Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bsq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N TYR 173.A O no hydrogen 2.971 N/A TRP 8.A N VAL 171.A O no hydrogen 2.866 N/A TRP 8.A NE1 VAL 130.A O no hydrogen 2.636 N/A ARG 9.A N ASP 7.A OD1 no hydrogen 3.029 N/A ARG 9.A NE ASP 7.A OD1 no hydrogen 3.125 N/A ARG 9.A NE ASP 7.A OD2 no hydrogen 3.449 N/A ARG 9.A NH2 ASP 7.A OD2 no hydrogen 3.052 N/A GLU 10.A N ASP 7.A O no hydrogen 3.038 N/A LYS 11.A N TRP 8.A O no hydrogen 3.162 N/A GLY 12.A N ARG 9.A O no hydrogen 3.089 N/A CYS 13.A N TRP 8.A O no hydrogen 3.125 N/A CYS 13.A SG LYS 11.A O no hydrogen 3.698 N/A THR 15.A OG1 GLU 16.A O no hydrogen 3.424 N/A THR 15.A OG1 GLU 36.A OE1 no hydrogen 2.753 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.840 N/A LYS 18.A NZ GLU 16.A O no hydrogen 2.833 N/A LYS 18.A NZ SER 48.A OG no hydrogen 2.855 N/A GLN 20.A N SER 187.A O no hydrogen 2.873 N/A GLN 20.A NE2 CYS 23.A O no hydrogen 3.263 N/A CYS 23.A SG TYR 94.A OH no hydrogen 3.651 N/A GLY 24.A N CYS 68.A O no hydrogen 2.925 N/A ALA 25.A N CYS 23.A O no hydrogen 2.743 N/A TRP 27.A NE1 GLY 67.A O no hydrogen 3.102 N/A ALA 28.A N ALA 25.A O no hydrogen 2.889 N/A PHE 29.A N ALA 25.A O no hydrogen 3.076 N/A SER 30.A N CYS 26.A O no hydrogen 2.791 N/A SER 30.A OG VAL 168.A O no hydrogen 2.686 N/A ALA 31.A N TRP 27.A O no hydrogen 3.088 N/A VAL 32.A N ALA 28.A O no hydrogen 2.956 N/A GLY 33.A N PHE 29.A O no hydrogen 2.904 N/A ALA 34.A N SER 30.A O no hydrogen 3.154 N/A LEU 35.A N ALA 31.A O no hydrogen 3.145 N/A GLU 36.A N VAL 32.A O no hydrogen 2.767 N/A GLY 37.A N GLY 33.A O no hydrogen 3.186 N/A GLN 38.A N ALA 34.A O no hydrogen 3.294 N/A GLN 38.A NE2 LYS 133.A O no hydrogen 2.992 N/A LEU 39.A N LEU 35.A O no hydrogen 2.799 N/A LYS 40.A N GLU 36.A O no hydrogen 3.078 N/A LYS 40.A NZ GLY 44.A O no hydrogen 2.638 N/A LEU 41.A N GLY 37.A O no hydrogen 3.043 N/A LYS 42.A N GLN 38.A O no hydrogen 2.815 N/A THR 43.A N LEU 39.A O no hydrogen 2.819 N/A THR 43.A OG1 LEU 39.A O no hydrogen 2.758 N/A GLY 44.A N LYS 40.A O no hydrogen 2.775 N/A LYS 45.A N THR 43.A OG1 no hydrogen 3.119 N/A SER 48.A OG GLU 16.A OE2 no hydrogen 3.214 N/A LEU 49.A N GLU 36.A OE2 no hydrogen 2.799 N/A SER 50.A N GLU 87.A O no hydrogen 2.917 N/A SER 50.A OG TYR 92.A O no hydrogen 2.721 N/A GLN 52.A NE2 ASP 56.A OD1 no hydrogen 2.811 N/A GLN 52.A NE2 MET 97.A O no hydrogen 2.716 N/A ASN 53.A N SER 50.A OG no hydrogen 2.944 N/A VAL 55.A N ALA 51.A O no hydrogen 2.997 N/A ASP 56.A N GLN 52.A O no hydrogen 2.770 N/A CYS 57.A N ASN 53.A O no hydrogen 3.046 N/A CYS 57.A SG ASN 53.A O no hydrogen 3.189 N/A CYS 57.A SG ASN 53.A OD1 no hydrogen 3.406 N/A CYS 57.A SG TYR 92.A OH no hydrogen 3.748 N/A SER 58.A N LEU 54.A O no hydrogen 3.174 N/A SER 58.A OG LEU 54.A O no hydrogen 2.581 N/A GLU 60.A N SER 58.A O no hydrogen 2.904 N/A TYR 63.A N GLU 60.A O no hydrogen 2.923 N/A TYR 63.A OH ASP 82.A OD2 no hydrogen 2.519 N/A GLY 64.A N GLU 60.A O no hydrogen 2.913 N/A ASN 65.A ND2 SER 58.A OG no hydrogen 3.067 N/A LYS 66.A N GLY 70.A O no hydrogen 2.661 N/A CYS 68.A N ASP 98.A OD1 no hydrogen 2.816 N/A CYS 68.A SG ASP 98.A OD1 no hydrogen 3.830 N/A GLY 69.A N LYS 66.A O no hydrogen 2.862 N/A GLY 70.A N GLY 67.A O no hydrogen 3.227 N/A TYR 72.A N ASN 65.A OD1 no hydrogen 2.836 N/A THR 74.A N TYR 213.A OH no hydrogen 3.182 N/A THR 74.A OG1 TYR 213.A OH no hydrogen 2.667 N/A ALA 76.A N TYR 72.A O no hydrogen 2.975 N/A PHE 77.A N MET 73.A O no hydrogen 2.970 N/A GLN 78.A N THR 74.A O no hydrogen 2.874 N/A GLN 78.A NE2 ASP 82.A OD1 no hydrogen 2.864 N/A TYR 79.A N GLU 75.A O no hydrogen 2.897 N/A TYR 79.A OH ASN 53.A OD1 no hydrogen 2.859 N/A ILE 80.A N ALA 76.A O no hydrogen 2.983 N/A ILE 81.A N PHE 77.A O no hydrogen 2.940 N/A ASP 82.A N GLN 78.A O no hydrogen 2.828 N/A ASN 83.A N TYR 79.A O no hydrogen 2.691 N/A ASN 83.A ND2 GLY 85.A O no hydrogen 2.904 N/A GLY 84.A N ILE 81.A O no hydrogen 3.214 N/A GLY 85.A N ILE 80.A O no hydrogen 3.229 N/A ILE 86.A N ALA 110.A O no hydrogen 3.071 N/A ASP 89.A N SER 48.A O no hydrogen 2.823 N/A SER 91.A OG GLU 87.A OE1 no hydrogen 2.613 N/A SER 91.A OG ALA 88.A O no hydrogen 3.464 N/A TYR 92.A N ALA 88.A O no hydrogen 3.038 N/A TYR 92.A OH ASP 56.A OD2 no hydrogen 2.793 N/A TYR 94.A OH GLN 20.A O no hydrogen 2.491 N/A LYS 95.A N GLN 52.A OE1 no hydrogen 2.612 N/A GLU 99.A N ASP 56.A OD1 no hydrogen 3.043 N/A HIS 102.A N TYR 92.A OH no hydrogen 3.183 N/A HIS 102.A ND1 LYS 100.A O no hydrogen 3.258 N/A ASN 104.A N GLU 87.A OE2 no hydrogen 2.654 N/A LYS 106.A N ASN 104.A OD1 no hydrogen 3.513 N/A ASN 107.A N ASN 104.A O no hydrogen 2.839 N/A ARG 108.A N SER 105.A O no hydrogen 3.251 N/A ARG 108.A NE GLY 84.A O no hydrogen 2.671 N/A ALA 109.A N ILE 86.A O no hydrogen 2.798 N/A ALA 110.A N ILE 86.A O no hydrogen 3.316 N/A CYS 112.A SG ARG 114.A O no hydrogen 3.218 N/A CYS 112.A SG GLU 218.A O no hydrogen 3.740 N/A SER 113.A N GLU 218.A O no hydrogen 2.918 N/A SER 113.A OG GLU 218.A O no hydrogen 3.096 N/A SER 113.A OG ILE 219.A OXT no hydrogen 2.841 N/A ARG 114.A NE GLU 218.A OE1 no hydrogen 2.835 N/A ARG 114.A NH2 GLU 218.A OE1 no hydrogen 2.607 N/A ILE 116.A N TYR 216.A O no hydrogen 2.822 N/A LEU 118.A N CYS 214.A O no hydrogen 3.050 N/A GLY 121.A N ALA 211.A O no hydrogen 2.842 N/A ASP 122.A N PRO 119.A O no hydrogen 3.278 N/A ALA 125.A N ASP 122.A OD1 no hydrogen 2.902 N/A LEU 126.A N ASP 122.A O no hydrogen 3.004 N/A LYS 127.A N GLU 123.A O no hydrogen 2.897 N/A GLU 128.A N ASP 124.A O no hydrogen 3.065 N/A ALA 129.A N ALA 125.A O no hydrogen 3.078 N/A VAL 130.A N LEU 126.A O no hydrogen 2.925 N/A ALA 131.A N LYS 127.A O no hydrogen 2.861 N/A THR 132.A N GLU 128.A O no hydrogen 2.757 N/A THR 132.A OG1 GLU 128.A O no hydrogen 2.746 N/A LYS 133.A N ALA 129.A O no hydrogen 2.657 N/A GLY 134.A N ALA 129.A O no hydrogen 3.184 N/A VAL 136.A N VAL 170.A O no hydrogen 3.057 N/A SER 137.A N SER 215.A O no hydrogen 2.882 N/A SER 137.A OG SER 30.A O no hydrogen 3.098 N/A SER 137.A OG SER 30.A OG no hydrogen 3.229 N/A VAL 138.A N VAL 168.A O no hydrogen 2.925 N/A ILE 140.A N HIS 166.A O no hydrogen 2.811 N/A ASP 141.A N CYS 208.A O no hydrogen 2.839 N/A ALA 142.A N ASN 165.A OD1 no hydrogen 2.912 N/A SER 143.A N ASP 141.A OD1 no hydrogen 3.125 N/A SER 143.A OG ASP 141.A OD1 no hydrogen 2.683 N/A HIS 144.A NE2 ASP 141.A OD2 no hydrogen 3.138 N/A SER 146.A OG TYR 155.A OH no hydrogen 2.800 N/A SER 146.A OG ASP 157.A OD2 no hydrogen 2.475 N/A PHE 147.A N HIS 144.A O no hydrogen 3.049 N/A PHE 148.A N SER 145.A O no hydrogen 2.983 N/A PHE 149.A N SER 145.A O no hydrogen 3.146 N/A PHE 149.A N SER 146.A O no hydrogen 3.221 N/A TYR 150.A N SER 146.A O no hydrogen 3.039 N/A TYR 150.A OH GLY 153.A O no hydrogen 2.694 N/A TYR 155.A N ARG 199.A O no hydrogen 2.791 N/A TYR 155.A OH SER 146.A OG no hydrogen 2.800 N/A SER 159.A N ASP 157.A OD1 no hydrogen 3.034 N/A SER 159.A OG ASP 157.A OD1 no hydrogen 3.550 N/A CYS 160.A N ASP 157.A O no hydrogen 3.008 N/A CYS 160.A SG ASP 141.A O no hydrogen 3.205 N/A THR 161.A N ASP 141.A OD2 no hydrogen 2.881 N/A THR 161.A OG1 ASP 141.A OD2 no hydrogen 2.741 N/A ASN 163.A N THR 161.A OG1 no hydrogen 3.119 N/A ASN 165.A N ILE 140.A O no hydrogen 2.889 N/A ASN 165.A ND2 ASP 141.A OD1 no hydrogen 3.051 N/A HIS 166.A N ILE 140.A O no hydrogen 3.016 N/A HIS 166.A ND1 ASN 165.A OD1 no hydrogen 2.707 N/A VAL 168.A N VAL 138.A O no hydrogen 2.848 N/A LEU 169.A N LYS 185.A O no hydrogen 3.161 N/A VAL 170.A N VAL 136.A O no hydrogen 2.806 N/A VAL 171.A N LEU 183.A O no hydrogen 2.822 N/A TYR 173.A N VAL 6.A O no hydrogen 2.888 N/A TYR 173.A OH PRO 3.A O no hydrogen 2.797 N/A GLY 174.A N TYR 181.A O no hydrogen 3.130 N/A THR 175.A OG1 ASP 180.A OD1 no hydrogen 2.723 N/A LEU 176.A N LYS 179.A O no hydrogen 2.812 N/A LYS 179.A N LEU 176.A O no hydrogen 3.060 N/A TYR 181.A N GLY 174.A O no hydrogen 2.881 N/A TRP 182.A N MET 200.A O no hydrogen 2.727 N/A TRP 182.A NE1 GLU 123.A OE1 no hydrogen 3.074 N/A LEU 183.A N GLY 172.A O no hydrogen 2.852 N/A VAL 184.A N ILE 198.A O no hydrogen 2.891 N/A LYS 185.A N LEU 169.A O no hydrogen 2.696 N/A LYS 185.A NZ THR 15.A O no hydrogen 3.148 N/A LYS 185.A NZ THR 15.A OG1 no hydrogen 3.018 N/A LYS 185.A NZ GLU 16.A O no hydrogen 3.352 N/A ASN 186.A N GLY 196.A O no hydrogen 3.078 N/A SER 187.A N ASN 186.A OD1 no hydrogen 2.860 N/A SER 187.A OG GLN 20.A OE1 no hydrogen 2.702 N/A GLY 189.A N LYS 18.A O no hydrogen 2.785 N/A PHE 192.A N GLY 189.A O no hydrogen 3.359 N/A ASP 194.A N TYR 197.A O no hydrogen 2.647 N/A GLY 196.A N PHE 192.A O no hydrogen 2.745 N/A TYR 197.A N ASP 194.A O no hydrogen 3.170 N/A ILE 198.A N VAL 184.A O no hydrogen 2.972 N/A ARG 199.A N TYR 150.A OH no hydrogen 3.383 N/A MET 200.A N TRP 182.A O no hydrogen 2.925 N/A ALA 201.A N TYR 155.A O no hydrogen 2.903 N/A ARG 202.A N ASP 180.A O no hydrogen 3.044 N/A ARG 202.A NE TYR 181.A O no hydrogen 3.086 N/A ARG 202.A NH2 GLY 174.A O no hydrogen 2.889 N/A ASN 203.A N GLU 123.A OE1 no hydrogen 2.890 N/A ASN 203.A ND2 ASP 180.A OD2 no hydrogen 2.828 N/A ASN 206.A N GLU 123.A OE2 no hydrogen 2.841 N/A ASN 206.A ND2 SER 212.A OG no hydrogen 2.858 N/A CYS 208.A SG ASP 141.A O no hydrogen 3.820 N/A GLY 209.A N ASN 206.A O no hydrogen 3.024 N/A ILE 210.A N HIS 207.A O no hydrogen 3.209 N/A ALA 211.A N ASN 206.A OD1 no hydrogen 2.818 N/A SER 212.A N GLY 209.A O no hydrogen 2.940 N/A TYR 213.A OH THR 74.A OG1 no hydrogen 2.667 N/A CYS 214.A SG ILE 210.A O no hydrogen 3.548 N/A SER 215.A N SER 137.A O no hydrogen 2.837 N/A TYR 216.A N ILE 116.A O no hydrogen 2.898 N/A GLU 218.A N ARG 114.A O no hydrogen 2.753 N/A