Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bth_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 143.A O no hydrogen 2.785 N/A ILE 1.A N ASP 204.A OD2 no hydrogen 2.718 N/A VAL 2.A N ASP 199.A O no hydrogen 2.626 N/A SER 5.A N VAL 162.A O no hydrogen 2.848 N/A SER 5.A OG ASP 6.A O no hydrogen 3.393 N/A ALA 7.A N LEU 160.A O no hydrogen 2.915 N/A MET 11.A N GLU 8.A O no hydrogen 3.306 N/A GLN 15.A N SER 12.A O no hydrogen 3.041 N/A GLN 15.A NE2 VAL 16.A O GLN 15.A HE22 3.415 2.554 VAL 16.A N ALA 30.A O no hydrogen 2.972 N/A MET 17.A N ARG 62.A O no hydrogen 2.974 N/A LEU 18.A N CYS 28.A O no hydrogen 2.881 N/A PHE 19.A N LEU 60.A O no hydrogen 2.966 N/A ARG 20.A NE PRO 23A.A O no hydrogen 3.515 N/A LYS 21.A NZ ASP 58.A O no hydrogen 2.934 N/A CYS 28.A N LEU 18.A O no hydrogen 3.210 N/A CYS 28.A SG LEU 27.A O no hydrogen 3.198 N/A CYS 28.A SG SER 205.A O no hydrogen 3.797 N/A GLY 29.A N SER 205.A O no hydrogen 2.669 N/A ALA 30.A N VAL 16.A O no hydrogen 2.960 N/A SER 31.A N LEU 39.A O no hydrogen 2.788 N/A SER 31.A OG GLN 221.A OE1 no hydrogen 2.814 N/A LEU 32.A N TRP 14.A O no hydrogen 2.896 N/A ILE 33.A N TRP 37.A O no hydrogen 3.155 N/A ARG 36.A N SER 34.A OG no hydrogen 3.254 N/A ARG 36.A NH1 GLU 82.A OE1 ARG 36.A HH12 3.091 2.174 VAL 38.A N MET 103.A O no hydrogen 2.928 N/A LEU 39.A N SER 31.A O no hydrogen 2.781 N/A THR 40.A N ALA 101.A O no hydrogen 2.803 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.772 N/A ALA 41.A N THR 40.A OG1 no hydrogen 2.768 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 3.306 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.686 N/A HIS 43.A NE2 SER 205.A OG no hydrogen 2.808 N/A CYS 44.A N ALA 41.A O no hydrogen 3.259 N/A CYS 44.A SG SER 205.A O no hydrogen 3.784 N/A LEU 45.A N ALA 42.A O no hydrogen 3.282 N/A ASN 57.A ND2 LEU 81.A O ASN 57.A HD21 3.425 2.459 ASP 58.A N ASN 57.A OD1 no hydrogen 2.962 N/A LEU 60.A N PHE 19.A O no hydrogen 2.956 N/A VAL 61.A N SER 79.A O no hydrogen 3.206 N/A ARG 62.A N MET 17.A O no hydrogen 2.841 N/A ARG 62.A NE GLU 76.A OE2 no hydrogen 3.049 N/A ARG 62.A NH2 GLU 76.A OE1 ARG 62.A HH21 3.450 2.620 ARG 62.A NH2 GLU 76.A OE2 ARG 62.A HH21 3.223 2.381 ILE 63.A N LYS 77.A O no hydrogen 2.770 N/A LYS 65.A NZ SER 67.A O no hydrogen 3.031 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.688 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 3.101 N/A LYS 65.A NZ GLU 76.A OE1 no hydrogen 2.963 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 3.214 N/A HIS 66.A N GLU 72.A OE2 no hydrogen 3.240 N/A HIS 66.A NE2 ALA 7.A O no hydrogen 3.117 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.764 N/A SER 67.A OG SER 158.A O no hydrogen 3.245 N/A ARG 68.A N SER 158.A O no hydrogen 2.696 N/A ARG 68.A NH1 PRO 157.A O ARG 68.A HH11 2.806 1.843 ARG 70.A N SER 67.A OG no hydrogen 3.304 N/A GLU 72.A N GLU 76.A OE1 no hydrogen 2.948 N/A ILE 75.A N GLU 72.A O no hydrogen 3.257 N/A GLU 76.A N GLU 72.A O no hydrogen 2.808 N/A LYS 77.A N ILE 63.A O no hydrogen 2.844 N/A LYS 77.A NZ ALA 110.A O no hydrogen 3.494 N/A SER 79.A N VAL 61.A O no hydrogen 2.855 N/A SER 79.A OG MET 80.A O no hydrogen 3.457 N/A GLU 82.A N LYS 104.A O no hydrogen 2.670 N/A LYS 83.A N LYS 104.A O no hydrogen 3.398 N/A TYR 85.A N LEU 102.A O no hydrogen 2.808 N/A HIS 87.A N ILE 100.A O no hydrogen 3.076 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.913 N/A ARG 89.A NH1 PRO 88.A O ARG 89.A HH11 2.809 1.950 TYR 90.A N HIS 87.A O no hydrogen 2.839 N/A ASN 91.A N ASP 97.A O no hydrogen 3.267 N/A ASN 91.A ND2 TYR 90.A O ASN 91.A HD22 2.675 2.069 LEU 96.A N ASN 91.A O no hydrogen 2.583 N/A ASP 97.A N ASN 95.A OD1 no hydrogen 3.125 N/A ARG 98.A NH1 ASP 97.A OD2 ARG 98.A HH11 3.123 2.164 ILE 100.A N ARG 98.A O no hydrogen 2.858 N/A ALA 101.A N THR 40.A O no hydrogen 3.021 N/A LEU 102.A N TYR 85.A O no hydrogen 2.805 N/A MET 103.A N VAL 38.A O no hydrogen 2.760 N/A LYS 104.A N LYS 83.A O no hydrogen 2.838 N/A LEU 105.A N ARG 36.A O no hydrogen 2.866 N/A LYS 106.A N MET 80.A O no hydrogen 2.800 N/A LYS 106.A NZ LEU 81.A O no hydrogen 3.467 N/A VAL 109.A N ASP 35.A O no hydrogen 2.847 N/A SER 112.A N ILE 115.A O no hydrogen 3.021 N/A TYR 114.A N SER 112.A OG no hydrogen 3.367 N/A ILE 115.A N SER 112.A O no hydrogen 3.258 N/A HIS 116.A N PRO 13.A O no hydrogen 2.851 N/A VAL 118.A N LEU 32.A O no hydrogen 3.163 N/A CYS 119.A N TRP 219.A O no hydrogen 3.160 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.683 N/A ALA 126.A N ASP 122.A O no hydrogen 2.979 N/A LEU 130.A N ALA 126.A O no hydrogen 2.987 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.774 N/A GLN 131.A NE2 ALA 127A.A O GLN 131.A HE22 3.559 3.008 GLN 131.A NE2 SER 128B.A O GLN 131.A HE22 2.776 1.821 GLY 133.A N ILE 167.A O no hydrogen 2.871 N/A TYR 134.A N GLN 131.A O no hydrogen 2.870 N/A LYS 135.A NZ TYR 190A.A OH no hydrogen 3.414 N/A GLY 136.A N LEU 165.A O no hydrogen 2.784 N/A ARG 137.A N VAL 210.A O no hydrogen 2.732 N/A ARG 137.A NE ASN 164.A OD1 no hydrogen 2.673 N/A VAL 138.A N VAL 163.A O no hydrogen 2.876 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.744 N/A GLY 140.A N GLN 161.A O no hydrogen 2.971 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 2.847 N/A GLY 142.A N ASP 204.A OD1 no hydrogen 2.985 N/A ASN 143.A N GLN 202.A O no hydrogen 2.728 N/A LEU 144.A N GLY 155.A O no hydrogen 2.872 N/A LYS 145.A NZ LEU 144.A O no hydrogen 2.987 N/A THR 147.A OG1 LYS 145.A O no hydrogen 3.023 N/A LEU 160.A N HIS 66.A O no hydrogen 2.667 N/A GLN 161.A N GLY 140.A O no hydrogen 2.837 N/A GLN 161.A NE2 ASP 6.A OD1 GLN 161.A HE21 2.815 1.884 GLN 161.A NE2 VAL 159.A O GLN 161.A HE22 3.002 2.021 GLN 161.A NE2 LEU 160.A O GLN 161.A HE22 3.697 3.130 VAL 162.A N SER 5.A O no hydrogen 2.791 N/A VAL 163.A N VAL 138.A O no hydrogen 3.000 N/A LEU 165.A N GLY 136.A O no hydrogen 2.772 N/A ILE 167.A N TYR 134.A O no hydrogen 2.867 N/A VAL 168.A N CYS 187.A O no hydrogen 2.976 N/A ARG 170.A NH1 MET 185.A O ARG 170.A HH12 3.118 2.275 ARG 170.A NH2 MET 185.A O ARG 170.A HH22 2.981 2.079 CYS 173.A N GLU 169.A O no hydrogen 3.056 N/A CYS 173.A SG VAL 168.A O no hydrogen 3.763 N/A CYS 173.A SG GLU 169.A O no hydrogen 3.407 N/A LYS 174.A N ARG 170.A O no hydrogen 2.793 N/A LYS 174.A NZ ASP 175.A OD1 no hydrogen 2.968 N/A ASP 175.A N PRO 171.A O no hydrogen 2.840 N/A SER 176.A N CYS 173.A O no hydrogen 2.945 N/A SER 176.A OG VAL 172.A O no hydrogen 3.209 N/A SER 176.A OG CYS 173.A O no hydrogen 2.572 N/A THR 177.A OG1 GLU 229.A OE2 no hydrogen 2.656 N/A ILE 179.A N THR 177.A OG1 no hydrogen 2.894 N/A THR 182.A OG1 ASP 97.A OD1 no hydrogen 2.436 N/A ASN 184.A ND2 ASP 97.A OD1 ASN 184.A HD22 3.000 2.025 MET 185.A N THR 182.A O no hydrogen 2.883 N/A PHE 186.A N TYR 240.A O no hydrogen 2.878 N/A ALA 188.A N GLY 238.A O no hydrogen 3.048 N/A GLY 189.A N PRO 166.A O no hydrogen 2.819 N/A LYS 191.A N GLU 194B.A OE1 no hydrogen 3.033 N/A LYS 191.A NZ GLU 169.A OE1 no hydrogen 2.840 N/A LYS 191.A NZ GLU 169.A OE2 no hydrogen 2.846 N/A ARG 197.A NE ASP 232A.A OD2 no hydrogen 2.982 N/A ARG 197.A NH1 ASP 234.A OD1 ARG 197.A HH12 2.763 1.955 ARG 197.A NH2 ASP 234.A OD1 ARG 197.A HH22 2.739 1.922 ARG 197.A NH2 ASP 232A.A O ARG 197.A HH21 2.850 1.867 GLY 198.A N ASP 232A.A OD1 no hydrogen 2.894 N/A ASP 199.A N VAL 2.A O no hydrogen 3.006 N/A ALA 200.A N ASP 199.A OD1 no hydrogen 2.749 N/A CYS 201.A N ASP 204.A OD2 no hydrogen 2.720 N/A CYS 201.A SG GLN 202.A OE1 no hydrogen 3.590 N/A ASP 204.A N CYS 201.A O no hydrogen 2.850 N/A SER 205.A OG HIS 43.A NE2 no hydrogen 2.808 N/A SER 205.A OG SER 226.A O no hydrogen 3.263 N/A GLY 206.A N VAL 225.A O no hydrogen 2.824 N/A GLY 207.A N ASP 204.A O no hydrogen 2.935 N/A PHE 209.A N GLY 223.A O no hydrogen 2.794 N/A VAL 210.A N ARG 137.A O no hydrogen 2.873 N/A MET 211.A N TYR 220.A O no hydrogen 2.980 N/A LYS 212.A NZ ASN 217.A OD1 no hydrogen 3.095 N/A SER 213.A N ARG 218.A O no hydrogen 2.993 N/A ASN 217.A N SER 213.A O no hydrogen 3.031 N/A ARG 218.A N ASN 216B.A OD1 no hydrogen 3.087 N/A TYR 220.A N MET 211.A O no hydrogen 2.885 N/A GLN 221.A N CYS 119.A O no hydrogen 2.810 N/A GLN 221.A NE2 GLY 223.A O GLN 221.A HE22 3.340 2.428 MET 222.A N PHE 209.A O no hydrogen 2.900 N/A GLY 223.A N PHE 209.A O no hydrogen 3.138 N/A ILE 224.A N THR 241.A O no hydrogen 3.255 N/A VAL 225.A N GLY 207.A O no hydrogen 2.949 N/A SER 226.A N PHE 239.A O no hydrogen 3.288 N/A SER 226.A OG ASP 99.A OD2 no hydrogen 2.728 N/A TRP 227.A N PHE 239.A O no hydrogen 3.335 N/A CYS 231.A N GLU 146.A OE1 no hydrogen 2.996 N/A CYS 231.A SG ALA 200.A O no hydrogen 3.869 N/A CYS 231.A SG GLN 202.A OE1 no hydrogen 3.515 N/A ARG 233.A NE GLU 146.A OE1 no hydrogen 2.920 N/A ARG 233.A NH2 GLU 146.A OE2 ARG 233.A HH21 2.621 1.760 LYS 236.A N ARG 233.A O no hydrogen 3.318 N/A LYS 236.A NZ SER 176.A O no hydrogen 2.573 N/A LYS 236.A NZ GLU 229.A OE1 no hydrogen 2.776 N/A GLY 238.A N ALA 188.A O no hydrogen 3.334 N/A PHE 239.A N TRP 227.A O no hydrogen 2.844 N/A TYR 240.A N PHE 186.A O no hydrogen 2.755 N/A THR 241.A N ILE 224.A O no hydrogen 2.989 N/A THR 241.A OG1 ASP 99.A O no hydrogen 2.714 N/A HIS 242.A N ASN 184.A O no hydrogen 2.619 N/A VAL 243.A N MET 222.A O no hydrogen 3.173 N/A ARG 245.A N HIS 242.A ND1 no hydrogen 3.242 N/A ARG 245.A NH1 ASP 183.A O ARG 245.A HH11 2.679 1.841 LEU 246.A N VAL 243.A O no hydrogen 3.000 N/A LYS 247.A N PHE 244.A O no hydrogen 3.154 N/A LYS 247.A NZ PRO 121.A O no hydrogen 2.707 N/A TRP 249.A N LEU 246.A O no hydrogen 2.890 N/A ILE 250.A N LEU 246.A O no hydrogen 3.127 N/A GLN 251.A N LYS 247.A O no hydrogen 3.042 N/A LYS 252.A N LYS 248.A O no hydrogen 2.892 N/A VAL 253.A N TRP 249.A O no hydrogen 2.869 N/A ILE 254.A N ILE 250.A O no hydrogen 2.934 N/A ALA 127A.A N ARG 123.A O no hydrogen 3.023 N/A TYR 190A.A OH ASN 164.A O no hydrogen 3.152 N/A PHE 215A.A N SER 213.A OG no hydrogen 3.314 N/A ASP 232A.A N ASP 199.A OD2 no hydrogen 2.902 N/A SER 128B.A N GLU 124.A O no hydrogen 2.753 N/A SER 128B.A OG GLU 124.A O no hydrogen 2.530 N/A SER 128B.A OG THR 125.A O no hydrogen 3.210 N/A ASN 151B.A ND2 GLU 146.A O ASN 151B.A HD22 2.816 2.220 ASN 151B.A ND2 THR 147.A OG1 ASN 151B.A HD22 2.871 1.967 GLU 194B.A N LYS 191.A O no hydrogen 3.071 N/A ASN 216B.A ND2 TYR 220.A OH ASN 216B.A HD21 2.739 1.903 LEU 129C.A N THR 125.A O no hydrogen 2.852 N/A VAL 152C.A N ASN 151B.A OD1 no hydrogen 2.573 N/A ASP 51E.A N PRO 48B.A O no hydrogen 3.017 N/A LYS 52F.A N PRO 49C.A O no hydrogen 3.251 N/A LYS 52F.A NZ TRP 50D.A O no hydrogen 3.260 N/A THR 55I.A N ASN 53G.A OD1 no hydrogen 2.927 N/A