Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hbu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N PRO 2.A O no hydrogen 3.065 N/A LYS 5.A NZ GLU 9.A OE1 no hydrogen 2.629 N/A LYS 5.A NZ GLU 9.A OE2 no hydrogen 3.299 N/A LEU 6.A N PRO 2.A O no hydrogen 3.252 N/A ALA 7.A N ALA 3.A O no hydrogen 2.979 N/A LEU 8.A N LEU 4.A O no hydrogen 2.897 N/A GLU 9.A N LYS 5.A O no hydrogen 2.817 N/A TYR 10.A OH VAL 22.A O no hydrogen 2.850 N/A ILE 11.A N LEU 6.A O no hydrogen 2.960 N/A VAL 12.A N ALA 7.A O no hydrogen 2.934 N/A CYS 14.A N TYR 10.A O no hydrogen 3.055 N/A MET 15.A N ILE 11.A O no hydrogen 2.741 N/A ASN 16.A N VAL 12.A O no hydrogen 2.939 N/A ASN 16.A ND2 LYS 99.A O no hydrogen 2.903 N/A LYS 17.A N PRO 13.A O no hydrogen 2.975 N/A HIS 18.A N CYS 14.A O no hydrogen 2.697 N/A GLY 19.A N MET 15.A O no hydrogen 2.840 N/A CYS 21.A N PHE 178.A O no hydrogen 2.832 N/A VAL 23.A N LEU 176.A O no hydrogen 2.792 N/A PHE 26.A N ASP 174.A O no hydrogen 2.943 N/A LEU 27.A N ASP 174.A OD1 no hydrogen 2.918 N/A GLY 28.A N ASP 174.A OD2 no hydrogen 2.721 N/A GLY 32.A N GLY 28.A O no hydrogen 2.925 N/A GLN 33.A N LYS 29.A O.A no hydrogen 2.970 N/A GLN 33.A N LYS 29.A O.B no hydrogen 2.738 N/A GLN 33.A NE2.A ASP 37.A OD1 no hydrogen 3.393 N/A GLN 34.A N GLU 30.A O no hydrogen 3.009 N/A GLN 34.A NE2.B THR 81.A OG1 no hydrogen 3.408 N/A ILE 35.A N THR 31.A O no hydrogen 2.918 N/A GLY 36.A N GLY 32.A O no hydrogen 2.848 N/A ASP 37.A N GLN 33.A O no hydrogen 2.857 N/A GLU 38.A N GLN 34.A O no hydrogen 2.967 N/A VAL 39.A N ILE 35.A O no hydrogen 2.920 N/A ARG 40.A N GLY 36.A O no hydrogen 2.944 N/A ARG 40.A NH2 ASP 37.A OD1 no hydrogen 2.923 N/A ALA 41.A N ASP 37.A O no hydrogen 2.895 N/A LEU 42.A N GLU 38.A O no hydrogen 2.891 N/A HIS 43.A N VAL 39.A O no hydrogen 2.960 N/A HIS 43.A ND1 ASP 44.A OD2 no hydrogen 3.332 N/A ASP 44.A N ARG 40.A O no hydrogen 2.808 N/A THR 45.A N ALA 41.A O no hydrogen 2.923 N/A THR 45.A OG1 ALA 41.A O no hydrogen 2.860 N/A THR 45.A OG1 LEU 42.A O no hydrogen 3.452 N/A GLY 46.A N HIS 43.A O no hydrogen 3.216 N/A LYS 47.A N LEU 42.A O no hydrogen 3.008 N/A LYS 47.A NZ THR 45.A OG1 no hydrogen 3.413 N/A THR 49.A N ILE 69.A O no hydrogen 2.925 N/A GLN 52.A N ASP 67.A O no hydrogen 2.876 N/A GLN 52.A NE2 ASP 67.A OD1 no hydrogen 2.650 N/A VAL 54.A N ILE 64.A O no hydrogen 2.718 N/A SER 55.A N ILE 64.A O no hydrogen 3.122 N/A LYS 57.A N ASP 63.A OD1 no hydrogen 3.066 N/A LYS 57.A NZ LYS 62.A O no hydrogen 3.254 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 3.481 N/A ASP 63.A N SER 60.A O no hydrogen 3.125 N/A ILE 64.A N SER 55.A O no hydrogen 2.931 N/A ARG 65.A NH1 GLY 51.A O no hydrogen 2.820 N/A GLY 66.A N GLN 52.A O no hydrogen 2.845 N/A LYS 68.A N CYS 115.A O no hydrogen 2.811 N/A LYS 68.A NZ THR 49.A O no hydrogen 2.873 N/A ILE 69.A N THR 49.A OG1 no hydrogen 3.096 N/A THR 70.A N VAL 113.A O no hydrogen 3.018 N/A THR 70.A OG1 LYS 47.A O no hydrogen 3.233 N/A ILE 72.A N ALA 111.A O no hydrogen 2.810 N/A GLU 73.A N GLU 76.A OE2 no hydrogen 2.715 N/A GLY 74.A N GLU 76.A OE1 no hydrogen 2.754 N/A LYS 75.A NZ.A GLU 73.A OE1.B no hydrogen 3.282 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.693 N/A CYS 79.A N GLU 76.A O no hydrogen 2.940 N/A CYS 79.A SG PRO 77.A O no hydrogen 3.978 N/A THR 81.A N GLU 38.A OE1 no hydrogen 3.124 N/A THR 81.A N GLU 38.A OE2 no hydrogen 3.101 N/A THR 81.A OG1 GLU 38.A OE2 no hydrogen 2.892 N/A ILE 82.A N GLU 38.A OE1 no hydrogen 3.003 N/A GLY 83.A N CYS 79.A O no hydrogen 2.855 N/A LEU 84.A N GLU 80.A O no hydrogen 2.829 N/A LEU 85.A N THR 81.A O no hydrogen 2.805 N/A MET 86.A N ILE 82.A O no hydrogen 2.892 N/A SER 87.A N GLY 83.A O no hydrogen 2.934 N/A SER 87.A OG GLY 83.A O no hydrogen 3.356 N/A SER 88.A N LEU 84.A O no hydrogen 2.997 N/A SER 88.A OG LEU 84.A O no hydrogen 2.776 N/A MET 89.A N LEU 85.A O no hydrogen 2.895 N/A ASP 90.A N MET 86.A O no hydrogen 2.862 N/A ASP 91.A N SER 87.A O no hydrogen 2.849 N/A LEU 92.A N SER 88.A O no hydrogen 3.230 N/A ILE 93.A N MET 89.A O no hydrogen 2.926 N/A ARG 94.A N ASP 90.A O no hydrogen 2.796 N/A HIS 95.A N ASP 91.A O no hydrogen 3.046 N/A CYS 96.A N ILE 93.A O no hydrogen 2.919 N/A CYS 96.A SG LEU 92.A O no hydrogen 3.300 N/A ASN 97.A N ARG 94.A O no hydrogen 3.245 N/A ASN 97.A ND2 ILE 105.A O no hydrogen 2.837 N/A GLY 98.A N ASN 97.A OD1 no hydrogen 3.156 N/A LYS 99.A N CYS 96.A O no hydrogen 2.738 N/A GLY 101.A N ASN 16.A OD1 no hydrogen 2.948 N/A TYR 103.A N LEU 100.A O no hydrogen 3.101 N/A LYS 104.A N ASP 205.A OD1 no hydrogen 2.876 N/A LYS 104.A NZ.A TYR 103.A O no hydrogen 2.854 N/A ILE 105.A N ASN 97.A OD1 no hydrogen 2.991 N/A ASN 106.A N PHE 204.A O no hydrogen 3.147 N/A ARG 108.A NE ASP 90.A OD1 no hydrogen 2.802 N/A ARG 108.A NE ASP 90.A OD2 no hydrogen 3.029 N/A ARG 108.A NH1 ASP 90.A OD2 no hydrogen 3.188 N/A ARG 108.A NH2 THR 109.A O no hydrogen 2.993 N/A THR 109.A N TRP 202.A O no hydrogen 3.022 N/A THR 109.A OG1 LYS 110.A O no hydrogen 2.732 N/A ALA 111.A N ILE 72.A O no hydrogen 2.954 N/A MET 112.A N THR 200.A O no hydrogen 2.779 N/A VAL 113.A N THR 70.A O no hydrogen 2.916 N/A ALA 114.A N ALA 198.A O no hydrogen 2.786 N/A CYS 115.A N LYS 68.A O no hydrogen 2.764 N/A TYR 116.A N ARG 196.A O no hydrogen 2.841 N/A ASN 119.A ND2 ARG 65.A O no hydrogen 2.969 N/A GLY 120.A N ALA 192.A O no hydrogen 2.987 N/A THR 121.A OG1 ASN 119.A OD1 no hydrogen 2.786 N/A TYR 123.A N VAL 189.A O no hydrogen 2.861 N/A HIS 126.A N HIS 187.A O no hydrogen 2.920 N/A HIS 126.A ND1 VAL 124.A O no hydrogen 2.873 N/A ASN 129.A N SER 181.A O no hydrogen 2.953 N/A ASN 129.A ND2 ARG 135.A O no hydrogen 2.801 N/A ASN 129.A ND2 GLU 208.A OE2 no hydrogen 2.889 N/A ASP 133.A N ASN 129.A OD1 no hydrogen 2.851 N/A GLY 134.A N GLU 208.A OE2 no hydrogen 2.830 N/A ARG 135.A N ASP 133.A OD2 no hydrogen 3.077 N/A ARG 135.A NE ASP 133.A OD1 no hydrogen 3.058 N/A ARG 135.A NE ASP 133.A OD2 no hydrogen 3.096 N/A ARG 135.A NH2 ASP 133.A OD1 no hydrogen 2.695 N/A CYS 136.A N TYR 203.A O no hydrogen 2.757 N/A CYS 136.A SG TYR 203.A O no hydrogen 3.627 N/A VAL 137.A N TYR 203.A O no hydrogen 3.363 N/A THR 138.A N PHE 179.A O no hydrogen 2.761 N/A THR 138.A OG1 ASP 128.A OD1 no hydrogen 2.832 N/A THR 138.A OG1 SER 181.A OG no hydrogen 2.873 N/A CYS 139.A N VAL 201.A O no hydrogen 2.893 N/A CYS 139.A SG LEU 177.A O no hydrogen 4.046 N/A ILE 140.A N LEU 177.A O no hydrogen 2.763 N/A TYR 141.A N ILE 199.A O no hydrogen 2.806 N/A TYR 141.A OH ASP 174.A OD1 no hydrogen 2.676 N/A TYR 142.A N ARG 175.A O no hydrogen 2.934 N/A ASN 144.A ND2 PRO 171.A O no hydrogen 2.963 N/A ASN 144.A ND2 TYR 197.A O no hydrogen 2.996 N/A TRP 147.A N ASN 144.A O no hydrogen 3.348 N/A TRP 147.A NE1 GLY 153.A O no hydrogen 2.980 N/A LYS 150.A N ASP 148.A OD1.A no hydrogen 3.096 N/A VAL 151.A N ASP 148.A O no hydrogen 2.965 N/A SER 152.A N ASP 148.A O no hydrogen 2.816 N/A GLY 153.A N ALA 149.A O no hydrogen 2.917 N/A GLY 154.A N PRO 191.A O no hydrogen 2.805 N/A LEU 156.A N ILE 169.A O no hydrogen 2.942 N/A ARG 157.A N GLU 188.A O no hydrogen 2.971 N/A ARG 157.A NE ASP 168.A OD1 no hydrogen 2.780 N/A ARG 157.A NH2 ASP 168.A OD2 no hydrogen 2.971 N/A ILE 158.A N ALA 167.A O no hydrogen 2.818 N/A PHE 159.A N PRO 186.A O no hydrogen 2.949 N/A GLN 165.A NE2 LYS 163.A O no hydrogen 3.544 N/A ALA 167.A N ILE 158.A O no hydrogen 2.722 N/A ILE 169.A N LEU 156.A O no hydrogen 2.750 N/A LYS 172.A N GLU 170.A O no hydrogen 2.759 N/A PHE 173.A N ASN 144.A O no hydrogen 3.079 N/A ASP 174.A N TYR 142.A O no hydrogen 2.874 N/A ARG 175.A N LYS 172.A O no hydrogen 3.165 N/A ARG 175.A NE ASP 24.A OD1 no hydrogen 2.864 N/A ARG 175.A NH1 ASP 24.A OD1 no hydrogen 3.429 N/A ARG 175.A NH1 ASP 24.A OD2 no hydrogen 3.013 N/A ARG 175.A NH2 GLU 170.A O no hydrogen 3.009 N/A LEU 176.A N VAL 23.A O no hydrogen 2.830 N/A LEU 177.A N ILE 140.A O no hydrogen 2.773 N/A PHE 178.A N CYS 21.A O no hydrogen 2.915 N/A PHE 179.A N THR 138.A O no hydrogen 2.955 N/A TRP 180.A N GLY 19.A O no hydrogen 3.137 N/A SER 181.A N CYS 136.A O no hydrogen 3.024 N/A SER 181.A OG THR 138.A OG1 no hydrogen 2.873 N/A ARG 183.A NE.A PRO 130.A O no hydrogen 2.632 N/A ARG 183.A NH2.A PRO 130.A O no hydrogen 2.862 N/A ARG 184.A N ASP 182.A OD1 no hydrogen 3.057 N/A ARG 184.A NE ASP 182.A OD1 no hydrogen 2.805 N/A ARG 184.A NE ASP 182.A OD2 no hydrogen 3.225 N/A ARG 184.A NH2 ASP 182.A OD2 no hydrogen 3.384 N/A ASN 185.A N ASP 182.A O no hydrogen 3.100 N/A ASN 185.A ND2 GLY 19.A O no hydrogen 3.174 N/A ASN 185.A ND2 TRP 180.A O no hydrogen 2.918 N/A HIS 187.A N HIS 126.A O no hydrogen 2.967 N/A HIS 187.A ND1 ASN 185.A O no hydrogen 2.827 N/A GLU 188.A N ARG 157.A O no hydrogen 2.891 N/A VAL 189.A N TYR 123.A O no hydrogen 2.921 N/A GLN 190.A N ILE 155.A O no hydrogen 2.895 N/A ALA 192.A N THR 121.A O no hydrogen 2.967 N/A TYR 193.A N SER 152.A O no hydrogen 2.771 N/A ARG 196.A N TYR 116.A O no hydrogen 2.864 N/A ARG 196.A NE GLY 154.A O no hydrogen 2.793 N/A ARG 196.A NH2 GLY 154.A O no hydrogen 3.028 N/A TYR 197.A N ASN 144.A OD1 no hydrogen 2.820 N/A ALA 198.A N ALA 114.A O no hydrogen 3.040 N/A ILE 199.A N TYR 141.A O no hydrogen 2.832 N/A THR 200.A N MET 112.A O no hydrogen 2.855 N/A VAL 201.A N CYS 139.A O no hydrogen 2.979 N/A TRP 202.A N THR 109.A OG1 no hydrogen 3.125 N/A TRP 202.A NE1 ASP 128.A OD1 no hydrogen 2.925 N/A TYR 203.A N VAL 137.A O no hydrogen 2.855 N/A TYR 203.A OH ASP 90.A OD1 no hydrogen 2.653 N/A PHE 204.A N GLY 107.A O no hydrogen 2.951 N/A ASP 205.A N GLY 134.A O no hydrogen 2.949 N/A ALA 206.A N LYS 104.A O no hydrogen 2.766 N/A GLU 208.A N ASP 205.A OD2 no hydrogen 2.866 N/A ARG 209.A N ASP 205.A O no hydrogen 2.963 N/A ARG 209.A NH1 ASP 133.A O no hydrogen 3.097 N/A ALA 210.A N ALA 206.A O no hydrogen 2.985 N/A ARG 211.A N ASP 207.A O no hydrogen 3.233 N/A ARG 211.A NE ASP 207.A OD1 no hydrogen 2.835 N/A ARG 211.A NH2 ASP 207.A OD1 no hydrogen 3.404 N/A ARG 211.A NH2 ASP 207.A OD2 no hydrogen 2.972 N/A ALA 212.A N GLU 208.A O no hydrogen 3.005 N/A ALA 212.A N ARG 209.A O no hydrogen 3.189 N/A LYS 213.A N ARG 209.A O no hydrogen 3.182 N/A VAL 214.A N ARG 211.A O no hydrogen 3.230 N/A LYS 215.A NZ ASN 131.A O no hydrogen 3.067 N/A LYS 215.A NZ GLY 132.A O no hydrogen 3.467 N/A