Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4x8s_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLN 134.A O no hydrogen 2.840 N/A ILE 1.A N ASP 186.A OD1 no hydrogen 3.445 N/A ILE 1.A N ASP 186.A OD2 no hydrogen 2.663 N/A VAL 2.A N ASP 181.A O no hydrogen 2.727 N/A LYS 5.A N VAL 147.A O no hydrogen 2.922 N/A CYS 7.A N LEU 145.A O no hydrogen 2.743 N/A CYS 7.A SG.B PRO 8.A O no hydrogen 3.530 N/A LYS 9.A NZ ASP 65.A OD1 no hydrogen 3.543 N/A LYS 9.A NZ ASP 65.A OD2 no hydrogen 2.761 N/A LYS 9.A NZ ASP 67.A OD2 no hydrogen 2.705 N/A GLU 11.A N PRO 8.A O no hydrogen 2.826 N/A CYS 12.A SG.B SER 130.A OG no hydrogen 3.394 N/A GLN 15.A N CYS 12.A O no hydrogen 3.129 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 2.956 N/A VAL 16.A N GLY 28.A O no hydrogen 2.920 N/A LEU 17.A N VAL 55.A O no hydrogen 2.973 N/A LEU 18.A N CYS 26.A O no hydrogen 2.797 N/A LEU 19.A N ILE 53.A O no hydrogen 2.828 N/A VAL 20.A N ALA 23.A O no hydrogen 2.946 N/A ASN 21.A N ASN 51.A O no hydrogen 3.174 N/A ALA 23.A N VAL 20.A O no hydrogen 3.082 N/A GLN 24.A NE2 TRP 132.A O no hydrogen 2.816 N/A LEU 25.A N LEU 18.A O no hydrogen 2.799 N/A CYS 26.A N LEU 18.A O no hydrogen 3.455 N/A CYS 26.A SG.A LEU 25.A O no hydrogen 3.098 N/A CYS 26.A SG.B GLY 27.A O no hydrogen 3.482 N/A CYS 26.A SG.B SER 38.A OG no hydrogen 3.645 N/A GLY 27.A N SER 187.A O no hydrogen 2.849 N/A GLY 28.A N VAL 16.A O no hydrogen 3.099 N/A THR 29.A N VAL 37.A O no hydrogen 2.760 N/A LEU 30.A N TRP 14.A O no hydrogen 2.980 N/A ILE 31.A N TRP 35.A O no hydrogen 2.958 N/A ILE 34.A N ASN 32.A OD1 no hydrogen 3.107 N/A TRP 35.A N ASN 32.A OD1 no hydrogen 3.111 N/A VAL 36.A N LEU 94.A O no hydrogen 2.949 N/A VAL 37.A N THR 29.A O no hydrogen 2.762 N/A SER 38.A N ALA 92.A O no hydrogen 2.872 N/A SER 38.A OG GLY 27.A O no hydrogen 2.714 N/A HIS 41.A N ASP 90.A OD1 no hydrogen 2.843 N/A HIS 41.A ND1 ASP 90.A OD2 no hydrogen 2.599 N/A HIS 41.A NE2 SER 187.A OG no hydrogen 2.812 N/A CYS 42.A N ALA 39.A O no hydrogen 3.245 N/A CYS 42.A SG.A SER 187.A O no hydrogen 3.827 N/A PHE 43.A N ALA 40.A O no hydrogen 3.067 N/A ASP 44.A N HIS 41.A O no hydrogen 3.349 N/A ASN 51.A N ASN 48D.A O no hydrogen 3.048 N/A ILE 53.A N LEU 19.A O no hydrogen 2.862 N/A ALA 54.A N ARG 71.A O no hydrogen 2.802 N/A VAL 55.A N LEU 17.A O no hydrogen 2.773 N/A LEU 56.A N GLN 69.A O no hydrogen 2.774 N/A HIS 59.A N GLU 58.A OE1 no hydrogen 2.873 N/A HIS 59.A NE2 GLU 144.A OE2 no hydrogen 2.861 N/A LEU 61.A N LEU 143.A O no hydrogen 2.815 N/A SER 62.A N ASP 60.A OD1 no hydrogen 2.891 N/A SER 62.A OG ASP 60.A OD1 no hydrogen 2.707 N/A ASP 65.A N GLU 68.A OE1 no hydrogen 3.092 N/A ASP 65.A N GLU 68.A OE2 no hydrogen 3.159 N/A GLY 66.A N GLU 68.A OE2 no hydrogen 2.970 N/A ASP 67.A N ASP 65.A OD1 no hydrogen 3.126 N/A GLU 68.A N GLU 68.A OE2 no hydrogen 2.878 N/A GLN 69.A N LEU 56.A O no hydrogen 2.781 N/A GLN 69.A NE2 VAL 101.A O no hydrogen 2.729 N/A ARG 71.A N ALA 54.A O no hydrogen 2.881 N/A ARG 71.A NE PRO 99.A O no hydrogen 2.959 N/A ARG 71.A NH1 SER 70.A O no hydrogen 2.913 N/A ARG 71.A NH2 PRO 99.A O no hydrogen 3.197 N/A VAL 73.A N LEU 52.A O no hydrogen 3.130 N/A ALA 74.A N ARG 95.A O no hydrogen 2.770 N/A GLN 75.A N ARG 95.A O no hydrogen 3.282 N/A GLN 75.A NE2 ARG 239.A O no hydrogen 3.169 N/A GLN 75.A NE2 GLY 241.A O no hydrogen 2.764 N/A GLN 75.A NE2 VAL 242.A O no hydrogen 3.533 N/A VAL 76.A N VAL 242.A O no hydrogen 2.846 N/A ILE 77.A N LEU 93.A O no hydrogen 2.760 N/A ILE 78.A N LEU 244.A O no hydrogen 2.917 N/A SER 80.A N ALA 246.A O no hydrogen 2.808 N/A TYR 82.A N PRO 79.A O no hydrogen 3.169 N/A TYR 82.A OH ASP 44.A OD1 no hydrogen 2.714 N/A TYR 82.A OH ASP 44.A OD2 no hydrogen 2.952 N/A GLY 85.A N ASP 44.A OD2 no hydrogen 2.985 N/A THR 86.A N VAL 83.A O no hydrogen 3.044 N/A THR 86.A OG1 VAL 83.A O no hydrogen 2.683 N/A ILE 91.A N HIS 89.A O no hydrogen 2.978 N/A ALA 92.A N SER 38.A O no hydrogen 2.948 N/A LEU 93.A N ILE 77.A O no hydrogen 2.806 N/A LEU 94.A N VAL 36.A O no hydrogen 2.786 N/A ARG 95.A N GLN 75.A O no hydrogen 2.935 N/A ARG 95.A NH2 SER 236.A O no hydrogen 3.174 N/A LEU 96.A N ILE 34.A O no hydrogen 2.778 N/A HIS 97.A N ARG 72.A O no hydrogen 2.820 N/A VAL 100.A N THR 33.A O no hydrogen 2.891 N/A VAL 101.A N GLN 69.A OE1 no hydrogen 2.778 N/A THR 103.A N VAL 106.A O no hydrogen 3.088 N/A HIS 105.A N THR 103.A OG1 no hydrogen 3.044 N/A VAL 106.A N THR 103.A O no hydrogen 3.200 N/A VAL 107.A N PRO 13.A O no hydrogen 3.191 N/A LEU 109.A N LEU 30.A O no hydrogen 2.822 N/A CYS 110.A N TRP 199.A O no hydrogen 3.392 N/A CYS 110.A SG TRP 199.A O no hydrogen 3.717 N/A ARG 114.A NE GLU 228.A OE2 no hydrogen 3.214 N/A ARG 114.A NH1 GLN 225.A OE1 no hydrogen 3.463 N/A ARG 114.A NH1 GLU 118A.A OE2 no hydrogen 2.800 N/A ARG 114.A NH2 GLU 228.A OE2 no hydrogen 3.411 N/A SER 117.A N GLU 113.A O no hydrogen 3.012 N/A SER 127.A N VAL 150.A O no hydrogen 3.031 N/A SER 127.A OG THR 193.A OG1 no hydrogen 2.630 N/A LEU 128.A N ALA 192.A O no hydrogen 2.837 N/A VAL 129.A N LEU 148.A O no hydrogen 2.820 N/A SER 130.A OG GLN 15.A OE1 no hydrogen 2.697 N/A GLY 131.A N MET 146.A O no hydrogen 3.032 N/A TRP 132.A NE1 HIS 59.A O no hydrogen 3.025 N/A GLY 133.A N ASP 186.A OD1 no hydrogen 2.813 N/A GLN 134.A N GLN 134.A OE1 no hydrogen 2.761 N/A LEU 135.A N ALA 140.A O no hydrogen 3.029 N/A GLY 139.A N LEU 136.A O no hydrogen 3.034 N/A ALA 142.A N GLY 133.A O no hydrogen 3.137 N/A LEU 145.A N HIS 59.A O no hydrogen 3.016 N/A MET 146.A N GLY 131.A O no hydrogen 3.123 N/A VAL 147.A N LYS 5.A O no hydrogen 2.768 N/A LEU 148.A N VAL 129.A O no hydrogen 2.836 N/A VAL 150.A N SER 127.A O no hydrogen 2.872 N/A ARG 152.A N ARG 125.A O no hydrogen 2.767 N/A LEU 153.A N CYS 172.A O no hydrogen 3.023 N/A CYS 158.A N MET 154.A O no hydrogen 2.990 N/A LEU 159.A N THR 155.A O no hydrogen 2.863 N/A GLN 160.A N GLN 156.A O no hydrogen 3.037 N/A THR 167.A OG1 ASN 88.A OD1 no hydrogen 2.712 N/A TYR 169.A N THR 167.A OG1 no hydrogen 3.180 N/A MET 170.A N THR 167.A O no hydrogen 3.279 N/A PHE 171.A N TYR 220.A O no hydrogen 2.881 N/A ALA 173.A N GLY 218.A O no hydrogen 3.038 N/A TYR 175.A OH ASN 149.A O no hydrogen 3.099 N/A LYS 180.A NZ SER 179A.A OG no hydrogen 2.802 N/A ASP 181.A N VAL 2.A O no hydrogen 3.024 N/A SER 182.A N.A ASP 181.A OD1 no hydrogen 2.869 N/A SER 182.A N.B ASP 181.A OD1 no hydrogen 2.820 N/A SER 182.A OG.A TYR 220.A OH no hydrogen 2.738 N/A SER 182.A OG.B TYR 220.A OH no hydrogen 3.010 N/A CYS 183.A N ASP 186.A OD2 no hydrogen 2.695 N/A CYS 183.A SG.A GLN 134.A OE1 no hydrogen 3.679 N/A CYS 183.A SG.B GLN 134.A O no hydrogen 3.025 N/A LYS 184.A NZ GLY 208.A O no hydrogen 3.257 N/A GLY 185.A N GLN 134.A OE1 no hydrogen 2.789 N/A ASP 186.A N CYS 183.A O no hydrogen 2.928 N/A SER 187.A N LYS 184.A O no hydrogen 3.344 N/A SER 187.A OG HIS 41.A NE2 no hydrogen 2.812 N/A SER 187.A OG LYS 184.A O no hydrogen 2.791 N/A GLY 188.A N VAL 205.A O no hydrogen 2.810 N/A GLY 189.A N ASP 186.A O no hydrogen 2.995 N/A HIS 191.A N GLY 203.A O no hydrogen 3.083 N/A HIS 191.A ND1 THR 202.A OG1 no hydrogen 2.795 N/A ALA 192.A N LEU 128.A O no hydrogen 2.806 N/A THR 193.A N TYR 200.A O no hydrogen 2.872 N/A THR 193.A OG1 SER 127.A OG no hydrogen 2.630 N/A THR 193.A OG1 THR 202.A OG1 no hydrogen 2.652 N/A TYR 195.A N THR 198.A O no hydrogen 2.778 N/A THR 198.A N TYR 195.A O no hydrogen 3.116 N/A TYR 200.A N THR 193.A O no hydrogen 2.866 N/A LEU 201.A N CYS 110.A O no hydrogen 2.908 N/A THR 202.A N HIS 191.A O no hydrogen 3.116 N/A THR 202.A OG1 HIS 191.A ND1 no hydrogen 2.795 N/A THR 202.A OG1 HIS 191.A O no hydrogen 3.156 N/A THR 202.A OG1 THR 193.A OG1 no hydrogen 2.652 N/A GLY 203.A N HIS 191.A O no hydrogen 3.209 N/A VAL 205.A N GLY 189.A O no hydrogen 3.000 N/A SER 206.A N VAL 219.A O no hydrogen 3.242 N/A SER 206.A OG ASP 90.A OD2 no hydrogen 2.685 N/A TRP 207.A N VAL 219.A O no hydrogen 3.045 N/A CYS 211.A N ASP 137.A OD2 no hydrogen 3.028 N/A THR 213.A OG1 GLN 209.A O no hydrogen 2.701 N/A GLY 215.A N SER 176.A O no hydrogen 2.742 N/A HIS 216.A N THR 213.A O no hydrogen 3.023 N/A GLY 218.A N ALA 173.A O no hydrogen 3.009 N/A VAL 219.A N TRP 207.A O no hydrogen 2.808 N/A TYR 220.A N PHE 171.A O no hydrogen 2.852 N/A TYR 220.A OH SER 182.A OG.A no hydrogen 2.738 N/A TYR 220.A OH SER 182.A OG.B no hydrogen 3.010 N/A THR 221.A N ILE 204.A O no hydrogen 2.989 N/A THR 221.A OG1 ASP 90.A O no hydrogen 2.653 N/A ARG 222.A N TYR 169.A O no hydrogen 2.940 N/A ARG 222.A NE GLU 168.A O no hydrogen 2.925 N/A VAL 223.A N THR 202.A O no hydrogen 3.332 N/A GLN 225.A N ARG 222.A O no hydrogen 3.236 N/A GLN 225.A NE2 GLU 168.A O no hydrogen 2.806 N/A TYR 226.A N VAL 223.A O no hydrogen 2.842 N/A TYR 226.A OH HIS 89.A ND1 no hydrogen 2.790 N/A LEU 230.A N TYR 226.A O no hydrogen 2.813 N/A GLN 231.A N ILE 227.A O no hydrogen 2.891 N/A LYS 232.A N GLU 228.A O no hydrogen 2.972 N/A LEU 233.A N TRP 229.A O no hydrogen 3.218 N/A MET 234.A N LEU 230.A O no hydrogen 2.972 N/A ARG 235.A N GLN 231.A O no hydrogen 3.219 N/A ARG 235.A N LYS 232.A O no hydrogen 3.196 N/A SER 236.A N LEU 233.A O no hydrogen 2.991 N/A SER 236.A OG LEU 233.A O no hydrogen 2.758 N/A ARG 239.A N GLN 75.A OE1 no hydrogen 3.417 N/A LEU 244.A N VAL 76.A O no hydrogen 2.799 N/A ARG 245.A NH2 SER 80.A O no hydrogen 2.873 N/A ALA 246.A N ILE 78.A O no hydrogen 2.900 N/A PHE 248.A N SER 80.A OG no hydrogen 2.996 N/A GLU 118A.A N ARG 114.A O no hydrogen 2.823 N/A GLN 161A.A N ASP 157.A O no hydrogen 2.791 N/A GLY 174A.A N PRO 151.A O no hydrogen 2.949 N/A SER 179A.A N ASP 177.A OD1 no hydrogen 3.230 N/A SER 179A.A OG ASP 177.A OD1 no hydrogen 2.695 N/A ALA 212A.A N ASP 181.A OD2 no hydrogen 2.894 N/A ILE 46B.A N PHE 43.A O no hydrogen 3.396 N/A ARG 119B.A N THR 115.A O no hydrogen 2.927 N/A SER 162B.A OG CYS 158.A O no hydrogen 3.010 N/A THR 120C.A N PHE 116.A O no hydrogen 3.013 N/A ARG 163C.A N GLY 215.A O no hydrogen 2.919 N/A LEU 121D.A N PHE 116.A O no hydrogen 3.155 N/A ALA 122E.A N SER 117.A O no hydrogen 2.837 N/A PHE 123F.A N THR 120C.A O no hydrogen 3.160 N/A VAL 124G.A N LEU 121D.A O no hydrogen 3.054 N/A