Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2aq1_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASN 191.A OD1 no hydrogen 3.527 N/A SER 1.A OG THR 192.A O no hydrogen 3.430 N/A SER 1.A OG THR 192.A OG1 no hydrogen 3.376 N/A GLN 2.A NE2 TRP 194.A O no hydrogen 3.452 N/A MET 6.A N ASP 9.A OD1 no hydrogen 2.787 N/A ASP 9.A N MET 6.A O no hydrogen 2.718 N/A HIS 11.A N ASP 196.A OD2 no hydrogen 2.739 N/A HIS 11.A ND1 MET 198.A O no hydrogen 3.013 N/A LYS 12.A NZ PRO 7.A O no hydrogen 2.460 N/A LYS 12.A NZ LEU 10.A O no hydrogen 2.875 N/A SER 13.A N GLU 179.A O no hydrogen 2.907 N/A SER 13.A OG TYR 178.A O no hydrogen 2.563 N/A SER 13.A OG GLU 179.A OE2 no hydrogen 3.364 N/A SER 14.A N GLU 179.A OE2 no hydrogen 3.113 N/A SER 14.A OG GLU 179.A OE1 no hydrogen 2.371 N/A SER 14.A OG GLU 179.A OE2 no hydrogen 3.250 N/A GLU 15.A N LYS 12.A O no hydrogen 3.206 N/A PHE 16.A N SER 13.A O no hydrogen 2.820 N/A THR 17.A N GLY 202.A O no hydrogen 2.739 N/A MET 20.A N ASN 174.A O no hydrogen 3.230 N/A GLY 21.A N PHE 173.A O no hydrogen 2.617 N/A ASN 22.A N THR 19.A O no hydrogen 3.167 N/A MET 23.A N MET 20.A O no hydrogen 2.913 N/A LYS 24.A N MET 20.A O no hydrogen 2.826 N/A TYR 25.A N GLY 21.A O no hydrogen 2.826 N/A LEU 26.A N MET 23.A O no hydrogen 3.173 N/A TYR 27.A N LYS 24.A O no hydrogen 2.892 N/A TYR 27.A OH TYR 214.A OH no hydrogen 2.583 N/A ASP 29.A N ASN 162.A OD1 no hydrogen 2.889 N/A HIS 30.A NE2 ASN 87.A O no hydrogen 2.749 N/A VAL 32.A N GLY 85.A O no hydrogen 2.620 N/A ALA 34.A N VAL 83.A O no hydrogen 2.976 N/A LYS 36.A N ASP 82.A OD1 no hydrogen 3.042 N/A VAL 37.A N VAL 81.A O no hydrogen 2.817 N/A SER 39.A OG LYS 77.A O no hydrogen 2.775 N/A VAL 40.A N ILE 49.A O no hydrogen 2.873 N/A LYS 42.A NZ ALA 45.A O no hydrogen 2.665 N/A LYS 42.A NZ ASP 47.A O no hydrogen 2.925 N/A PHE 43.A N ASP 47.A OD2 no hydrogen 2.795 N/A LEU 44.A N ASP 47.A OD1 no hydrogen 2.718 N/A HIS 46.A NE2 GLU 66.A OE1 no hydrogen 2.803 N/A LEU 48.A N THR 65.A O no hydrogen 2.953 N/A ILE 49.A N ASP 41.A O no hydrogen 2.950 N/A TYR 50.A N VAL 63.A O no hydrogen 2.802 N/A ILE 52.A N ASP 61.A O no hydrogen 3.143 N/A SER 53.A OG ASP 61.A OD1 no hydrogen 3.474 N/A ASP 54.A N TYR 60.A O no hydrogen 2.920 N/A LEU 57.A N ASP 54.A OD1 no hydrogen 3.299 N/A LEU 57.A N ASP 54.A OD2 no hydrogen 3.332 N/A ASN 59.A N ASP 54.A OD1 no hydrogen 3.042 N/A ASP 61.A N GLY 104.A O no hydrogen 3.084 N/A LYS 62.A NZ ASN 51.A OD1 no hydrogen 3.255 N/A VAL 63.A N TYR 50.A O no hydrogen 2.928 N/A LYS 64.A N THR 106.A O no hydrogen 3.111 N/A LYS 64.A NZ GLU 66.A OE2 no hydrogen 3.062 N/A LYS 64.A NZ TYR 93.A O no hydrogen 2.921 N/A THR 65.A N LEU 48.A O no hydrogen 2.781 N/A THR 65.A OG1 GLY 110.A O no hydrogen 2.795 N/A GLU 66.A N MET 108.A O no hydrogen 2.961 N/A LEU 67.A N HIS 46.A O no hydrogen 2.758 N/A LEU 72.A N ASN 69.A OD1 no hydrogen 3.015 N/A ALA 73.A N ASN 69.A O no hydrogen 3.404 N/A LYS 74.A N GLU 70.A O no hydrogen 2.919 N/A LYS 75.A N ASP 71.A O no hydrogen 2.897 N/A TYR 76.A N ALA 73.A O no hydrogen 3.187 N/A LYS 77.A N LYS 74.A O no hydrogen 3.347 N/A GLU 79.A N TYR 76.A O no hydrogen 2.993 N/A VAL 80.A N GLU 79.A OE2 no hydrogen 3.231 N/A VAL 81.A N VAL 37.A O no hydrogen 2.723 N/A ASP 82.A N THR 113.A O no hydrogen 2.875 N/A VAL 83.A N ALA 34.A O no hydrogen 2.869 N/A TYR 84.A N GLY 111.A O no hydrogen 2.858 N/A GLY 85.A N VAL 32.A O no hydrogen 3.057 N/A SER 86.A N GLN 154.A OE1 no hydrogen 3.090 N/A SER 86.A OG LEU 26.A O no hydrogen 2.847 N/A TYR 88.A N CYS 107.A O no hydrogen 2.854 N/A CYS 92.A N TYR 89.A O no hydrogen 3.271 N/A HIS 103.A N VAL 100.A O no hydrogen 3.463 N/A LYS 105.A NZ PHE 94.A O no hydrogen 3.092 N/A THR 106.A N LYS 62.A O no hydrogen 2.934 N/A THR 106.A OG1 ASN 87.A OD1 no hydrogen 3.097 N/A THR 106.A OG1 TYR 88.A O no hydrogen 2.986 N/A CYS 107.A N TYR 88.A O no hydrogen 3.167 N/A MET 108.A N LYS 64.A O no hydrogen 2.911 N/A TYR 109.A OH SER 208.A O no hydrogen 3.107 N/A TYR 109.A OH SER 208.A OG no hydrogen 2.597 N/A GLY 110.A N GLU 66.A O no hydrogen 3.043 N/A ILE 112.A N ASN 217.A OD1 no hydrogen 2.813 N/A THR 113.A N ASP 82.A O no hydrogen 3.068 N/A HIS 115.A N VAL 80.A O no hydrogen 2.956 N/A ASN 118.A N HIS 115.A O no hydrogen 3.187 N/A ASN 118.A ND2 SER 150.A O no hydrogen 2.627 N/A HIS 119.A NE2 ASP 82.A OD2 no hydrogen 2.710 N/A ASN 124.A N ASP 121.A O no hydrogen 2.987 N/A GLN 126.A N THR 146.A O no hydrogen 2.888 N/A GLN 126.A NE2 ASN 127.A O no hydrogen 2.667 N/A VAL 128.A N VAL 144.A O no hydrogen 2.810 N/A VAL 130.A N PHE 142.A O no hydrogen 2.855 N/A ARG 131.A N ILE 227.A O no hydrogen 3.089 N/A VAL 132.A N ILE 140.A O no hydrogen 2.854 N/A TYR 133.A N VAL 229.A O no hydrogen 2.850 N/A GLU 134.A N ARG 137.A O no hydrogen 3.020 N/A ASN 135.A N LEU 231.A O no hydrogen 2.913 N/A ARG 137.A N GLU 134.A O no hydrogen 3.329 N/A THR 139.A N VAL 132.A O no hydrogen 2.864 N/A PHE 142.A N VAL 130.A O no hydrogen 2.967 N/A VAL 144.A N VAL 128.A O no hydrogen 2.907 N/A GLN 145.A NE2 ASN 127.A OD1 no hydrogen 3.479 N/A THR 146.A N GLN 126.A O no hydrogen 2.989 N/A THR 146.A OG1 GLU 155.A OE1 no hydrogen 2.734 N/A LYS 148.A N THR 146.A OG1 no hydrogen 3.333 N/A LYS 148.A NZ ASP 147.A OD1 no hydrogen 3.159 N/A LYS 148.A NZ GLU 155.A OE2 no hydrogen 2.806 N/A LYS 149.A N ASN 118.A O no hydrogen 2.655 N/A LYS 149.A NZ HIS 119.A O no hydrogen 2.740 N/A SER 150.A N ASN 118.A OD1 no hydrogen 2.709 N/A VAL 151.A N VAL 220.A O no hydrogen 3.051 N/A ALA 153.A N LYS 218.A O no hydrogen 2.926 N/A GLN 154.A NE2 TYR 109.A O no hydrogen 2.781 N/A GLU 155.A N THR 152.A OG1 no hydrogen 3.167 N/A ASP 157.A N ALA 153.A O no hydrogen 2.734 N/A ILE 158.A N GLN 154.A O no hydrogen 2.950 N/A LYS 159.A N GLU 155.A O no hydrogen 2.998 N/A LYS 159.A NZ GLN 145.A O no hydrogen 3.068 N/A ALA 160.A N LEU 156.A O no hydrogen 2.832 N/A ARG 161.A N ASP 157.A O no hydrogen 2.797 N/A ARG 161.A NE ASP 157.A OD1 no hydrogen 2.784 N/A ARG 161.A NH1 TYR 171.A OH no hydrogen 2.680 N/A ARG 161.A NH1 TYR 210.A OH no hydrogen 2.893 N/A ARG 161.A NH2 ASP 157.A OD2 no hydrogen 2.933 N/A ARG 161.A NH2 TYR 210.A OH no hydrogen 2.849 N/A ASN 162.A N ILE 158.A O no hydrogen 2.802 N/A PHE 163.A N LYS 159.A O no hydrogen 3.162 N/A LEU 164.A N ALA 160.A O no hydrogen 3.011 N/A ILE 165.A N ARG 161.A O no hydrogen 2.747 N/A ASN 166.A N ASN 162.A O no hydrogen 3.332 N/A LYS 167.A N PHE 163.A O no hydrogen 2.942 N/A LYS 168.A N LEU 164.A O no hydrogen 2.753 N/A LYS 168.A NZ GLU 134.A OE2 no hydrogen 3.225 N/A ASN 169.A N ILE 165.A O no hydrogen 3.091 N/A LEU 170.A N LEU 164.A O no hydrogen 3.243 N/A TYR 171.A OH MET 197.A O no hydrogen 2.468 N/A GLU 172.A N SER 175.A O no hydrogen 2.988 N/A SER 176.A OG LEU 170.A O no hydrogen 2.557 N/A SER 176.A OG TYR 178.A O no hydrogen 3.536 N/A TYR 178.A N SER 176.A OG no hydrogen 3.299 N/A TYR 178.A OH GLU 134.A OE2 no hydrogen 2.904 N/A GLU 179.A N THR 232.A O no hydrogen 2.817 N/A THR 180.A OG1 THR 232.A OG1 no hydrogen 2.676 N/A TYR 182.A N HIS 230.A O no hydrogen 2.941 N/A ILE 183.A N TYR 195.A O no hydrogen 3.034 N/A LYS 184.A N GLU 228.A O no hydrogen 2.744 N/A LYS 184.A NZ ASP 4.A OD1 no hydrogen 2.629 N/A LYS 184.A NZ ASP 4.A OD2 no hydrogen 2.785 N/A PHE 185.A N PHE 193.A O no hydrogen 2.724 N/A ILE 186.A N LYS 226.A O no hydrogen 2.869 N/A GLU 187.A N ASN 191.A O no hydrogen 2.819 N/A GLY 190.A N GLU 187.A O no hydrogen 2.961 N/A ASN 191.A N ASN 189.A OD1 no hydrogen 2.800 N/A ASN 191.A ND2 GLU 187.A OE1 no hydrogen 2.908 N/A THR 192.A N SER 1.A OG no hydrogen 3.104 N/A THR 192.A OG1 SER 1.A OG no hydrogen 3.376 N/A PHE 193.A N PHE 185.A O no hydrogen 3.177 N/A TRP 194.A NE1 PRO 3.A O no hydrogen 2.974 N/A TYR 195.A N ILE 183.A O no hydrogen 2.995 N/A MET 197.A N GLY 181.A O no hydrogen 2.846 N/A MET 198.A N ASP 196.A OD1 no hydrogen 2.878 N/A GLY 202.A N GLU 15.A O no hydrogen 2.883 N/A GLN 207.A NE2 ASN 22.A O no hydrogen 2.947 N/A SER 208.A OG TYR 109.A OH no hydrogen 2.597 N/A LYS 209.A N ASP 206.A OD1 no hydrogen 3.164 N/A TYR 210.A N ASP 206.A O no hydrogen 2.929 N/A TYR 210.A OH ASP 196.A O no hydrogen 2.632 N/A LEU 211.A N GLN 207.A O no hydrogen 2.899 N/A MET 212.A N SER 208.A O no hydrogen 2.936 N/A MET 212.A N LYS 209.A O no hydrogen 3.246 N/A MET 213.A N TYR 210.A O no hydrogen 3.408 N/A TYR 214.A N LEU 211.A O no hydrogen 2.899 N/A TYR 214.A OH TYR 27.A OH no hydrogen 2.583 N/A TYR 214.A OH ASP 157.A OD2 no hydrogen 2.579 N/A ASN 215.A N MET 212.A O no hydrogen 2.932 N/A ASN 215.A ND2 GLU 66.A O no hydrogen 3.550 N/A ASN 217.A N TYR 214.A O no hydrogen 3.207 N/A ASN 217.A ND2 ILE 112.A O no hydrogen 3.089 N/A LYS 218.A N ASP 216.A OD1 no hydrogen 3.002 N/A LYS 218.A NZ GLU 187.A OE1 no hydrogen 2.444 N/A VAL 220.A N VAL 151.A O no hydrogen 2.938 N/A SER 222.A N LYS 149.A O no hydrogen 2.827 N/A SER 222.A OG LYS 148.A O no hydrogen 2.648 N/A SER 222.A OG LYS 149.A O no hydrogen 3.126 N/A LYS 223.A NZ ASP 221.A OD2 no hydrogen 2.907 N/A SER 224.A N ASP 221.A O no hydrogen 3.149 N/A SER 224.A OG ASN 188.A OD1 no hydrogen 2.924 N/A SER 224.A OG ASP 221.A OD2 no hydrogen 2.531 N/A VAL 225.A N ASP 221.A O no hydrogen 2.967 N/A LYS 226.A N ILE 186.A O no hydrogen 2.888 N/A LYS 226.A NZ ILE 227.A O no hydrogen 2.924 N/A GLU 228.A N LYS 184.A O no hydrogen 2.975 N/A VAL 229.A N ARG 131.A O no hydrogen 2.921 N/A HIS 230.A N TYR 182.A O no hydrogen 2.787 N/A HIS 230.A NE2 GLU 228.A OE1 no hydrogen 2.805 N/A LEU 231.A N TYR 133.A O no hydrogen 2.880 N/A THR 232.A N THR 180.A O no hydrogen 3.151 N/A THR 232.A OG1 THR 180.A OG1 no hydrogen 2.676 N/A THR 233.A N ASN 135.A OD1 no hydrogen 2.866 N/A LYS 234.A N PRO 177.A O no hydrogen 2.991 N/A LYS 234.A NZ SER 13.A OG no hydrogen 2.585 N/A LYS 234.A NZ SER 175.A OG no hydrogen 3.228 N/A