Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bf6_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 142.A O no hydrogen 3.210 N/A ILE 1.A N ASN 143.A O no hydrogen 2.797 N/A ILE 1.A N ASP 195.A OD1 no hydrogen 3.408 N/A ILE 1.A N ASP 195.A OD2 no hydrogen 2.682 N/A VAL 2.A N ASP 190.A O no hydrogen 2.874 N/A SER 5.A N VAL 153.A O no hydrogen 3.203 N/A ALA 7.A N LEU 151.A O no hydrogen 2.743 N/A MET 11.A N.A GLU 8.A O no hydrogen 3.151 N/A MET 11.A N.B GLU 8.A O no hydrogen 3.159 N/A GLN 15.A N SER 12.A O no hydrogen 2.994 N/A GLN 15.A NE2 SER 12.A OG no hydrogen 2.897 N/A GLN 15.A NE2 THR 139.A OG1 no hydrogen 2.517 N/A VAL 16.A N ALA 30.A O no hydrogen 2.758 N/A MET 17.A N ARG 62.A O no hydrogen 2.838 N/A LEU 18.A N CYS 28.A O no hydrogen 2.904 N/A PHE 19.A N LEU 60.A O no hydrogen 2.848 N/A ARG 20.A N GLU 25.A O.A no hydrogen 2.965 N/A ARG 20.A N GLU 25.A O.B no hydrogen 3.033 N/A ARG 20.A NE SER 22A.A O no hydrogen 3.151 N/A ARG 20.A NH1 GLU 25.A OE1.A no hydrogen 3.493 N/A ARG 20.A NH1 GLU 25.A OE2.B no hydrogen 2.750 N/A LYS 21.A N ASP 58.A O no hydrogen 3.138 N/A LYS 21.A NZ ASN 57.A O no hydrogen 3.157 N/A GLN 24.A NE2 LYS 21.A O no hydrogen 2.857 N/A LEU 27.A N.A LEU 18.A O no hydrogen 2.947 N/A LEU 27.A N.B LEU 18.A O no hydrogen 2.979 N/A CYS 28.A N LEU 18.A O no hydrogen 3.366 N/A CYS 28.A SG LEU 27.A O.A no hydrogen 3.144 N/A CYS 28.A SG LEU 27.A O.B no hydrogen 3.323 N/A GLY 29.A N SER 196.A O no hydrogen 2.763 N/A SER 31.A N LEU 39.A O no hydrogen 2.744 N/A SER 31.A OG LEU 39.A O no hydrogen 3.325 N/A SER 31.A OG GLN 212.A OE1 no hydrogen 2.626 N/A LEU 32.A N TRP 14.A O no hydrogen 2.748 N/A ILE 33.A N TRP 37.A O no hydrogen 3.161 N/A ARG 36.A N SER 34.A OG no hydrogen 3.281 N/A ARG 36.A NH1 GLU 250.A OXT no hydrogen 2.668 N/A ARG 36.A NH2 GLU 250.A OE2 no hydrogen 2.813 N/A TRP 37.A N SER 34.A OG no hydrogen 3.118 N/A VAL 38.A N MET 103.A O no hydrogen 2.934 N/A LEU 39.A N SER 31.A O no hydrogen 2.722 N/A THR 40.A N ALA 101.A O no hydrogen 2.839 N/A THR 40.A OG1 GLY 29.A O no hydrogen 3.196 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.972 N/A HIS 43.A NE2 SER 196.A OG no hydrogen 2.703 N/A CYS 44.A N ALA 41.A O no hydrogen 3.319 N/A LEU 45.A N ALA 42.A O no hydrogen 2.879 N/A LEU 46.A N ALA 42.A O no hydrogen 2.650 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.772 N/A ASP 58.A N THR 55I.A O no hydrogen 3.165 N/A LEU 60.A N PHE 19.A O no hydrogen 2.867 N/A VAL 61.A N SER 79.A O no hydrogen 2.978 N/A ARG 62.A N MET 17.A O no hydrogen 2.766 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 2.806 N/A ARG 62.A NH2 GLU 76.A OE1 no hydrogen 3.471 N/A ARG 62.A NH2 GLU 76.A OE2 no hydrogen 2.982 N/A ILE 63.A N LYS 77.A O no hydrogen 2.875 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.675 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 3.051 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 2.731 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 3.479 N/A HIS 66.A N GLU 72.A OE2 no hydrogen 3.445 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.994 N/A ARG 68.A N SER 149.A O no hydrogen 2.871 N/A ARG 68.A NE PRO 148.A O no hydrogen 2.728 N/A ARG 68.A NH2 PRO 148.A O no hydrogen 3.330 N/A ARG 70.A N SER 67.A OG no hydrogen 3.118 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 3.074 N/A ILE 75.A N GLU 72.A O no hydrogen 3.457 N/A GLU 76.A N GLU 72.A O no hydrogen 3.231 N/A LYS 77.A N ILE 63.A O no hydrogen 2.782 N/A SER 79.A N VAL 61.A O no hydrogen 3.054 N/A SER 79.A OG MET 80.A O no hydrogen 3.181 N/A SER 79.A OG LYS 107.A O no hydrogen 2.897 N/A GLU 82.A N LYS 104.A O no hydrogen 2.731 N/A ILE 84.A N GLU 56.A OE2 no hydrogen 2.800 N/A TYR 85.A N LEU 102.A O no hydrogen 2.765 N/A HIS 87.A N ILE 100.A O no hydrogen 3.419 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 3.231 N/A TYR 90.A N HIS 87.A O no hydrogen 3.183 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.850 N/A ASN 91.A N ASP 97.A O no hydrogen 2.950 N/A ASN 91.A ND2 ASN 95.A OD1 no hydrogen 3.504 N/A ASN 91.A ND2 GLU 94A.A OE1 no hydrogen 3.233 N/A ASN 95.A ND2 ARG 171.A O no hydrogen 2.800 N/A ASN 95.A ND2 THR 173.A OG1 no hydrogen 3.027 N/A ILE 100.A N ARG 98.A O no hydrogen 2.950 N/A ALA 101.A N THR 40.A O no hydrogen 2.769 N/A LEU 102.A N TYR 85.A O no hydrogen 2.704 N/A MET 103.A N VAL 38.A O no hydrogen 2.814 N/A LYS 104.A N LYS 83.A O no hydrogen 3.043 N/A LYS 104.A NZ GLU 82.A OE2 no hydrogen 3.352 N/A LEU 105.A N ARG 36.A O no hydrogen 2.972 N/A LYS 106.A N MET 80.A O no hydrogen 3.127 N/A LYS 107.A N SER 79.A OG no hydrogen 3.212 N/A VAL 109.A N ASP 35.A O no hydrogen 2.927 N/A SER 112.A N ILE 115.A O no hydrogen 2.853 N/A TYR 114.A N SER 112.A OG no hydrogen 3.385 N/A HIS 116.A N PRO 13.A O no hydrogen 3.102 N/A VAL 118.A N LEU 32.A O no hydrogen 2.890 N/A CYS 119.A N TRP 210.A O no hydrogen 3.175 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.609 N/A ALA 126.A N ASP 122.A O no hydrogen 3.113 N/A LEU 130.A N ALA 126.A O no hydrogen 3.045 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.797 N/A GLN 131.A NE2 SER 128B.A O no hydrogen 3.011 N/A GLY 133.A N ILE 158.A O no hydrogen 2.795 N/A TYR 134.A N GLN 131.A O no hydrogen 3.148 N/A LYS 135.A NZ TYR 181A.A OH no hydrogen 3.381 N/A GLY 136.A N LEU 156.A O no hydrogen 2.789 N/A ARG 137.A N VAL 201.A O no hydrogen 2.709 N/A ARG 137.A NE ASN 155.A OD1 no hydrogen 3.229 N/A VAL 138.A N VAL 154.A O.A no hydrogen 2.833 N/A VAL 138.A N VAL 154.A O.B no hydrogen 2.825 N/A GLY 140.A N GLN 152.A O no hydrogen 3.136 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 2.885 N/A GLY 142.A N ASP 195.A OD1 no hydrogen 2.883 N/A ASN 143.A N GLU 193.A O no hydrogen 2.882 N/A LEU 151.A N HIS 66.A O no hydrogen 2.927 N/A GLN 152.A N GLY 140.A O no hydrogen 3.004 N/A VAL 153.A N SER 5.A O no hydrogen 2.819 N/A VAL 154.A N.A VAL 138.A O no hydrogen 3.016 N/A VAL 154.A N.B VAL 138.A O no hydrogen 3.015 N/A LEU 156.A N GLY 136.A O no hydrogen 2.792 N/A ILE 158.A N TYR 134.A O no hydrogen 2.734 N/A VAL 159.A N CYS 178.A O no hydrogen 3.069 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.709 N/A ARG 161.A NH1 THR 173.A O no hydrogen 2.990 N/A ARG 161.A NH2 MET 176.A O no hydrogen 2.697 N/A VAL 163.A N GLU 160.A O no hydrogen 3.190 N/A CYS 164.A N GLU 160.A O no hydrogen 3.260 N/A CYS 164.A SG VAL 159.A O no hydrogen 3.260 N/A CYS 164.A SG GLU 160.A O no hydrogen 3.422 N/A LYS 165.A N ARG 161.A O no hydrogen 2.954 N/A ASP 166.A N PRO 162.A O no hydrogen 3.038 N/A SER 167.A N VAL 163.A O no hydrogen 3.125 N/A SER 167.A OG VAL 163.A O no hydrogen 3.447 N/A SER 167.A OG CYS 164.A O no hydrogen 2.804 N/A THR 168.A OG1 GLU 220.A OE1 no hydrogen 2.760 N/A ILE 170.A N THR 168.A OG1 no hydrogen 3.124 N/A ARG 171.A NE GLU 94A.A OE2 no hydrogen 2.813 N/A ARG 171.A NH2 GLU 94A.A OE1 no hydrogen 3.455 N/A MET 176.A N THR 173.A O no hydrogen 3.009 N/A PHE 177.A N TYR 231.A O no hydrogen 2.949 N/A ALA 179.A N GLY 229.A O no hydrogen 2.943 N/A GLY 180.A N PRO 157.A O no hydrogen 2.966 N/A LYS 182.A N GLU 185B.A OE1 no hydrogen 2.788 N/A LYS 182.A NZ GLU 160.A OE1 no hydrogen 3.318 N/A LYS 182.A NZ GLU 160.A OE2 no hydrogen 3.477 N/A ARG 188.A NE ASP 223A.A OD2 no hydrogen 2.770 N/A ARG 188.A NH1 ASP 225.A OD1 no hydrogen 3.014 N/A ARG 188.A NH2 ASP 225.A OD1 no hydrogen 3.234 N/A GLY 189.A N ASP 223A.A OD1 no hydrogen 2.708 N/A ASP 190.A N VAL 2.A O no hydrogen 3.165 N/A CYS 192.A N ASP 195.A OD2 no hydrogen 2.760 N/A CYS 192.A SG LYS 145.A O no hydrogen 3.778 N/A CYS 192.A SG GLU 193.A OE1 no hydrogen 3.361 N/A ASP 195.A N CYS 192.A O no hydrogen 2.963 N/A SER 196.A OG HIS 43.A NE2 no hydrogen 2.703 N/A SER 196.A OG VAL 216.A O no hydrogen 3.099 N/A SER 196.A OG SER 217.A O no hydrogen 2.997 N/A GLY 197.A N VAL 216.A O no hydrogen 3.069 N/A GLY 198.A N ASP 195.A O no hydrogen 2.960 N/A PHE 200.A N GLY 214.A O no hydrogen 2.722 N/A VAL 201.A N ARG 137.A O no hydrogen 2.826 N/A MET 202.A N TYR 211.A O no hydrogen 2.748 N/A SER 204.A N ARG 209.A O no hydrogen 2.870 N/A SER 204.A OG ASN 207B.A OD1 no hydrogen 3.297 N/A ARG 209.A N ASN 207B.A OD1 no hydrogen 3.096 N/A TYR 211.A N MET 202.A O no hydrogen 2.781 N/A GLN 212.A N CYS 119.A O no hydrogen 2.948 N/A GLN 212.A NE2 GLY 214.A O no hydrogen 3.228 N/A MET 213.A N PHE 200.A O no hydrogen 2.796 N/A GLY 214.A N PHE 200.A O no hydrogen 3.028 N/A ILE 215.A N THR 232.A O no hydrogen 3.251 N/A VAL 216.A N GLY 198.A O no hydrogen 2.978 N/A SER 217.A N PHE 230.A O no hydrogen 3.175 N/A SER 217.A OG ASP 99.A OD2 no hydrogen 2.648 N/A TRP 218.A N PHE 230.A O no hydrogen 3.243 N/A CYS 222.A N GLU 146.A OE2 no hydrogen 3.132 N/A CYS 222.A SG ALA 191.A O no hydrogen 3.799 N/A CYS 222.A SG GLU 193.A OE1 no hydrogen 3.285 N/A ARG 224.A NH1 GLU 146.A OE2 no hydrogen 3.018 N/A LYS 227.A N ARG 224.A O no hydrogen 3.091 N/A LYS 227.A NZ GLU 220.A OE1 no hydrogen 3.120 N/A GLY 229.A N ALA 179.A O no hydrogen 3.257 N/A PHE 230.A N TRP 218.A O no hydrogen 2.785 N/A TYR 231.A N PHE 177.A O no hydrogen 2.721 N/A THR 232.A N ILE 215.A O no hydrogen 2.807 N/A THR 232.A OG1 ASP 99.A O no hydrogen 2.704 N/A HIS 233.A N ASN 175.A O no hydrogen 2.841 N/A VAL 234.A N MET 213.A O no hydrogen 3.146 N/A LEU 237.A N VAL 234.A O no hydrogen 3.157 N/A LYS 238.A N PHE 235.A O no hydrogen 2.991 N/A TRP 240.A N LEU 237.A O no hydrogen 3.115 N/A ILE 241.A N LEU 237.A O no hydrogen 3.284 N/A GLN 242.A N.A LYS 238.A O no hydrogen 2.990 N/A GLN 242.A N.B LYS 238.A O no hydrogen 2.990 N/A GLN 242.A NE2.A ASP 246.A OD2 no hydrogen 2.770 N/A VAL 244.A N TRP 240.A O no hydrogen 3.171 N/A ILE 245.A N ILE 241.A O no hydrogen 3.157 N/A ASP 246.A N GLN 242.A O.A no hydrogen 3.021 N/A ASP 246.A N GLN 242.A O.B no hydrogen 3.019 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.644 N/A ALA 127A.A N ARG 123.A O no hydrogen 3.029 N/A PHE 206A.A N SER 204.A OG no hydrogen 3.106 N/A ASP 223A.A N ASP 190.A OD2 no hydrogen 3.028 N/A SER 128B.A N GLU 124.A O no hydrogen 2.818 N/A SER 128B.A OG GLU 124.A O no hydrogen 2.920 N/A GLU 185B.A N LYS 182.A O no hydrogen 2.961 N/A ASN 207B.A N SER 204.A OG no hydrogen 3.337 N/A ASN 207B.A ND2 TYR 211.A OH no hydrogen 2.746 N/A LEU 129C.A N THR 125.A O no hydrogen 2.867 N/A TRP 50D.A N TYR 47A.A O no hydrogen 3.022 N/A LYS 187D.A N GLU 185B.A O no hydrogen 2.833 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.913 N/A LYS 52F.A N TYR 47A.A O no hydrogen 3.229 N/A PHE 54H.A N LEU 45.A O no hydrogen 3.110 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 3.235 N/A THR 55I.A OG1 GLU 56.A OE1 no hydrogen 3.040 N/A