Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o42_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ARG 75.A O no hydrogen 2.961 N/A GLU 6.A N LYS 52.A O no hydrogen 2.787 N/A ARG 7.A N LYS 52.A O no hydrogen 3.115 N/A MET 9.A N LEU 50.A O no hydrogen 2.753 N/A CYS 11.A N ASP 10.A OD1 no hydrogen 2.807 N/A CYS 11.A SG.A GLN 48.A O no hydrogen 3.779 N/A CYS 11.A SG.B TYR 83.A OH no hydrogen 3.247 N/A CYS 11.A SG.B ASP 87.A OD1 no hydrogen 3.736 N/A ARG 12.A N GLN 48.A O no hydrogen 2.885 N/A ARG 12.A NE GLN 48.A OE1 no hydrogen 2.817 N/A ARG 12.A NH2 ALA 18.A O no hydrogen 3.090 N/A ARG 12.A NH2 GLN 48.A OE1 no hydrogen 3.021 N/A GLY 14.A N GLU 46.A O no hydrogen 2.942 N/A ARG 15.A N ASN 35.A OD1 no hydrogen 2.834 N/A ARG 15.A NE GLU 43.A OE2 no hydrogen 2.930 N/A ARG 15.A NH1 ALA 36.A O no hydrogen 3.192 N/A ARG 15.A NH1 GLU 43.A OE1 no hydrogen 2.753 N/A ARG 15.A NH2 PRO 34.A O no hydrogen 2.993 N/A ARG 15.A NH2 ALA 36.A O no hydrogen 2.831 N/A GLY 17.A N GLU 46.A OE1 no hydrogen 3.029 N/A ALA 18.A N ARG 15.A O no hydrogen 2.951 N/A THR 19.A N GLY 17.A O no hydrogen 2.888 N/A GLY 20.A N TRP 63.A O no hydrogen 2.803 N/A THR 22.A OG1 THR 19.A O no hydrogen 3.462 N/A THR 23.A N GLY 20.A O no hydrogen 2.905 N/A THR 23.A OG1 GLY 20.A O no hydrogen 2.665 N/A THR 24.A N ALA 21.A O no hydrogen 3.399 N/A THR 24.A OG1 ALA 21.A O no hydrogen 3.521 N/A TYR 26.A OH HIS 60.A ND1 no hydrogen 2.740 N/A ALA 27.A N THR 24.A OG1 no hydrogen 3.054 N/A VAL 28.A N THR 24.A O no hydrogen 2.988 N/A GLU 29.A N ILE 25.A O no hydrogen 2.987 N/A ALA 30.A N TYR 26.A O no hydrogen 3.106 N/A ASP 31.A N ALA 27.A O no hydrogen 2.736 N/A GLY 32.A N VAL 28.A O no hydrogen 2.775 N/A ASN 35.A N ASP 33.A OD1 no hydrogen 2.881 N/A ALA 36.A N ASP 33.A O no hydrogen 2.976 N/A PHE 38.A N ASN 35.A O no hydrogen 3.137 N/A LYS 42.A N GLU 39.A O no hydrogen 2.948 N/A GLU 46.A N GLY 14.A O no hydrogen 2.932 N/A GLN 48.A N ARG 12.A O no hydrogen 2.831 N/A GLN 48.A NE2 ARG 15.A O no hydrogen 2.876 N/A GLN 48.A NE2 GLU 46.A OE1 no hydrogen 2.931 N/A TYR 49.A N GLU 64.A O no hydrogen 2.750 N/A LEU 50.A N ASP 10.A O no hydrogen 2.827 N/A ILE 51.A N THR 62.A O no hydrogen 2.854 N/A LYS 52.A N ARG 7.A O no hydrogen 2.939 N/A LYS 52.A NZ GLU 6.A OE1 no hydrogen 2.753 N/A LYS 52.A NZ TRP 53.A O no hydrogen 2.839 N/A LYS 52.A NZ TRP 56.A O no hydrogen 2.711 N/A TRP 53.A NE1 THR 62.A OG1 no hydrogen 2.957 N/A LYS 54.A N THR 4.A O no hydrogen 2.874 N/A TRP 56.A N TRP 53.A O no hydrogen 3.133 N/A TRP 56.A NE1 GLU 3.A OE1 no hydrogen 2.861 N/A SER 57.A OG GLU 155.A OE1 no hydrogen 2.817 N/A HIS 60.A N SER 57.A O no hydrogen 2.967 N/A HIS 60.A ND1 TYR 26.A OH no hydrogen 2.740 N/A HIS 60.A NE2 GLU 155.A OE2 no hydrogen 2.744 N/A ASN 61.A N HIS 58.A O no hydrogen 3.174 N/A ASN 61.A ND2 HIS 58.A ND1 no hydrogen 3.245 N/A THR 62.A N ILE 51.A O no hydrogen 3.268 N/A THR 62.A OG1 GLU 64.A OE2 no hydrogen 2.660 N/A TRP 63.A N THR 23.A OG1 no hydrogen 2.940 N/A GLU 64.A N TYR 49.A O no hydrogen 2.807 N/A THR 65.A N THR 68.A OG1 no hydrogen 2.924 N/A THR 68.A N THR 65.A OG1 no hydrogen 2.969 N/A THR 68.A OG1 GLU 64.A OE1 no hydrogen 2.779 N/A THR 68.A OG1 THR 65.A O no hydrogen 3.186 N/A LEU 69.A N THR 65.A O no hydrogen 3.004 N/A LYS 70.A N GLU 66.A O no hydrogen 3.024 N/A LYS 70.A NZ GLU 66.A OE2 no hydrogen 2.864 N/A GLN 71.A N GLU 67.A O no hydrogen 2.857 N/A GLN 72.A N THR 68.A O no hydrogen 3.139 N/A GLN 72.A NE2 GLU 64.A OE1 no hydrogen 3.172 N/A GLN 72.A NE2 THR 68.A O no hydrogen 2.901 N/A ASN 73.A N LYS 70.A O no hydrogen 3.096 N/A VAL 74.A N LEU 69.A O no hydrogen 3.275 N/A ARG 75.A N GLU 3.A O no hydrogen 2.863 N/A ARG 75.A NH2.A ASN 73.A OD1 no hydrogen 2.800 N/A LYS 79.A N GLY 76.A O no hydrogen 2.979 N/A LEU 80.A N MET 77.A O no hydrogen 2.987 N/A ASN 82.A N LYS 78.A O no hydrogen 3.179 N/A TYR 83.A N LYS 79.A O no hydrogen 2.924 N/A LYS 84.A N LEU 80.A O no hydrogen 2.920 N/A LYS 84.A NZ GLU 66.A OE1 no hydrogen 3.052 N/A LYS 85.A N ASP 81.A O no hydrogen 2.972 N/A LYS 86.A N ASN 82.A O no hydrogen 2.815 N/A ASP 87.A N TYR 83.A O no hydrogen 2.779 N/A GLN 88.A N LYS 84.A O no hydrogen 2.886 N/A GLU 89.A N LYS 85.A O no hydrogen 3.071 N/A THR 90.A N LYS 86.A O no hydrogen 3.036 N/A THR 90.A OG1 LYS 86.A O no hydrogen 3.295 N/A LYS 91.A N ASP 87.A O no hydrogen 3.113 N/A ARG 92.A N GLN 88.A O no hydrogen 3.170 N/A TRP 93.A N GLU 89.A O no hydrogen 3.131 N/A LEU 94.A N THR 90.A O no hydrogen 2.838 N/A LYS 95.A N LYS 91.A O no hydrogen 2.961 N/A ASN 96.A N ARG 92.A O no hydrogen 3.380 N/A ASN 96.A N TRP 93.A O no hydrogen 3.157 N/A ASP 101.A N SER 98.A OG no hydrogen 2.913 N/A VAL 102.A N SER 98.A O no hydrogen 2.957 N/A GLU 103.A N PRO 99.A O no hydrogen 2.763 N/A TYR 104.A N GLU 100.A O no hydrogen 3.104 N/A TYR 105.A N ASP 101.A O no hydrogen 3.074 N/A ASN 106.A N VAL 102.A O no hydrogen 3.106 N/A CYS 107.A N GLU 103.A O no hydrogen 3.130 N/A CYS 107.A SG GLU 103.A O no hydrogen 3.178 N/A CYS 107.A SG GLU 103.A OE2 no hydrogen 3.101 N/A GLN 108.A N TYR 104.A O no hydrogen 3.101 N/A GLN 109.A N TYR 105.A O no hydrogen 3.031 N/A GLN 109.A NE2.A TYR 105.A O no hydrogen 3.039 N/A GLU 110.A N ASN 106.A O no hydrogen 3.285 N/A LEU 111.A N CYS 107.A O no hydrogen 2.997 N/A THR 112.A N GLN 108.A O no hydrogen 3.014 N/A THR 112.A OG1 GLN 108.A O no hydrogen 2.939 N/A ASP 113.A N GLN 109.A O no hydrogen 2.905 N/A ASP 114.A N GLU 110.A O no hydrogen 2.995 N/A LEU 115.A N LEU 111.A O no hydrogen 2.959 N/A HIS 116.A N THR 112.A O no hydrogen 2.928 N/A LYS 117.A N ASP 113.A O no hydrogen 3.216 N/A GLN 118.A N ASP 114.A O no hydrogen 3.222 N/A GLN 120.A N LYS 117.A O no hydrogen 3.138 N/A GLN 120.A NE2 HIS 58.A O no hydrogen 3.017 N/A ILE 121.A N GLN 118.A O no hydrogen 2.942 N/A GLU 123.A N LYS 143.A O no hydrogen 2.736 N/A ARG 124.A N LYS 143.A O no hydrogen 3.302 N/A ARG 124.A NE TYR 149.A OH no hydrogen 3.368 N/A ARG 124.A NH2 TYR 149.A OH no hydrogen 2.981 N/A ILE 126.A N TYR 141.A O no hydrogen 2.812 N/A HIS 128.A ND1 TYR 171.A OH no hydrogen 2.732 N/A SER 129.A N ASP 139.A O no hydrogen 2.935 N/A SER 129.A OG GLN 131.A O no hydrogen 2.742 N/A GLN 131.A N GLN 131.A OE1 no hydrogen 2.776 N/A SER 133.A N TYR 137.A O no hydrogen 2.930 N/A SER 133.A OG TYR 137.A O no hydrogen 3.511 N/A GLY 136.A N SER 133.A O no hydrogen 2.951 N/A TYR 137.A N SER 133.A OG no hydrogen 3.207 N/A ASP 139.A N SER 129.A OG no hydrogen 2.869 N/A TYR 140.A N GLU 155.A O no hydrogen 2.957 N/A TYR 141.A N ALA 127.A O no hydrogen 2.839 N/A CYS 142.A N SER 153.A O no hydrogen 2.783 N/A CYS 142.A SG TYR 140.A O no hydrogen 3.713 N/A LYS 143.A N ARG 124.A O no hydrogen 2.927 N/A LYS 143.A NZ GLU 123.A OE2 no hydrogen 2.789 N/A LYS 143.A NZ TRP 144.A O no hydrogen 3.050 N/A LYS 143.A NZ LEU 147.A O no hydrogen 2.706 N/A TRP 144.A NE1 SER 153.A OG no hydrogen 2.853 N/A GLN 145.A N ILE 121.A O no hydrogen 2.822 N/A GLN 145.A NE2.B GLN 118.A OE1 no hydrogen 2.511 N/A LEU 147.A N TRP 144.A O no hydrogen 3.293 N/A SER 150.A OG GLU 151.A OE1 no hydrogen 3.101 N/A GLU 151.A N PRO 148.A O no hydrogen 2.998 N/A CYS 152.A N TYR 149.A O no hydrogen 3.028 N/A CYS 152.A SG TYR 149.A O no hydrogen 3.208 N/A SER 153.A N CYS 142.A O no hydrogen 3.105 N/A SER 153.A OG GLU 155.A OE1 no hydrogen 2.544 N/A GLU 155.A N TYR 140.A O no hydrogen 2.827 N/A LEU 159.A N ASP 156.A OD1 no hydrogen 2.849 N/A ILE 160.A N ASP 156.A O no hydrogen 2.996 N/A SER 161.A N GLY 157.A O no hydrogen 2.856 N/A SER 161.A OG GLY 157.A O no hydrogen 3.346 N/A SER 161.A OG ALA 158.A O no hydrogen 2.842 N/A LYS 162.A N LEU 159.A O no hydrogen 3.209 N/A LYS 163.A N ILE 160.A O no hydrogen 3.361 N/A LYS 163.A NZ GLU 29.A OE1 no hydrogen 2.724 N/A PHE 164.A N ILE 160.A O no hydrogen 2.819 N/A GLN 165.A NE2 ASP 169.A OD1 no hydrogen 2.886 N/A CYS 167.A SG VAL 122.A O no hydrogen 3.535 N/A ILE 168.A N PHE 164.A O no hydrogen 3.258 N/A ASP 169.A N GLN 165.A O no hydrogen 2.905 N/A GLU 170.A N ALA 166.A O no hydrogen 2.976 N/A TYR 171.A N CYS 167.A O no hydrogen 2.975 N/A TYR 171.A OH HIS 128.A ND1 no hydrogen 2.732 N/A PHE 172.A N ILE 168.A O no hydrogen 3.066 N/A SER 173.A N ASP 169.A O no hydrogen 2.952 N/A