Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bth_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 121.A O no hydrogen 2.989 N/A ILE 1.A N ASP 174.A OD1 no hydrogen 3.484 N/A ILE 1.A N ASP 174.A OD2 no hydrogen 2.628 N/A VAL 2.A N ASP 169.A O no hydrogen 2.776 N/A TYR 5.A N CYS 135.A O no hydrogen 2.828 N/A CYS 7.A N LEU 133.A O no hydrogen 3.180 N/A CYS 7.A SG LEU 133.A O no hydrogen 3.537 N/A THR 11.A N GLY 8.A O no hydrogen 3.254 N/A THR 11.A OG1 CYS 7.A O no hydrogen 3.058 N/A THR 11.A OG1 GLY 8.A O no hydrogen 2.804 N/A GLN 15.A N VAL 12.A O no hydrogen 3.138 N/A VAL 16.A N GLY 27.A O no hydrogen 2.990 N/A SER 17.A N ARG 49.A O no hydrogen 3.015 N/A SER 17.A OG HIS 23.A ND1 no hydrogen 2.774 N/A LEU 18.A N CYS 25.A O no hydrogen 2.790 N/A ASN 19.A N GLN 47.A O no hydrogen 2.771 N/A SER 20.A N TYR 22.A O no hydrogen 3.014 N/A GLY 21.A N ASN 19.A OD1 no hydrogen 2.717 N/A HIS 23.A ND1 SER 17.A OG no hydrogen 2.774 N/A HIS 23.A NE2 GLY 173.A O no hydrogen 2.762 N/A PHE 24.A N LEU 18.A O no hydrogen 3.104 N/A CYS 25.A SG PHE 24.A O no hydrogen 3.163 N/A GLY 26.A N SER 175.A O no hydrogen 2.800 N/A SER 28.A N VAL 36.A O no hydrogen 2.846 N/A LEU 29.A N TYR 14.A O no hydrogen 2.905 N/A ILE 30.A N TRP 34.A O no hydrogen 3.076 N/A GLN 33.A N ASN 31.A OD1 no hydrogen 2.892 N/A GLN 33.A NE2 LEU 90.A O no hydrogen 3.258 N/A TRP 34.A N ASN 31.A O no hydrogen 3.201 N/A VAL 35.A N ILE 88.A O no hydrogen 2.899 N/A VAL 36.A N SER 28.A O no hydrogen 2.786 N/A SER 37.A N MET 86.A O no hydrogen 2.920 N/A SER 37.A OG GLY 26.A O no hydrogen 2.966 N/A ALA 38.A N SER 37.A OG no hydrogen 2.709 N/A HIS 40.A N ASP 84.A OD1 no hydrogen 3.010 N/A HIS 40.A ND1 ASP 84.A OD2 no hydrogen 2.774 N/A HIS 40.A NE2 SER 175.A OG no hydrogen 2.569 N/A CYS 41.A N ALA 38.A O no hydrogen 3.119 N/A CYS 41.A SG SER 37.A OG no hydrogen 3.779 N/A TYR 42.A N ALA 39.A O no hydrogen 3.062 N/A GLN 47.A N ASN 19.A O no hydrogen 2.845 N/A VAL 48.A N ILE 65.A O no hydrogen 2.765 N/A ARG 49.A N SER 17.A O no hydrogen 2.826 N/A LEU 50.A N GLN 63.A O no hydrogen 2.861 N/A ASN 54.A N GLU 59.A OE1 no hydrogen 3.186 N/A ILE 55.A N ASP 131.A O no hydrogen 2.852 N/A ASN 56.A N ASN 54.A OD1 no hydrogen 2.717 N/A ASN 56.A ND2 ASP 131.A OD1 no hydrogen 2.971 N/A GLU 59.A N GLU 62.A OE2 no hydrogen 2.781 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.739 N/A GLN 63.A N LEU 50.A O no hydrogen 3.037 N/A GLN 63.A NE2 SER 95.A O no hydrogen 2.868 N/A ILE 65.A N VAL 48.A O no hydrogen 2.852 N/A ALA 67.A N ILE 46.A O no hydrogen 3.214 N/A SER 68.A N LYS 89.A O no hydrogen 2.807 N/A SER 68.A OG LYS 89.A O no hydrogen 3.307 N/A LYS 69.A NZ ASN 221.A O no hydrogen 2.914 N/A LYS 69.A NZ ASN 221.A OD1 no hydrogen 3.468 N/A ILE 71.A N LEU 87.A O no hydrogen 2.616 N/A HIS 73.A N ILE 85.A O no hydrogen 3.023 N/A SER 75.A N HIS 73.A ND1 no hydrogen 3.038 N/A TYR 76.A N HIS 73.A O no hydrogen 2.851 N/A ASN 77.A N ASN 82.A O no hydrogen 3.026 N/A ASN 79.A N ASN 77.A OD1 no hydrogen 2.716 N/A THR 80.A N ASN 77.A OD1 no hydrogen 2.966 N/A LEU 81.A N ASN 77.A O no hydrogen 2.725 N/A ASN 82.A N THR 80.A OG1 no hydrogen 3.296 N/A ASN 83.A ND2 SER 75.A O no hydrogen 2.970 N/A ILE 85.A N ASN 83.A O no hydrogen 2.804 N/A MET 86.A N SER 37.A O no hydrogen 2.944 N/A LEU 87.A N ILE 71.A O no hydrogen 2.780 N/A ILE 88.A N VAL 35.A O no hydrogen 2.856 N/A LYS 89.A N LYS 69.A O no hydrogen 2.813 N/A LYS 89.A NZ ASN 221.A O no hydrogen 2.773 N/A LEU 90.A N GLN 33.A O no hydrogen 2.828 N/A LYS 91.A N SER 66.A O no hydrogen 2.742 N/A ALA 94.A N SER 32.A O no hydrogen 2.742 N/A SER 95.A N GLN 63.A OE1 no hydrogen 2.785 N/A ALA 99.A N PRO 13.A O no hydrogen 3.105 N/A ILE 101.A N LEU 29.A O no hydrogen 2.916 N/A CYS 107.A SG ASN 209.A OD1 no hydrogen 3.932 N/A SER 109.A OG THR 112.A OG1 no hydrogen 3.331 N/A GLY 111.A N ILE 140.A O no hydrogen 2.734 N/A THR 112.A N SER 109.A O no hydrogen 2.966 N/A THR 112.A OG1 SER 109.A O no hydrogen 2.641 N/A THR 112.A OG1 SER 109.A OG no hydrogen 3.331 N/A CYS 114.A N ALA 138.A O no hydrogen 2.760 N/A CYS 114.A SG THR 112.A O no hydrogen 3.840 N/A LEU 115.A N VAL 180.A O no hydrogen 2.832 N/A ILE 116.A N LEU 136.A O no hydrogen 2.752 N/A GLY 118.A N LYS 134.A O no hydrogen 3.083 N/A TRP 119.A NE1 ASP 53.A O no hydrogen 2.866 N/A GLY 120.A N ASP 174.A OD1 no hydrogen 2.796 N/A ASN 121.A N GLN 172.A O no hydrogen 2.887 N/A ASN 121.A ND2 GLY 126.A O no hydrogen 2.877 N/A THR 122.A N SER 128.A O no hydrogen 2.848 N/A THR 122.A OG1 SER 128.A O no hydrogen 3.094 N/A LYS 123.A N ASN 121.A OD1 no hydrogen 3.091 N/A SER 128.A N ASN 121.A OD1 no hydrogen 2.821 N/A LYS 134.A N GLY 118.A O no hydrogen 3.081 N/A LYS 134.A NZ THR 6.A OG1 no hydrogen 2.745 N/A CYS 135.A N TYR 5.A O no hydrogen 2.622 N/A LEU 136.A N ILE 116.A O no hydrogen 2.861 N/A ALA 138.A N CYS 114.A O no hydrogen 2.909 N/A ILE 140.A N THR 112.A O no hydrogen 2.780 N/A LEU 141.A N CYS 160.A O no hydrogen 2.884 N/A SER 142.A OG SER 145.A OG no hydrogen 3.143 N/A SER 145.A N SER 142.A OG no hydrogen 3.255 N/A SER 145.A OG SER 142.A O no hydrogen 3.047 N/A SER 145.A OG SER 142.A OG no hydrogen 3.143 N/A CYS 146.A N SER 142.A O no hydrogen 2.974 N/A LYS 147.A N ASP 143.A O no hydrogen 2.843 N/A SER 148.A N SER 144.A O no hydrogen 2.985 N/A SER 148.A OG SER 144.A O no hydrogen 2.932 N/A ALA 149.A N SER 145.A O no hydrogen 2.920 N/A TYR 150.A N CYS 146.A O no hydrogen 3.081 N/A TYR 150.A OH PRO 201.A O no hydrogen 2.628 N/A GLN 153.A N TYR 150.A O no hydrogen 3.125 N/A ASN 157.A N THR 155.A OG1 no hydrogen 3.160 N/A MET 158.A N THR 155.A O no hydrogen 3.200 N/A PHE 159.A N TYR 204.A O no hydrogen 2.932 N/A ALA 161.A N GLY 202.A O no hydrogen 3.156 N/A TYR 163.A OH LYS 137.A O no hydrogen 2.833 N/A GLY 166.A N TYR 163.A O no hydrogen 3.050 N/A ASP 169.A N VAL 2.A O no hydrogen 2.985 N/A SER 170.A N ASP 169.A OD1 no hydrogen 2.766 N/A SER 170.A OG.A TYR 204.A OH no hydrogen 3.208 N/A SER 170.A OG.B TYR 204.A OH no hydrogen 2.811 N/A CYS 171.A N ASP 174.A OD2 no hydrogen 2.887 N/A CYS 171.A SG GLN 172.A OE1 no hydrogen 3.708 N/A ASP 174.A N CYS 171.A O no hydrogen 3.004 N/A SER 175.A OG HIS 40.A NE2 no hydrogen 2.569 N/A SER 175.A OG SER 190.A O no hydrogen 3.478 N/A GLY 176.A N VAL 189.A O no hydrogen 2.856 N/A GLY 177.A N ASP 174.A O no hydrogen 3.002 N/A VAL 179.A N GLY 187.A O no hydrogen 3.123 N/A VAL 180.A N LEU 115.A O no hydrogen 2.954 N/A CYS 181.A N LYS 184.A O no hydrogen 2.910 N/A SER 182.A O CYS 181.A O no hydrogen 3.221 N/A GLY 183.A N SER 182.A O no hydrogen 2.242 N/A LYS 184.A N CYS 181.A O no hydrogen 2.995 N/A LEU 185.A N SER 102.A O no hydrogen 2.859 N/A GLN 186.A N VAL 179.A O no hydrogen 2.925 N/A GLN 186.A NE2 SER 106.A O no hydrogen 2.944 N/A GLY 187.A N VAL 179.A O no hydrogen 3.121 N/A ILE 188.A N THR 205.A O no hydrogen 3.228 N/A VAL 189.A N GLY 177.A O no hydrogen 2.966 N/A SER 190.A N VAL 203.A O no hydrogen 3.253 N/A SER 190.A OG ASP 84.A OD2 no hydrogen 2.697 N/A TRP 191.A N VAL 203.A O no hydrogen 3.153 N/A SER 193.A N TYR 150.A OH no hydrogen 3.341 N/A CYS 195.A SG SER 170.A O no hydrogen 3.866 N/A CYS 195.A SG GLN 172.A OE1 no hydrogen 3.441 N/A GLN 197.A NE2 CYS 195.A O no hydrogen 2.935 N/A ASN 199.A N LEU 164.A O no hydrogen 2.702 N/A LYS 200.A N GLN 197.A O no hydrogen 3.201 N/A LYS 200.A NZ ALA 149.A O no hydrogen 2.663 N/A VAL 203.A N TRP 191.A O no hydrogen 2.831 N/A TYR 204.A N PHE 159.A O no hydrogen 2.747 N/A TYR 204.A OH SER 170.A OG.A no hydrogen 3.208 N/A TYR 204.A OH SER 170.A OG.B no hydrogen 2.811 N/A THR 205.A N ILE 188.A O no hydrogen 2.934 N/A THR 205.A OG1 ASP 84.A O no hydrogen 2.818 N/A LYS 206.A N ASN 157.A O no hydrogen 2.815 N/A VAL 207.A N GLN 186.A O no hydrogen 2.971 N/A CYS 208.A SG ASN 209.A OD1 no hydrogen 3.672 N/A ASN 209.A N LYS 206.A O no hydrogen 3.218 N/A ASN 209.A ND2 SER 156.A O no hydrogen 3.169 N/A ASN 209.A ND2 ASN 157.A OD1 no hydrogen 2.983 N/A TYR 210.A N VAL 207.A O no hydrogen 2.873 N/A TYR 210.A OH ASN 83.A OD1 no hydrogen 2.589 N/A ILE 214.A N TYR 210.A O no hydrogen 2.789 N/A LYS 215.A N VAL 211.A O no hydrogen 2.995 N/A GLN 216.A N SER 212.A O no hydrogen 3.035 N/A THR 217.A N TRP 213.A O no hydrogen 2.888 N/A THR 217.A OG1 TRP 213.A O no hydrogen 2.709 N/A ILE 218.A N ILE 214.A O no hydrogen 2.908 N/A ALA 219.A N LYS 215.A O no hydrogen 3.123 N/A SER 220.A N GLN 216.A O no hydrogen 3.041 N/A SER 220.A N THR 217.A O no hydrogen 3.368 N/A SER 220.A OG GLN 216.A O no hydrogen 2.836 N/A ASN 221.A ND2 THR 217.A O no hydrogen 2.885 N/A GLY 162A.A N PRO 139.A O no hydrogen 3.093 N/A GLY 167A.A N ALA 196A.A O no hydrogen 2.849 N/A ALA 196A.A N ASP 169.A OD2 no hydrogen 2.970 N/A