Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5h39_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 ARG 248.A O no hydrogen 2.653 N/A GLU 4.A N HIS 2.A ND1 no hydrogen 2.901 N/A LEU 5.A N HIS 2.A O no hydrogen 3.000 N/A GLN 6.A N GLU 3.A O no hydrogen 3.072 N/A GLN 6.A NE2 GLU 3.A O no hydrogen 3.028 N/A GLN 6.A NE2 ARG 38.A O no hydrogen 2.903 N/A TYR 7.A OH MET 193.A O no hydrogen 2.539 N/A LEU 8.A N GLU 4.A O no hydrogen 3.138 N/A ARG 9.A N LEU 5.A O no hydrogen 2.783 N/A GLN 10.A N GLN 6.A O no hydrogen 2.891 N/A LEU 11.A N TYR 7.A O no hydrogen 2.964 N/A ARG 12.A N LEU 8.A O no hydrogen 3.041 N/A GLU 13.A N ARG 9.A O no hydrogen 2.843 N/A ILE 14.A N GLN 10.A O no hydrogen 2.995 N/A LEU 15.A N LEU 11.A O no hydrogen 2.957 N/A CYS 16.A N ARG 12.A O no hydrogen 2.852 N/A ARG 17.A N GLU 13.A O no hydrogen 2.830 N/A GLY 18.A N ILE 14.A O no hydrogen 2.827 N/A SER 19.A N SER 31.A O no hydrogen 2.804 N/A ARG 21.A N THR 29.A O no hydrogen 3.177 N/A ARG 21.A NH2 ASP 228.A OD2 no hydrogen 2.775 N/A THR 25.A N ASP 23.A OD2 no hydrogen 2.993 N/A THR 25.A OG1 ASP 23.A OD1 no hydrogen 3.027 N/A THR 25.A OG1 ASP 23.A OD2 no hydrogen 2.816 N/A GLY 26.A N ASP 23.A O no hydrogen 2.894 N/A ILE 27.A N THR 25.A OG1 no hydrogen 3.123 N/A GLY 28.A N ASP 23.A OD1 no hydrogen 2.963 N/A THR 29.A N ARG 21.A O no hydrogen 3.135 N/A LEU 30.A N ILE 231.A O no hydrogen 2.861 N/A SER 31.A N SER 19.A O no hydrogen 3.035 N/A LEU 32.A N ALA 229.A O no hydrogen 2.958 N/A GLY 34.A N GLY 227.A O no hydrogen 2.990 N/A MET 35.A N LEU 226.A O no hydrogen 3.221 N/A GLN 36.A NE2 THR 225.A OG1 no hydrogen 2.831 N/A ALA 37.A N HIS 224.A O no hydrogen 2.952 N/A ARG 38.A N GLN 6.A OE1 no hydrogen 2.923 N/A ARG 38.A NE GLU 221.A OE1 no hydrogen 3.141 N/A ARG 38.A NH1 GLU 221.A OE1 no hydrogen 2.755 N/A TYR 39.A N PHE 222.A O no hydrogen 2.699 N/A SER 40.A N GLU 3.A OE1 no hydrogen 2.937 N/A SER 40.A N GLU 3.A OE2 no hydrogen 3.209 N/A SER 40.A OG GLU 3.A OE2 no hydrogen 2.986 N/A LEU 41.A N GLY 220.A O no hydrogen 2.838 N/A ARG 42.A NE GLU 181.A OE1 no hydrogen 2.773 N/A ARG 42.A NE GLU 181.A OE2 no hydrogen 3.012 N/A ARG 42.A NH2 GLU 181.A OE2 no hydrogen 3.194 N/A PHE 45.A N PRO 251.A O no hydrogen 2.828 N/A LEU 47.A N PHE 45.A O no hydrogen 2.783 N/A THR 49.A N GLU 4.A OE1 no hydrogen 2.720 N/A THR 49.A N GLU 4.A OE2 no hydrogen 3.168 N/A THR 49.A OG1 GLU 4.A OE1 no hydrogen 2.765 N/A THR 49.A OG1 ARG 248.A O no hydrogen 3.327 N/A THR 50.A N GLU 4.A OE2 no hydrogen 2.813 N/A THR 50.A OG1 GLU 4.A OE2 no hydrogen 2.526 N/A LYS 51.A NZ GLY 194.A O no hydrogen 2.768 N/A VAL 53.A N TYR 275.A OH no hydrogen 2.942 N/A TRP 55.A N VAL 53.A O no hydrogen 2.772 N/A ARG 56.A NH1 GLY 79.A O no hydrogen 3.406 N/A VAL 58.A N PHE 54.A O no hydrogen 3.064 N/A VAL 59.A N TRP 55.A O no hydrogen 2.988 N/A GLN 60.A N ARG 56.A O no hydrogen 3.143 N/A GLU 61.A N GLY 57.A O no hydrogen 2.974 N/A LEU 62.A N VAL 58.A O no hydrogen 3.180 N/A LEU 63.A N VAL 59.A O no hydrogen 3.183 N/A TRP 64.A N GLN 60.A O no hydrogen 3.042 N/A TRP 64.A NE1 ASP 71.A O no hydrogen 2.904 N/A PHE 65.A N GLU 61.A O no hydrogen 2.876 N/A LEU 66.A N LEU 62.A O no hydrogen 2.835 N/A LYS 67.A N LEU 63.A O no hydrogen 3.207 N/A LYS 67.A NZ GLU 74.A OE2 no hydrogen 2.865 N/A GLY 68.A N PHE 65.A O no hydrogen 2.823 N/A SER 69.A N TRP 64.A O no hydrogen 3.415 N/A THR 70.A OG1 TYR 120.A OH no hydrogen 2.817 N/A ASP 71.A N SER 69.A OG no hydrogen 3.135 N/A SER 72.A N GLY 103.A O no hydrogen 2.792 N/A ARG 73.A N ASP 71.A OD1 no hydrogen 3.030 N/A GLU 74.A N ASP 71.A O no hydrogen 3.134 N/A SER 76.A N SER 72.A O no hydrogen 2.846 N/A SER 76.A OG ASP 84.A OD1 no hydrogen 3.317 N/A SER 76.A OG ASP 84.A OD2 no hydrogen 2.650 N/A ARG 77.A N ARG 73.A O no hydrogen 2.931 N/A THR 78.A N LEU 75.A O no hydrogen 3.031 N/A THR 78.A OG1 LEU 75.A O no hydrogen 2.858 N/A GLY 79.A N SER 76.A O no hydrogen 2.953 N/A LYS 81.A NZ SER 76.A O no hydrogen 3.092 N/A LYS 81.A NZ SER 76.A OG no hydrogen 3.326 N/A TRP 83.A NE1 GLU 61.A OE2 no hydrogen 2.825 N/A ASP 84.A N LYS 81.A O no hydrogen 3.038 N/A GLY 87.A N TRP 83.A O no hydrogen 3.038 N/A GLY 87.A N ASP 84.A O no hydrogen 3.180 N/A SER 88.A OG LYS 85.A O no hydrogen 3.263 N/A ARG 89.A NE ARG 100.A O no hydrogen 3.308 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.896 N/A PHE 91.A N SER 88.A OG no hydrogen 2.988 N/A LEU 92.A N SER 88.A O no hydrogen 3.004 N/A ALA 93.A N ARG 89.A O no hydrogen 2.920 N/A GLY 94.A N GLU 90.A O no hydrogen 3.017 N/A ARG 95.A N PHE 91.A O no hydrogen 3.089 N/A ARG 95.A N LEU 92.A O no hydrogen 2.920 N/A ARG 95.A NE MET 164.A O no hydrogen 3.102 N/A ARG 95.A NE ALA 165.A O no hydrogen 2.958 N/A ARG 95.A NH2 MET 164.A O no hydrogen 2.647 N/A GLY 96.A N ALA 93.A O no hydrogen 2.874 N/A LEU 97.A N LEU 92.A O no hydrogen 2.840 N/A ARG 100.A N LEU 97.A O no hydrogen 3.333 N/A ARG 100.A NH1 ASP 104.A O no hydrogen 3.183 N/A ARG 100.A NH1 LEU 163.A O no hydrogen 3.121 N/A ARG 100.A NH2 LEU 163.A O no hydrogen 2.897 N/A ARG 101.A NE ASP 124.A OD1 no hydrogen 3.388 N/A ARG 101.A NE ASP 124.A OD2 no hydrogen 2.868 N/A ARG 101.A NH1 ASP 71.A OD1 no hydrogen 3.075 N/A ARG 101.A NH1 ASP 71.A OD2 no hydrogen 3.434 N/A ARG 101.A NH1 GLU 102.A O no hydrogen 2.875 N/A ARG 101.A NH2 ASP 71.A OD2 no hydrogen 2.847 N/A ARG 101.A NH2 ASP 124.A OD1 no hydrogen 2.784 N/A GLY 103.A N GLY 87.A O no hydrogen 2.712 N/A ASP 104.A N ARG 101.A O no hydrogen 3.179 N/A LEU 105.A N THR 70.A O no hydrogen 3.064 N/A GLY 106.A N ASP 104.A OD1 no hydrogen 3.161 N/A VAL 108.A N GLY 106.A O no hydrogen 2.756 N/A PHE 111.A N VAL 108.A O no hydrogen 2.932 N/A GLN 112.A N VAL 108.A O no hydrogen 3.112 N/A GLN 112.A NE2 PRO 107.A O no hydrogen 2.934 N/A GLN 112.A NE2 ASP 160.A OD2 no hydrogen 2.874 N/A TRP 113.A N TYR 109.A O no hydrogen 2.787 N/A ARG 114.A N GLY 110.A O no hydrogen 3.175 N/A ARG 114.A NE ASP 133.A OD1 no hydrogen 2.861 N/A ARG 114.A NE ASP 133.A OD2 no hydrogen 3.352 N/A ARG 114.A NH1 ASP 133.A OD2 no hydrogen 2.835 N/A ARG 114.A NH1 GLU 263.A OE1 no hydrogen 2.989 N/A ARG 114.A NH2 LEU 66.A O no hydrogen 2.875 N/A HIS 115.A N PHE 111.A O no hydrogen 2.686 N/A HIS 115.A ND1 GLN 130.A O no hydrogen 2.758 N/A PHE 116.A N PHE 132.A O no hydrogen 2.968 N/A ALA 118.A N HIS 115.A O no hydrogen 3.033 N/A TYR 120.A OH THR 70.A OG1 no hydrogen 2.817 N/A TYR 120.A OH ASP 104.A OD1 no hydrogen 2.519 N/A VAL 121.A N TYR 127.A OH no hydrogen 2.607 N/A ALA 123.A N ASP 104.A OD2 no hydrogen 2.757 N/A ASP 124.A N ASP 122.A OD1 no hydrogen 2.839 N/A ALA 125.A N ASP 122.A O no hydrogen 3.353 N/A TYR 127.A OH ASP 122.A O no hydrogen 2.788 N/A THR 128.A N ASP 126.A OD1 no hydrogen 3.149 N/A THR 128.A OG1 ASP 126.A OD1 no hydrogen 2.768 N/A GLN 130.A N TYR 127.A O no hydrogen 2.875 N/A PHE 132.A N PHE 116.A O no hydrogen 2.842 N/A GLN 134.A N TRP 113.A O no hydrogen 2.886 N/A GLN 134.A NE2 GLN 112.A O no hydrogen 2.827 N/A GLN 134.A NE2 CYS 154.A O no hydrogen 2.715 N/A LEU 135.A N TRP 113.A O no hydrogen 3.395 N/A SER 136.A N ASP 133.A OD1 no hydrogen 3.170 N/A SER 136.A OG ASP 133.A OD2 no hydrogen 2.654 N/A TYR 137.A N ASP 133.A O no hydrogen 3.151 N/A TYR 137.A OH ARG 150.A O no hydrogen 2.681 N/A ILE 138.A N GLN 134.A O no hydrogen 2.963 N/A VAL 139.A N LEU 135.A O no hydrogen 3.118 N/A ASP 140.A N SER 136.A O no hydrogen 2.955 N/A LEU 141.A N TYR 137.A O no hydrogen 3.113 N/A ILE 142.A N ILE 138.A O no hydrogen 2.871 N/A LYS 143.A N VAL 139.A O no hydrogen 3.000 N/A ASN 144.A N ASP 140.A O no hydrogen 2.849 N/A ASN 144.A ND2 ASP 140.A OD1 no hydrogen 2.779 N/A ASN 145.A N LEU 141.A O no hydrogen 2.694 N/A ASP 148.A N ASN 145.A O no hydrogen 2.951 N/A ARG 150.A N ASP 148.A OD1 no hydrogen 2.703 N/A MET 153.A N CYS 173.A O no hydrogen 2.923 N/A CYS 154.A N GLN 134.A OE1 no hydrogen 2.748 N/A CYS 154.A SG TRP 156.A O no hydrogen 3.741 N/A CYS 154.A SG LEU 171.A O no hydrogen 3.501 N/A ALA 155.A N LEU 171.A O no hydrogen 2.802 N/A ASN 157.A ND2 GLN 112.A OE1 no hydrogen 3.518 N/A ASP 160.A N ASN 157.A O no hydrogen 2.819 N/A LEU 161.A N PRO 158.A O no hydrogen 3.288 N/A LEU 163.A N ASP 160.A O no hydrogen 3.066 N/A MET 164.A N LEU 161.A O no hydrogen 3.112 N/A ALA 165.A N LEU 105.A O no hydrogen 2.791 N/A CYS 169.A N TYR 109.A OH no hydrogen 2.901 N/A HIS 170.A N TYR 109.A OH no hydrogen 2.987 N/A LEU 171.A N TYR 187.A O no hydrogen 2.841 N/A CYS 173.A N MET 153.A O no hydrogen 2.798 N/A CYS 173.A SG MET 153.A O no hydrogen 3.756 N/A GLN 174.A N GLN 185.A O no hydrogen 2.859 N/A PHE 175.A N ILE 151.A O no hydrogen 2.869 N/A TYR 176.A N SER 183.A O no hydrogen 3.045 N/A ALA 178.A N GLU 181.A O no hydrogen 3.112 N/A GLU 181.A N ALA 178.A O no hydrogen 2.974 N/A LEU 182.A N ARG 218.A O no hydrogen 2.797 N/A SER 183.A N TYR 176.A O no hydrogen 2.804 N/A SER 183.A OG GLU 221.A O no hydrogen 3.549 N/A CYS 184.A N GLU 221.A O no hydrogen 2.971 N/A GLN 185.A N GLN 174.A O no hydrogen 2.856 N/A LEU 186.A N ILE 223.A O no hydrogen 2.970 N/A TYR 187.A N LEU 172.A O no hydrogen 2.977 N/A GLN 188.A N THR 225.A O no hydrogen 2.961 N/A GLN 188.A NE2 SER 190.A O no hydrogen 2.853 N/A GLN 188.A NE2 ASN 200.A OD1 no hydrogen 2.919 N/A ARG 189.A N CYS 169.A O no hydrogen 2.918 N/A ARG 189.A NE PRO 168.A O no hydrogen 2.752 N/A ARG 189.A NH2 PRO 167.A O no hydrogen 3.222 N/A ARG 189.A NH2 PRO 168.A O no hydrogen 3.323 N/A GLY 191.A N ASP 228.A O no hydrogen 2.911 N/A MET 193.A N HIS 230.A O no hydrogen 2.918 N/A GLY 194.A N ASP 192.A OD1 no hydrogen 2.898 N/A LEU 195.A N ASP 192.A OD1 no hydrogen 3.145 N/A GLY 196.A N ASP 192.A O no hydrogen 2.895 N/A VAL 197.A N ASP 192.A O no hydrogen 2.968 N/A ASN 200.A N GLY 196.A O no hydrogen 2.953 N/A ILE 201.A N VAL 197.A O no hydrogen 2.916 N/A ALA 202.A N PRO 198.A O no hydrogen 3.316 N/A SER 203.A N PHE 199.A O no hydrogen 3.020 N/A SER 203.A OG PHE 199.A O no hydrogen 3.177 N/A TYR 204.A N ASN 200.A O no hydrogen 3.270 N/A SER 205.A N ILE 201.A O no hydrogen 2.995 N/A SER 205.A OG ILE 201.A O no hydrogen 2.831 N/A LEU 206.A N ALA 202.A O no hydrogen 2.869 N/A LEU 207.A N SER 203.A O no hydrogen 2.934 N/A THR 208.A N TYR 204.A O no hydrogen 3.083 N/A THR 208.A OG1 TYR 204.A O no hydrogen 2.746 N/A TYR 209.A N SER 205.A O no hydrogen 3.043 N/A TYR 209.A OH HIS 44.A O no hydrogen 3.013 N/A MET 210.A N LEU 206.A O no hydrogen 2.931 N/A LEU 211.A N LEU 207.A O no hydrogen 2.930 N/A ALA 212.A N THR 208.A O no hydrogen 2.890 N/A HIS 213.A N TYR 209.A O no hydrogen 2.995 N/A VAL 214.A N MET 210.A O no hydrogen 3.012 N/A THR 215.A N LEU 211.A O no hydrogen 3.005 N/A THR 215.A OG1 LEU 211.A O no hydrogen 2.590 N/A THR 215.A OG1 ALA 212.A O no hydrogen 3.381 N/A GLY 216.A N HIS 213.A O no hydrogen 3.363 N/A LEU 217.A N ALA 212.A O no hydrogen 2.854 N/A ARG 218.A N GLY 180.A O no hydrogen 3.007 N/A GLY 220.A N LEU 182.A O no hydrogen 2.717 N/A GLU 221.A N SER 183.A OG no hydrogen 3.050 N/A PHE 222.A N TYR 39.A O no hydrogen 2.718 N/A ILE 223.A N CYS 184.A O no hydrogen 2.734 N/A HIS 224.A N ALA 37.A O no hydrogen 2.810 N/A HIS 224.A NE2 GLN 188.A OE1 no hydrogen 2.774 N/A THR 225.A N LEU 186.A O no hydrogen 2.973 N/A THR 225.A OG1 GLN 185.A OE1 no hydrogen 2.609 N/A LEU 226.A N MET 35.A O no hydrogen 2.935 N/A GLY 227.A N GLN 188.A O no hydrogen 2.794 N/A ASP 228.A N ARG 189.A O no hydrogen 2.882 N/A ALA 229.A N LEU 32.A O no hydrogen 2.896 N/A HIS 230.A N GLY 191.A O no hydrogen 2.906 N/A HIS 230.A ND1 ASP 228.A O no hydrogen 3.082 N/A HIS 230.A ND1 ASP 228.A OD1 no hydrogen 3.202 N/A ILE 231.A N LEU 30.A O no hydrogen 2.775 N/A LYS 233.A N GLY 28.A O no hydrogen 3.096 N/A LYS 233.A NZ ASP 20.A OD1 no hydrogen 3.017 N/A LYS 233.A NZ ASP 20.A OD2 no hydrogen 3.517 N/A HIS 235.A N TYR 232.A O no hydrogen 2.867 N/A ILE 236.A N LYS 233.A O no hydrogen 3.304 N/A LEU 239.A N HIS 235.A O no hydrogen 2.965 N/A ARG 240.A N ILE 236.A O no hydrogen 2.980 N/A LEU 241.A N GLU 237.A O no hydrogen 3.177 N/A GLN 242.A N PRO 238.A O no hydrogen 2.899 N/A GLN 242.A NE2 THR 50.A OG1 no hydrogen 2.873 N/A LEU 243.A N LEU 239.A O no hydrogen 2.823 N/A THR 244.A N LEU 241.A O no hydrogen 2.928 N/A THR 244.A OG1 LEU 241.A O no hydrogen 2.571 N/A ARG 245.A N GLN 242.A O no hydrogen 3.039 N/A ARG 245.A NH1 THR 50.A O no hydrogen 2.887 N/A ARG 245.A NH1 PRO 279.A O no hydrogen 2.969 N/A ARG 248.A N THR 49.A OG1 no hydrogen 2.815 N/A ARG 248.A NH1 CYS 276.A O no hydrogen 2.991 N/A ARG 252.A N VAL 273.A O no hydrogen 2.913 N/A GLU 254.A N ARG 271.A O no hydrogen 2.869 N/A LEU 256.A N ASP 269.A O no hydrogen 2.783 N/A ARG 257.A NE ASP 269.A OD1 no hydrogen 2.882 N/A ARG 257.A NH2 GLU 264.A O no hydrogen 2.895 N/A ARG 257.A NH2 ASP 269.A OD2 no hydrogen 2.704 N/A VAL 259.A N HIS 213.A NE2 no hydrogen 2.921 N/A SER 260.A OG GLU 264.A OE1 no hydrogen 2.975 N/A GLU 263.A N SER 261.A OG no hydrogen 3.207 N/A GLU 264.A N SER 261.A O no hydrogen 3.147 N/A THR 266.A N ASP 269.A OD2 no hydrogen 2.929 N/A ASP 268.A N THR 266.A OG1 no hydrogen 3.267 N/A ASP 269.A N THR 266.A O no hydrogen 2.934 N/A PHE 270.A N PRO 267.A O no hydrogen 3.407 N/A ARG 271.A N GLU 254.A O no hydrogen 2.769 N/A VAL 273.A N ARG 252.A O no hydrogen 2.757 N/A TYR 275.A OH LEU 48.A O no hydrogen 2.676 N/A CYS 276.A SG ASP 274.A OD1 no hydrogen 3.128 N/A HIS 278.A N THR 49.A O no hydrogen 2.825 N/A HIS 278.A NE2 THR 246.A O no hydrogen 2.732 N/A