917 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.789 N/A HIS 43.A NE2 SER 197.A OG no hydrogen 2.630 N/A CYS 44.A N ALA 41.A O no hydrogen 3.138 N/A LEU 45.A N ALA 42.A O no hydrogen 2.996 N/A LEU 46.A N ALA 42.A O no hydrogen 2.826 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.993 N/A ASP 58.A N THR 55I.A O no hydrogen 2.956 N/A LEU 59.A N GLU 56.A O no hydrogen 3.384 N/A LEU 60.A N PHE 19.A O no hydrogen 2.969 N/A VAL 61.A N SER 79.A O no hydrogen 2.958 N/A ARG 62.A N MET 17.A O no hydrogen 2.974 N/A ARG 62.A NE GLU 76.A OE2 no hydrogen 2.754 N/A ARG 62.A NH2 GLU 76.A OE1 no hydrogen 2.919 N/A ARG 62.A NH2 GLU 76.A OE2 no hydrogen 3.132 N/A ILE 63.A N LYS 77.A O no hydrogen 2.834 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.647 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 2.650 N/A LYS 65.A NZ GLU 76.A OE1 no hydrogen 2.824 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 2.899 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.868 N/A ARG 68.A N SER 150.A O no hydrogen 2.752 N/A ARG 68.A NE PRO 149.A O no hydrogen 2.722 N/A ARG 70.A N SER 67.A OG no hydrogen 3.304 N/A GLU 72.A N GLU 76.A OE1 no hydrogen 2.805 N/A ILE 75.A N GLU 72.A O no hydrogen 2.786 N/A GLU 76.A N GLU 72.A O no hydrogen 2.992 N/A LYS 77.A N ILE 63.A O no hydrogen 2.898 N/A LYS 77.A NZ ILE 75.A O no hydrogen 3.403 N/A LYS 77.A NZ GLU 76.A O no hydrogen 3.457 N/A SER 79.A N VAL 61.A O no hydrogen 2.723 N/A GLU 82.A N LYS 104.A O no hydrogen 2.712 N/A LYS 83.A N LYS 104.A O no hydrogen 3.473 N/A ILE 84.A N GLU 56.A OE2 no hydrogen 2.820 N/A TYR 85.A N LEU 102.A O no hydrogen 2.754 N/A HIS 87.A N ILE 100.A O no hydrogen 3.247 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.870 N/A TYR 90.A N HIS 87.A O no hydrogen 3.087 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.583 N/A ASN 91.A N ASP 97.A O no hydrogen 2.885 N/A ASN 91.A ND2 GLU 94A.A OE1 no hydrogen 3.097 N/A ARG 98.A NH1 ARG 89.A O no hydrogen 2.905 N/A ALA 101.A N THR 40.A O no hydrogen 2.850 N/A LEU 102.A N TYR 85.A O no hydrogen 2.752 N/A MET 103.A N VAL 38.A O no hydrogen 3.025 N/A LYS 104.A N LYS 83.A O no hydrogen 3.000 N/A LYS 104.A NZ GLU 82.A OE2 no hydrogen 3.568 N/A LEU 105.A N ARG 36.A O no hydrogen 2.804 N/A LYS 106.A N MET 80.A O no hydrogen 2.817 N/A VAL 109.A N ASP 35.A O no hydrogen 2.721 N/A SER 112.A N ILE 115.A O no hydrogen 2.983 N/A TYR 114.A N SER 112.A OG no hydrogen 2.937 N/A ILE 115.A N SER 112.A O no hydrogen 3.456 N/A HIS 116.A N PRO 13.A O no hydrogen 3.125 N/A VAL 118.A N LEU 32.A O no hydrogen 3.047 N/A CYS 119.A N TRP 211.A O no hydrogen 3.119 N/A ALA 126.A N ASP 122.A O no hydrogen 2.886 N/A LEU 130.A N ALA 126.A O no hydrogen 2.920 N/A GLN 131.A N LEU 129C.A O no hydrogen 3.002 N/A GLN 131.A NE2 SER 128B.A O no hydrogen 3.165 N/A GLY 133.A N ILE 159.A O no hydrogen 2.688 N/A TYR 134.A N GLN 131.A O no hydrogen 3.067 N/A LYS 135.A NZ TYR 182A.A OH no hydrogen 3.389 N/A GLY 136.A N LEU 157.A O no hydrogen 2.905 N/A ARG 137.A N VAL 202.A O no hydrogen 2.687 N/A ARG 137.A NE ASN 156.A OD1 no hydrogen 3.192 N/A VAL 138.A N VAL 155.A O no hydrogen 2.912 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.495 N/A GLY 140.A N GLN 153.A O no hydrogen 3.044 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 2.962 N/A GLY 142.A N ASP 196.A OD1 no hydrogen 2.812 N/A ASN 143.A N GLU 194.A O no hydrogen 2.829 N/A LEU 144.A N GLY 147.A O no hydrogen 3.097 N/A LEU 152.A N HIS 66.A O no hydrogen 2.825 N/A GLN 153.A N GLY 140.A O no hydrogen 3.129 N/A VAL 154.A N SER 5.A O no hydrogen 2.703 N/A VAL 155.A N VAL 138.A O no hydrogen 3.130 N/A LEU 157.A N GLY 136.A O no hydrogen 2.812 N/A ILE 159.A N TYR 134.A O no hydrogen 2.838 N/A VAL 160.A N CYS 179.A O no hydrogen 3.254 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.604 N/A ARG 162.A NH1 THR 174.A O no hydrogen 2.733 N/A ARG 162.A NH2 THR 174.A O no hydrogen 2.920 N/A CYS 165.A N GLU 161.A O no hydrogen 2.954 N/A CYS 165.A SG VAL 160.A O no hydrogen 3.616 N/A CYS 165.A SG GLU 161.A O no hydrogen 3.509 N/A LYS 166.A N ARG 162.A O no hydrogen 2.755 N/A ASP 167.A N PRO 163.A O no hydrogen 2.892 N/A SER 168.A N CYS 165.A O no hydrogen 3.251 N/A SER 168.A OG CYS 165.A O no hydrogen 2.739 N/A THR 169.A N LYS 166.A O no hydrogen 3.508 N/A THR 169.A OG1 GLU 221.A OE2 no hydrogen 2.795 N/A ILE 171.A N THR 169.A OG1 no hydrogen 3.004 N/A ARG 172.A NE GLU 94A.A OE2 no hydrogen 2.811 N/A ARG 172.A NH2 GLU 94A.A OE1 no hydrogen 2.954 N/A ARG 172.A NH2 GLU 94A.A OE2 no hydrogen 3.317 N/A THR 174.A OG1 ASP 97.A OD1 no hydrogen 2.545 N/A ASN 176.A N THR 174.A OG1 no hydrogen 3.056 N/A ASN 176.A ND2 ASP 97.A OD1 no hydrogen 2.806 N/A ASN 176.A ND2 ASP 97.A OD2 no hydrogen 3.504 N/A MET 177.A N THR 174.A O no hydrogen 3.372 N/A PHE 178.A N TYR 232.A O no hydrogen 3.133 N/A ALA 180.A N GLY 230.A O no hydrogen 2.964 N/A GLY 181.A N PRO 158.A O no hydrogen 3.012 N/A LYS 183.A N GLU 186B.A OE1 no hydrogen 2.448 N/A LYS 183.A NZ GLU 161.A OE1 no hydrogen 3.088 N/A LYS 183.A NZ GLU 161.A OE2 no hydrogen 3.202 N/A ARG 189.A NE ASP 224.A OD2 no hydrogen 2.449 N/A ARG 189.A NH1 ASP 226.A OD1 no hydrogen 2.926 N/A ARG 189.A NH2 ASP 224.A O no hydrogen 2.418 N/A ARG 189.A NH2 ASP 226.A OD1 no hydrogen 2.839 N/A GLY 190.A N ASP 224.A OD1 no hydrogen 2.832 N/A ASP 191.A N VAL 2.A O no hydrogen 3.266 N/A ALA 192.A N ASP 191.A OD1 no hydrogen 2.797 N/A CYS 193.A N ASP 196.A OD2 no hydrogen 2.833 N/A CYS 193.A SG LYS 145.A O no hydrogen 3.607 N/A ASP 196.A N CYS 193.A O no hydrogen 2.910 N/A SER 197.A OG HIS 43.A NE2 no hydrogen 2.630 N/A GLY 198.A N VAL 217.A O no hydrogen 3.021 N/A GLY 199.A N ASP 196.A O no hydrogen 3.035 N/A PHE 201.A N GLY 215.A O no hydrogen 2.824 N/A VAL 202.A N ARG 137.A O no hydrogen 2.830 N/A MET 203.A N TYR 212.A O no hydrogen 3.040 N/A SER 205.A N ARG 210.A O no hydrogen 2.823 N/A ASN 209.A N SER 205.A O no hydrogen 2.815 N/A TYR 212.A N MET 203.A O no hydrogen 2.838 N/A TYR 212.A OH ASN 208B.A OD1 no hydrogen 3.051 N/A GLN 213.A N CYS 119.A O no hydrogen 2.925 N/A GLN 213.A NE2 GLY 215.A O no hydrogen 2.953 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 3.093 N/A ILE 216.A N THR 233.A O no hydrogen 3.272 N/A VAL 217.A N GLY 199.A O no hydrogen 2.772 N/A SER 218.A N PHE 231.A O no hydrogen 2.863 N/A SER 218.A OG ASP 99.A OD2 no hydrogen 2.574 N/A CYS 223.A N GLU 146.A OE1 no hydrogen 3.318 N/A ASP 224.A N ASP 191.A OD2 no hydrogen 2.974 N/A LYS 228.A N ARG 225A.A O no hydrogen 3.261 N/A LYS 228.A NZ SER 168.A O no hydrogen 2.850 N/A LYS 228.A NZ GLU 221.A OE1 no hydrogen 2.420 N/A GLY 230.A N ALA 180.A O no hydrogen 3.146 N/A PHE 231.A N TRP 219.A O no hydrogen 2.808 N/A TYR 232.A N PHE 178.A O no hydrogen 2.981 N/A THR 233.A N ILE 216.A O no hydrogen 2.853 N/A THR 233.A OG1 ASP 99.A O no hydrogen 2.745 N/A HIS 234.A N ASN 176.A O no hydrogen 2.940 N/A VAL 235.A N MET 214.A O no hydrogen 3.177 N/A ARG 237.A N HIS 234.A ND1 no hydrogen 3.308 N/A ARG 237.A NH1 ASN 176.A OD1 no hydrogen 3.443 N/A LEU 238.A N VAL 235.A O no hydrogen 3.113 N/A LYS 239.A N PHE 236.A O no hydrogen 3.070 N/A LYS 239.A NZ PRO 121.A O no hydrogen 3.051 N/A ILE 242.A N LEU 238.A O no hydrogen 3.214 N/A GLN 243.A N LYS 239.A O no hydrogen 3.054 N/A LYS 244.A N LYS 240.A O no hydrogen 2.998 N/A VAL 245.A N TRP 241.A O no hydrogen 2.985 N/A ILE 246.A N ILE 242.A O no hydrogen 2.925 N/A ASP 247.A N GLN 243.A O no hydrogen 2.647 N/A GLN 248.A N LYS 244.A O no hydrogen 2.861 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.813 N/A GLU 94A.A N ASN 91.A OD1 no hydrogen 2.971 N/A ALA 127A.A N ARG 123.A O no hydrogen 2.946 N/A PHE 207A.A N SER 205.A OG no hydrogen 3.179 N/A ARG 225A.A NE GLU 146.A OE1 no hydrogen 2.700 N/A ARG 225A.A NH2 GLU 146.A OE2 no hydrogen 2.932 N/A SER 128B.A N GLU 124.A O no hydrogen 2.875 N/A GLU 186B.A N LYS 183.A O no hydrogen 3.066 N/A ASN 208B.A N SER 205.A OG no hydrogen 3.408 N/A LEU 129C.A N THR 125.A O no hydrogen 2.854 N/A TRP 50D.A N TYR 47A.A O no hydrogen 2.969 N/A LYS 188D.A NZ GLY 187C.A O no hydrogen 3.427 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.717 N/A LYS 52F.A N TYR 47A.A O no hydrogen 3.241 N/A LYS 52F.A NZ HIS 43.A O no hydrogen 2.910 N/A PHE 54H.A N LEU 45.A O no hydrogen 2.795 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.757 N/A THR 55I.A OG1 ASP 58.A OD2 no hydrogen 3.226 N/A