Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 25.A O no hydrogen 3.025 N/A GLN 3.A NE2 GLN 5.A OE1 no hydrogen 2.776 N/A GLN 5.A N THR 23.A O no hydrogen 2.856 N/A GLN 6.A N GLN 111.A OE1 no hydrogen 2.901 N/A GLN 6.A NE2 TYR 94.A O no hydrogen 2.908 N/A GLN 6.A NE2 THR 113.A OG1 no hydrogen 3.148 N/A SER 7.A N ALA 21.A O no hydrogen 2.872 N/A SER 7.A OG ALA 21.A O no hydrogen 3.197 N/A GLU 10.A N THR 114.A O no hydrogen 2.856 N/A VAL 12.A N THR 116.A O no hydrogen 2.880 N/A GLY 15.A N LEU 86.A O no hydrogen 2.810 N/A ALA 16.A N LYS 13.A O no hydrogen 3.282 N/A VAL 18.A N LEU 83.A O no hydrogen 3.036 N/A LEU 20.A N LEU 81.A O no hydrogen 2.805 N/A ALA 21.A N SER 7.A OG no hydrogen 2.950 N/A CYS 22.A N ALA 79.A O no hydrogen 2.856 N/A THR 23.A N GLN 5.A O no hydrogen 2.887 N/A ALA 24.A N ASN 77.A O no hydrogen 2.975 N/A SER 25.A N GLN 3.A O no hydrogen 2.948 N/A ILE 29.A N ASN 77.A OD1 no hydrogen 2.952 N/A ASP 31.A N ASN 28.A O no hydrogen 2.893 N/A THR 32.A N ILE 29.A O no hydrogen 3.189 N/A THR 32.A OG1 ASP 100.A OD2 no hydrogen 2.752 N/A TYR 33.A N GLY 99.A O no hydrogen 3.257 N/A ILE 34.A N ILE 51.A O no hydrogen 2.948 N/A HIS 35.A N VAL 97.A O no hydrogen 2.794 N/A TRP 36.A N GLY 49.A O no hydrogen 2.986 N/A VAL 37.A N TYR 95.A O no hydrogen 2.811 N/A LYS 38.A N GLU 46.A O no hydrogen 2.749 N/A LYS 38.A NZ GLU 89.A O no hydrogen 2.799 N/A GLN 39.A N VAL 93.A O no hydrogen 2.717 N/A GLN 39.A NE2 GLN 157.A OE1 no hydrogen 2.895 N/A GLY 40.A N GLY 44.A O no hydrogen 3.188 N/A GLY 44.A N GLY 40.A O no hydrogen 3.062 N/A GLU 46.A N LYS 38.A O no hydrogen 2.796 N/A TRP 47.A NE1 HIS 35.A ND1 no hydrogen 2.964 N/A ILE 48.A N TRP 36.A O no hydrogen 2.924 N/A ARG 50.A N LYS 59.A O no hydrogen 2.880 N/A ARG 50.A NE ASP 102.A OD1 no hydrogen 2.817 N/A ARG 50.A NE ASP 102.A OD2 no hydrogen 3.422 N/A ARG 50.A NH1 ASN 57.A O no hydrogen 3.313 N/A ARG 50.A NH2 ASP 102.A OD2 no hydrogen 3.032 N/A ILE 51.A N ILE 34.A O no hydrogen 2.845 N/A ASP 52.A N ASN 57.A O no hydrogen 2.854 N/A ALA 54.A N ASP 52.A OD1 no hydrogen 3.000 N/A ASN 55.A N ASP 52.A O no hydrogen 3.234 N/A GLY 56.A N ASP 52.A O no hydrogen 2.738 N/A ASN 57.A N ASN 55.A OD1 no hydrogen 2.974 N/A LYS 59.A N ARG 50.A O no hydrogen 3.068 N/A ASP 61.A N ILE 48.A O no hydrogen 3.012 N/A LYS 63.A N ASP 61.A OD1 no hydrogen 3.012 N/A LYS 63.A NZ GLN 43.A OE1 no hydrogen 3.023 N/A LYS 63.A NZ GLU 46.A OE2 no hydrogen 3.128 N/A PHE 64.A N ASP 61.A O no hydrogen 2.810 N/A GLN 65.A N SER 62.A O no hydrogen 3.307 N/A LYS 67.A N PHE 64.A O no hydrogen 3.057 N/A LYS 67.A NZ SER 84.A O no hydrogen 3.034 N/A LYS 67.A NZ SER 85.A O no hydrogen 2.909 N/A LYS 67.A NZ ASP 90.A OD2 no hydrogen 2.759 N/A ALA 68.A N PHE 64.A O no hydrogen 2.930 N/A THR 69.A N HIS 82.A O no hydrogen 2.827 N/A ILE 70.A N TYR 60.A OH no hydrogen 2.895 N/A THR 71.A N TYR 80.A O no hydrogen 3.092 N/A ASP 73.A N THR 78.A O no hydrogen 2.884 N/A SER 75.A N ASP 73.A OD1 no hydrogen 3.042 N/A SER 76.A OG ASP 73.A OD2 no hydrogen 2.923 N/A SER 76.A OG THR 78.A OG1 no hydrogen 3.278 N/A ASN 77.A N THR 74.A O no hydrogen 3.094 N/A ASN 77.A ND2 ALA 24.A O no hydrogen 3.167 N/A ASN 77.A ND2 PHE 27.A O no hydrogen 2.750 N/A THR 78.A N ASP 73.A O no hydrogen 3.143 N/A THR 78.A OG1 SER 76.A O no hydrogen 3.099 N/A THR 78.A OG1 SER 76.A OG no hydrogen 3.278 N/A ALA 79.A N CYS 22.A O no hydrogen 2.944 N/A TYR 80.A N THR 71.A O no hydrogen 2.896 N/A LEU 81.A N LEU 20.A O no hydrogen 2.988 N/A HIS 82.A N THR 69.A O no hydrogen 2.773 N/A LEU 83.A N VAL 18.A O no hydrogen 2.885 N/A SER 84.A N LYS 67.A O no hydrogen 3.038 N/A SER 84.A OG ASP 66.A O no hydrogen 3.531 N/A SER 84.A OG LYS 67.A O no hydrogen 3.459 N/A LEU 86.A N ALA 16.A O no hydrogen 2.820 N/A THR 87.A N ASP 90.A OD2 no hydrogen 2.852 N/A THR 87.A OG1 ASP 90.A OD2 no hydrogen 3.568 N/A GLU 89.A N THR 87.A OG1 no hydrogen 3.305 N/A ASP 90.A N THR 87.A O no hydrogen 3.014 N/A THR 91.A N SER 88.A O no hydrogen 3.244 N/A THR 91.A OG1 SER 88.A O no hydrogen 3.420 N/A ALA 92.A N VAL 115.A O no hydrogen 3.072 N/A VAL 93.A N GLN 39.A O no hydrogen 3.036 N/A TYR 94.A N THR 113.A O no hydrogen 2.779 N/A TYR 94.A OH ASP 90.A O no hydrogen 2.489 N/A TYR 95.A N VAL 37.A O no hydrogen 2.756 N/A TYR 95.A OH GLY 161.A O no hydrogen 2.592 N/A CYS 96.A N GLN 6.A OE1 no hydrogen 2.983 N/A CYS 96.A SG HIS 35.A O no hydrogen 3.973 N/A VAL 97.A N HIS 35.A O no hydrogen 2.893 N/A ARG 98.A N TYR 108.A O no hydrogen 2.999 N/A ARG 98.A NE ASP 107.A OD1 no hydrogen 3.135 N/A ARG 98.A NH2 ASP 107.A OD2 no hydrogen 3.134 N/A GLY 99.A N TYR 33.A O no hydrogen 3.088 N/A VAL 104.A N TYR 101.A O no hydrogen 3.224 N/A PHE 106.A N TYR 155.A OH no hydrogen 2.930 N/A ASP 107.A N ARG 98.A O no hydrogen 3.098 N/A TRP 109.A NE1 PHE 106.A O no hydrogen 3.018 N/A GLY 110.A N CYS 96.A O no hydrogen 2.663 N/A GLN 111.A N GLN 111.A OE1 no hydrogen 2.840 N/A GLN 111.A NE2 GLN 6.A O no hydrogen 2.960 N/A GLY 112.A N GLN 6.A OE1 no hydrogen 3.059 N/A THR 113.A N TYR 94.A O no hydrogen 2.806 N/A THR 113.A OG1 SER 7.A O no hydrogen 2.711 N/A VAL 115.A N ALA 92.A O no hydrogen 2.820 N/A THR 116.A N GLU 10.A O no hydrogen 2.853 N/A VAL 117.A N THR 91.A OG1 no hydrogen 3.091 N/A SER 118.A N VAL 12.A O no hydrogen 2.820 N/A SER 118.A OG VAL 12.A O no hydrogen 3.424 N/A GLN 122.A N SER 145.A OG no hydrogen 2.943 N/A THR 124.A N ARG 143.A O no hydrogen 2.957 N/A GLN 125.A NE2 TYR 205.A O no hydrogen 2.825 N/A SER 126.A N SER 141.A O no hydrogen 3.052 N/A LEU 130.A N LYS 222.A O no hydrogen 2.972 N/A ALA 132.A N GLU 224.A O no hydrogen 3.045 N/A SER 133.A N ASP 136.A OD2 no hydrogen 2.980 N/A GLY 135.A N LEU 197.A O no hydrogen 2.845 N/A ASP 136.A N SER 133.A O no hydrogen 3.001 N/A VAL 138.A N ILE 194.A O no hydrogen 2.944 N/A THR 139.A OG1 THR 193.A OG1 no hydrogen 2.855 N/A ILE 140.A N LEU 192.A O no hydrogen 2.898 N/A SER 141.A N SER 126.A O no hydrogen 2.916 N/A CYS 142.A N TYR 190.A O no hydrogen 2.937 N/A ARG 143.A N THR 124.A O no hydrogen 2.820 N/A ALA 144.A N THR 188.A O no hydrogen 2.809 N/A SER 145.A N GLN 122.A O no hydrogen 2.911 N/A ILE 148.A N GLY 187.A O no hydrogen 3.172 N/A SER 149.A N ASP 147.A OD1 no hydrogen 2.859 N/A ASN 150.A N TYR 190.A OH no hydrogen 3.064 N/A ASN 150.A ND2 THR 170.A OG1 no hydrogen 2.977 N/A ASN 150.A ND2 GLY 185.A O no hydrogen 3.042 N/A PHE 151.A N ILE 148.A O no hydrogen 2.963 N/A LEU 152.A N ASN 150.A O no hydrogen 2.882 N/A ASP 153.A N GLN 208.A O no hydrogen 2.854 N/A TRP 154.A N ILE 167.A O no hydrogen 2.787 N/A TYR 155.A N PHE 206.A O no hydrogen 2.721 N/A TYR 155.A OH ASP 153.A OD2 no hydrogen 3.387 N/A TYR 155.A OH GLN 208.A OE1 no hydrogen 2.621 N/A GLN 156.A N LYS 164.A O no hydrogen 2.911 N/A GLN 156.A NE2 TYR 205.A OH no hydrogen 2.970 N/A GLN 157.A N THR 204.A O no hydrogen 2.795 N/A GLN 157.A NE2 GLN 39.A OE1 no hydrogen 2.775 N/A LYS 158.A N THR 162.A O no hydrogen 2.839 N/A GLY 161.A N LYS 158.A O no hydrogen 2.868 N/A THR 162.A N ASP 160.A OD1 no hydrogen 2.983 N/A THR 162.A OG1 ASP 160.A OD1 no hydrogen 2.594 N/A LYS 164.A N GLN 156.A O no hydrogen 2.928 N/A LEU 166.A N TRP 154.A O no hydrogen 2.925 N/A ILE 167.A N TRP 154.A O no hydrogen 3.319 N/A TYR 168.A N ARG 172.A O no hydrogen 2.847 N/A TYR 169.A N ASP 153.A OD1 no hydrogen 3.305 N/A THR 170.A N LEU 152.A O no hydrogen 2.807 N/A THR 170.A OG1 ASN 150.A O no hydrogen 2.796 N/A SER 171.A N TYR 169.A O no hydrogen 2.766 N/A ARG 172.A N TYR 168.A O no hydrogen 2.905 N/A HIS 174.A N LEU 166.A O no hydrogen 2.881 N/A VAL 177.A N HIS 174.A O no hydrogen 3.129 N/A ARG 180.A NH1 ASP 201.A OD1 no hydrogen 3.365 N/A ARG 180.A NH1 ASP 201.A OD2 no hydrogen 2.515 N/A ARG 180.A NH2 ASP 201.A OD1 no hydrogen 2.981 N/A PHE 181.A N PRO 178.A O no hydrogen 3.187 N/A SER 182.A N THR 193.A O no hydrogen 2.937 N/A SER 184.A N SER 191.A O no hydrogen 3.008 N/A SER 184.A OG GLY 183.A O no hydrogen 3.202 N/A SER 186.A N ASP 189.A O no hydrogen 3.019 N/A THR 188.A OG1 ASP 189.A OD1 no hydrogen 2.848 N/A ASP 189.A N SER 186.A O no hydrogen 3.149 N/A TYR 190.A N CYS 142.A O no hydrogen 3.094 N/A TYR 190.A OH GLY 187.A O no hydrogen 2.660 N/A SER 191.A N SER 184.A O no hydrogen 2.938 N/A LEU 192.A N ILE 140.A O no hydrogen 2.814 N/A THR 193.A N SER 182.A O no hydrogen 2.801 N/A THR 193.A OG1 THR 139.A OG1 no hydrogen 2.855 N/A ILE 194.A N VAL 138.A O no hydrogen 2.889 N/A SER 195.A N ARG 180.A O no hydrogen 3.038 N/A SER 195.A OG ARG 180.A O no hydrogen 3.468 N/A LEU 197.A N ASP 136.A O no hydrogen 2.886 N/A GLU 198.A N ASP 201.A OD2 no hydrogen 2.948 N/A ASP 201.A N GLU 198.A O no hydrogen 2.929 N/A ILE 202.A N GLN 199.A O no hydrogen 3.427 N/A ALA 203.A N LEU 223.A O no hydrogen 3.338 N/A THR 204.A N GLN 157.A O no hydrogen 2.945 N/A TYR 205.A N THR 221.A O no hydrogen 2.809 N/A TYR 205.A OH ASP 201.A O no hydrogen 2.699 N/A PHE 206.A N TYR 155.A O no hydrogen 2.819 N/A CYS 207.A N GLN 125.A OE1 no hydrogen 3.174 N/A GLN 208.A N ASP 153.A O no hydrogen 2.943 N/A GLN 208.A NE2 TYR 103.A O no hydrogen 3.056 N/A GLN 208.A NE2 GLN 209.A O no hydrogen 2.883 N/A GLN 209.A N THR 216.A O no hydrogen 2.995 N/A GLN 209.A NE2 THR 212.A O no hydrogen 2.924 N/A GLN 209.A NE2 THR 216.A OG1 no hydrogen 3.244 N/A GLY 210.A N PHE 151.A O no hydrogen 2.897 N/A ASN 211.A N GLN 209.A OE1 no hydrogen 3.114 N/A THR 212.A N GLN 209.A OE1 no hydrogen 3.003 N/A THR 212.A OG1 ASN 211.A OD1 no hydrogen 2.976 N/A THR 216.A OG1 ILE 121.A O no hydrogen 2.728 N/A GLY 218.A N CYS 207.A O no hydrogen 2.860 N/A GLY 220.A N GLN 125.A OE1 no hydrogen 2.859 N/A THR 221.A N TYR 205.A O no hydrogen 2.939 N/A THR 221.A OG1 PRO 127.A O no hydrogen 2.622 N/A LYS 222.A N SER 128.A O no hydrogen 2.963 N/A LEU 223.A N ALA 203.A O no hydrogen 2.824 N/A GLU 224.A N LEU 130.A O no hydrogen 2.864 N/A LYS 226.A N ALA 132.A O no hydrogen 2.707 N/A