Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qs9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N LYS 64.A O no hydrogen 2.789 N/A SER 3.A OG LYS 64.A O no hydrogen 3.489 N/A LYS 4.A NZ HIS 60.A O no hydrogen 2.804 N/A LYS 4.A NZ THR 65.A OG1 no hydrogen 3.369 N/A ALA 5.A N GLN 36.A O no hydrogen 2.993 N/A VAL 6.A N ILE 66.A O no hydrogen 2.865 N/A ILE 7.A N LEU 38.A O no hydrogen 2.845 N/A VAL 8.A N ILE 68.A O no hydrogen 2.884 N/A GLY 10.A N TYR 22.A OH no hydrogen 3.207 N/A GLY 12.A N PRO 44.A O no hydrogen 2.672 N/A VAL 16.A N ASN 41.A OD1 no hydrogen 2.783 N/A THR 17.A N ASP 15.A OD1 no hydrogen 3.102 N/A THR 17.A OG1 ASP 15.A OD1 no hydrogen 2.701 N/A THR 18.A N ASP 15.A O no hydrogen 3.147 N/A TRP 21.A NE1 PHE 161.A O no hydrogen 2.831 N/A VAL 25.A N TRP 21.A O no hydrogen 3.023 N/A LYS 26.A N TYR 22.A O no hydrogen 2.900 N/A LYS 26.A NZ GLU 30.A OE2 no hydrogen 2.705 N/A LYS 26.A NZ CYS 37.A O no hydrogen 2.827 N/A LYS 27.A N GLY 23.A O no hydrogen 3.004 N/A GLU 28.A N TRP 24.A O no hydrogen 2.929 N/A LEU 29.A N VAL 25.A O no hydrogen 2.820 N/A GLU 30.A N LYS 26.A O no hydrogen 2.951 N/A LYS 31.A N GLU 28.A O no hydrogen 3.101 N/A LYS 31.A NZ GLU 28.A OE2 no hydrogen 2.814 N/A ILE 32.A N LEU 29.A O no hydrogen 3.171 N/A PHE 35.A N ILE 32.A O no hydrogen 3.074 N/A CYS 37.A SG ALA 5.A O no hydrogen 3.978 N/A LEU 38.A N ALA 5.A O no hydrogen 2.932 N/A LYS 40.A NZ GLU 58.A O no hydrogen 2.876 N/A ASN 41.A ND2 ASP 15.A OD2 no hydrogen 3.057 N/A THR 46.A OG1 ASN 102.A OD1 no hydrogen 3.168 N/A ALA 47.A N ASP 43.A O no hydrogen 2.849 N/A ARG 48.A N ASP 43.A OD1 no hydrogen 2.961 N/A ARG 48.A NH1 ASP 43.A OD1 no hydrogen 3.060 N/A GLU 49.A N SER 106.A O no hydrogen 2.944 N/A ILE 51.A N ARG 48.A O no hydrogen 2.962 N/A TRP 52.A N ARG 48.A O no hydrogen 2.823 N/A TRP 52.A NE1 PRO 42.A O no hydrogen 2.703 N/A LEU 53.A N GLU 49.A O no hydrogen 3.177 N/A PHE 55.A N ILE 51.A O no hydrogen 3.319 N/A THR 57.A N PRO 54.A O no hydrogen 2.969 N/A THR 57.A OG1 PRO 54.A O no hydrogen 3.325 N/A THR 57.A OG1 GLU 58.A OE2 no hydrogen 2.590 N/A GLU 58.A N PHE 55.A O no hydrogen 2.809 N/A LEU 59.A N PHE 55.A O no hydrogen 3.053 N/A ASP 62.A N THR 65.A OG1 no hydrogen 3.020 N/A LYS 64.A N ASP 62.A OD1 no hydrogen 2.773 N/A LYS 64.A NZ SER 1.A O no hydrogen 2.684 N/A THR 65.A N ASP 62.A O no hydrogen 3.053 N/A THR 65.A OG1 HIS 60.A O no hydrogen 3.513 N/A THR 65.A OG1 ASP 62.A O no hydrogen 3.540 N/A THR 65.A OG1 ASP 62.A OD1 no hydrogen 3.038 N/A ILE 66.A N LYS 4.A O no hydrogen 2.935 N/A ILE 67.A N ALA 87.A O no hydrogen 2.856 N/A ILE 68.A N VAL 6.A O no hydrogen 2.826 N/A GLY 69.A N VAL 89.A O no hydrogen 2.934 N/A HIS 70.A N VAL 8.A O no hydrogen 2.952 N/A SER 71.A N VAL 91.A O no hydrogen 2.877 N/A SER 71.A OG HIS 160.A NE2 no hydrogen 2.859 N/A GLY 73.A N HIS 70.A O no hydrogen 2.830 N/A ALA 74.A N SER 71.A O no hydrogen 2.782 N/A ILE 75.A N SER 71.A O no hydrogen 2.964 N/A ALA 76.A N SER 72.A O no hydrogen 2.820 N/A ALA 77.A N GLY 73.A O no hydrogen 2.979 N/A ARG 78.A NE TYR 108.A O no hydrogen 2.905 N/A ARG 78.A NH1 GLU 81.A OE1 no hydrogen 2.793 N/A ARG 78.A NH1 GLU 81.A OE2 no hydrogen 3.467 N/A ARG 78.A NH1 PRO 112.A O no hydrogen 3.096 N/A ARG 78.A NH2 TYR 108.A O no hydrogen 2.793 N/A ARG 78.A NH2 ARG 111.A O no hydrogen 2.770 N/A TYR 79.A N ALA 76.A O no hydrogen 2.840 N/A TYR 79.A OH CYS 61.A O no hydrogen 2.793 N/A ALA 80.A N ALA 77.A O no hydrogen 2.940 N/A GLU 81.A N ARG 78.A O no hydrogen 3.078 N/A THR 82.A N TYR 79.A O no hydrogen 3.231 N/A THR 82.A OG1 HIS 83.A ND1 no hydrogen 3.097 N/A HIS 83.A N TYR 79.A O no hydrogen 3.049 N/A HIS 83.A ND1 TYR 79.A O no hydrogen 2.881 N/A HIS 83.A NE2 GLU 56.A OE2 no hydrogen 2.992 N/A ARG 84.A NH1 ALA 120.A O no hydrogen 2.930 N/A VAL 85.A N ASN 121.A O no hydrogen 3.092 N/A TYR 86.A OH LEU 176.A O no hydrogen 2.757 N/A ALA 87.A N THR 65.A O no hydrogen 3.336 N/A ILE 88.A N TYR 124.A O no hydrogen 3.003 N/A VAL 89.A N ILE 67.A O no hydrogen 2.733 N/A LEU 90.A N VAL 126.A O no hydrogen 2.734 N/A VAL 91.A N GLY 69.A O no hydrogen 2.874 N/A SER 92.A N PHE 128.A O no hydrogen 2.901 N/A TYR 94.A OH GLU 103.A OE1 no hydrogen 2.646 N/A THR 95.A N GLU 140.A OE1 no hydrogen 2.864 N/A THR 95.A OG1 GLU 143.A OE1 no hydrogen 2.736 N/A SER 96.A N GLU 140.A OE1 no hydrogen 2.939 N/A SER 96.A OG GLU 140.A OE1 no hydrogen 3.467 N/A SER 96.A OG GLU 140.A OE2 no hydrogen 2.571 N/A LEU 98.A N SER 96.A OG no hydrogen 3.096 N/A GLY 99.A N ASP 97.A OD1 no hydrogen 2.737 N/A ASP 100.A N ASP 97.A O no hydrogen 2.837 N/A ASN 102.A N ASP 100.A OD1 no hydrogen 2.770 N/A ASN 102.A ND2 ILE 45.A O no hydrogen 3.038 N/A GLU 103.A N ASP 100.A OD1 no hydrogen 3.099 N/A ARG 104.A N ASP 100.A O no hydrogen 2.919 N/A ARG 104.A NE GLU 101.A OE1 no hydrogen 3.081 N/A ARG 104.A NH2 GLU 101.A OE2 no hydrogen 2.848 N/A ALA 105.A N GLU 101.A O no hydrogen 2.897 N/A SER 106.A N GLU 103.A O no hydrogen 3.067 N/A SER 106.A OG GLU 103.A O no hydrogen 2.617 N/A GLY 107.A N ARG 104.A O no hydrogen 3.087 N/A TYR 108.A N SER 106.A OG no hydrogen 3.163 N/A TYR 108.A OH ALA 47.A O no hydrogen 2.850 N/A THR 110.A OG1 GLY 107.A O no hydrogen 3.471 N/A ARG 111.A NH1 GLU 49.A OE1 no hydrogen 2.786 N/A ARG 111.A NH2 GLU 49.A OE1 no hydrogen 3.472 N/A ARG 111.A NH2 GLU 49.A OE2 no hydrogen 2.727 N/A TRP 113.A NE1 THR 95.A O no hydrogen 2.896 N/A GLN 114.A N GLU 81.A OE1 no hydrogen 2.978 N/A GLN 114.A NE2 GLU 81.A OE2 no hydrogen 2.876 N/A LYS 117.A NZ GLN 114.A OE1 no hydrogen 2.900 N/A ILE 118.A N GLN 114.A O no hydrogen 3.178 N/A LYS 119.A N TRP 115.A O no hydrogen 2.914 N/A LYS 119.A NZ GLU 116.A OE2 no hydrogen 3.495 N/A LYS 119.A NZ ARG 147.A O no hydrogen 3.321 N/A LYS 119.A NZ GLU 149.A OE1 no hydrogen 3.104 N/A LYS 119.A NZ HIS 186.A O no hydrogen 3.052 N/A ALA 120.A N GLU 116.A O no hydrogen 2.938 N/A ASN 121.A N LYS 117.A O no hydrogen 2.910 N/A ASN 121.A ND2 ALA 80.A O no hydrogen 2.811 N/A CYS 122.A N ILE 118.A O no hydrogen 2.998 N/A CYS 122.A SG VAL 85.A O no hydrogen 3.980 N/A CYS 122.A SG TYR 124.A O no hydrogen 3.183 N/A TYR 124.A OH PRO 180.A O no hydrogen 2.692 N/A VAL 126.A N ILE 88.A O no hydrogen 2.971 N/A GLN 127.A N LYS 151.A O no hydrogen 2.980 N/A GLN 127.A NE2 GLN 141.A O no hydrogen 2.939 N/A PHE 128.A N LEU 90.A O no hydrogen 2.657 N/A GLY 129.A N HIS 153.A O no hydrogen 3.147 N/A SER 130.A OG ASP 132.A OD1 no hydrogen 2.644 N/A THR 131.A N PHE 155.A O no hydrogen 2.939 N/A THR 131.A OG1 PHE 155.A O no hydrogen 3.526 N/A ASP 133.A N SER 130.A O no hydrogen 3.206 N/A PHE 135.A N ASP 133.A OD1 no hydrogen 2.826 N/A LEU 136.A N ASP 133.A OD1 no hydrogen 3.240 N/A TRP 138.A NE1 GLN 142.A OE1 no hydrogen 3.090 N/A GLU 140.A N PRO 137.A O no hydrogen 3.011 N/A GLN 142.A N TRP 138.A O no hydrogen 2.755 N/A GLN 142.A NE2 ASP 146.A OD1 no hydrogen 2.916 N/A GLU 143.A N LYS 139.A O no hydrogen 2.916 N/A VAL 144.A N GLU 140.A O no hydrogen 3.209 N/A ALA 145.A N GLN 141.A O no hydrogen 3.149 N/A ASP 146.A N GLN 142.A O no hydrogen 2.807 N/A ARG 147.A N GLU 143.A O no hydrogen 2.823 N/A LEU 148.A N VAL 144.A O no hydrogen 2.954 N/A THR 150.A N ALA 145.A O no hydrogen 3.199 N/A THR 150.A OG1 GLN 127.A OE1 no hydrogen 2.825 N/A LYS 151.A N ILE 125.A O no hydrogen 2.965 N/A HIS 153.A N GLN 127.A O no hydrogen 2.714 N/A PHE 155.A N GLY 129.A O no hydrogen 2.861 N/A CYS 158.A N SER 130.A OG no hydrogen 2.962 N/A GLY 159.A N ASP 132.A OD1 no hydrogen 2.781 N/A HIS 160.A ND1 ASP 133.A OD2 no hydrogen 2.716 N/A HIS 160.A NE2 SER 71.A OG no hydrogen 2.859 N/A PHE 161.A N CYS 158.A O no hydrogen 2.889 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.870 N/A LEU 169.A N PHE 166.A O no hydrogen 3.110 N/A THR 171.A N HIS 167.A O no hydrogen 3.141 N/A THR 171.A OG1 HIS 167.A O no hydrogen 3.435 N/A VAL 172.A N GLU 168.A O no hydrogen 3.093 N/A VAL 173.A N LEU 169.A O no hydrogen 3.009 N/A LYS 174.A N ILE 170.A O no hydrogen 2.916 N/A SER 175.A N THR 171.A O no hydrogen 3.012 N/A SER 175.A OG VAL 172.A O no hydrogen 2.594 N/A LEU 176.A N VAL 172.A O no hydrogen 3.043 N/A LEU 177.A N VAL 173.A O no hydrogen 3.076 N/A LEU 177.A N LYS 174.A O no hydrogen 3.237 N/A LYS 178.A N SER 175.A O no hydrogen 3.173 N/A VAL 179.A N LEU 176.A O no hydrogen 3.049 N/A HIS 186.A N GLU 149.A OE1 no hydrogen 2.892 N/A HIS 186.A ND1 GLU 149.A OE2 no hydrogen 2.826 N/A HIS 188.A N GLU 116.A OE1 no hydrogen 2.897 N/A