Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3px8_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ILE 50.A O no hydrogen 2.679 N/A ILE 6.A N LEU 56.A O no hydrogen 2.888 N/A ASN 7.A ND2 GLU 58.A OE1 no hydrogen 2.788 N/A PHE 8.A N GLU 58.A O no hydrogen 2.936 N/A THR 9.A OG1 SER 60.A O no hydrogen 3.203 N/A THR 10.A N SER 60.A O no hydrogen 2.988 N/A THR 10.A OG1 SER 60.A O no hydrogen 3.439 N/A THR 10.A OG1 GLU 142.A OE1 no hydrogen 2.669 N/A ALA 11.A N THR 9.A OG1 no hydrogen 2.978 N/A ALA 13.A N THR 10.A O no hydrogen 3.194 N/A THR 14.A N SER 17.A OG no hydrogen 3.026 N/A GLN 16.A NE2 GLN 16.A O no hydrogen 3.365 N/A GLN 16.A NE2 ASN 20.A OD1 no hydrogen 2.775 N/A SER 17.A N THR 14.A OG1 no hydrogen 2.955 N/A SER 17.A OG THR 14.A O no hydrogen 3.290 N/A TYR 18.A N THR 14.A O no hydrogen 2.979 N/A TYR 18.A OH MET 171.A O no hydrogen 2.707 N/A THR 19.A N VAL 15.A O no hydrogen 2.909 N/A THR 19.A OG1 VAL 15.A O no hydrogen 2.760 N/A ASN 20.A N GLN 16.A O no hydrogen 2.862 N/A PHE 21.A N SER 17.A O no hydrogen 3.068 N/A ILE 22.A N TYR 18.A O no hydrogen 2.934 N/A ARG 23.A N THR 19.A O no hydrogen 3.020 N/A ALA 24.A N ASN 20.A O no hydrogen 3.012 N/A VAL 25.A N PHE 21.A O no hydrogen 2.940 N/A ARG 26.A N ILE 22.A O no hydrogen 2.941 N/A ARG 26.A NE ALA 176.A O no hydrogen 2.794 N/A ARG 26.A NH1 GLU 182.A OE1 no hydrogen 3.066 N/A ARG 26.A NH2 ALA 175.A O no hydrogen 2.802 N/A ARG 26.A NH2 GLU 182.A OE1 no hydrogen 2.806 N/A GLY 27.A N ARG 23.A O no hydrogen 3.057 N/A ARG 28.A N ALA 24.A O no hydrogen 3.078 N/A ARG 28.A N VAL 25.A O no hydrogen 3.110 N/A LEU 29.A N VAL 25.A O no hydrogen 2.932 N/A LEU 29.A N ARG 26.A O no hydrogen 3.188 N/A THR 30.A N ARG 26.A O no hydrogen 3.302 N/A THR 30.A OG1 VAL 41.A O no hydrogen 2.884 N/A GLY 32.A N THR 30.A OG1 no hydrogen 3.400 N/A ALA 33.A N THR 31.A OG1 no hydrogen 3.155 N/A ARG 36.A N ILE 39.A O no hydrogen 2.922 N/A ARG 36.A NE ASP 34.A OD1 no hydrogen 2.850 N/A ARG 36.A NH1 ARG 255.A O no hydrogen 3.002 N/A ARG 36.A NH2 ASP 34.A OD2 no hydrogen 3.010 N/A ARG 36.A NH2 ARG 255.A O no hydrogen 3.059 N/A ILE 39.A N ARG 36.A O no hydrogen 2.860 N/A VAL 41.A N ASP 34.A O no hydrogen 2.855 N/A LEU 42.A N MET 252.A O no hydrogen 2.863 N/A ARG 45.A NE ASP 97.A OD1 no hydrogen 3.301 N/A ARG 45.A NH2 ASP 97.A OD1 no hydrogen 3.098 N/A VAL 46.A N ASN 44.A OD1 no hydrogen 3.010 N/A LEU 48.A N ARG 45.A O no hydrogen 3.076 N/A GLN 52.A N PRO 49.A O no hydrogen 2.865 N/A ARG 53.A N ILE 50.A O no hydrogen 3.146 N/A ARG 53.A NE ASP 72.A OD1 no hydrogen 2.907 N/A ARG 53.A NE ASP 72.A OD2 no hydrogen 3.266 N/A ARG 53.A NH1 ASP 72.A OD2 no hydrogen 2.899 N/A ARG 53.A NH1 ASP 97.A OD1 no hydrogen 2.991 N/A ILE 55.A N LEU 71.A O no hydrogen 2.959 N/A LEU 56.A N PRO 4.A O no hydrogen 2.847 N/A VAL 57.A N LEU 69.A O no hydrogen 2.850 N/A GLU 58.A N ILE 6.A O no hydrogen 2.843 N/A LEU 59.A N VAL 67.A O no hydrogen 2.810 N/A SER 60.A N PHE 8.A O no hydrogen 2.983 N/A SER 60.A OG GLU 58.A OE2 no hydrogen 2.474 N/A ASN 61.A N LEU 65.A O no hydrogen 3.098 N/A ASN 61.A ND2 GLU 142.A O no hydrogen 3.050 N/A ASN 61.A ND2 SER 146.A OG no hydrogen 2.923 N/A HIS 62.A N GLU 142.A OE1 no hydrogen 3.047 N/A ALA 63.A N GLU 142.A OE2 no hydrogen 3.022 N/A GLU 64.A N ASN 61.A O no hydrogen 3.017 N/A LEU 65.A N ASN 61.A OD1 no hydrogen 3.055 N/A SER 66.A OG GLU 58.A OE2 no hydrogen 2.617 N/A VAL 67.A N LEU 59.A O no hydrogen 2.897 N/A THR 68.A N ARG 82.A O no hydrogen 2.871 N/A LEU 69.A N VAL 57.A O no hydrogen 2.788 N/A ALA 70.A N GLY 80.A O no hydrogen 2.963 N/A LEU 71.A N ILE 55.A O no hydrogen 2.820 N/A ASP 72.A N TYR 77.A O no hydrogen 2.884 N/A VAL 73.A N ARG 53.A O no hydrogen 2.900 N/A THR 74.A N ASP 72.A OD1 no hydrogen 2.912 N/A THR 74.A OG1 ASP 72.A OD1 no hydrogen 2.682 N/A ASN 75.A N ASP 72.A O no hydrogen 3.371 N/A TYR 77.A N ASN 75.A OD1 no hydrogen 2.915 N/A VAL 79.A N ALA 70.A O no hydrogen 2.852 N/A TYR 81.A N TYR 88.A O no hydrogen 2.841 N/A TYR 81.A OH LEU 148.A O no hydrogen 2.797 N/A ARG 82.A N THR 68.A O no hydrogen 2.844 N/A ARG 82.A NE GLY 84.A O no hydrogen 2.829 N/A ARG 82.A NH1 ASP 107.A OD1 no hydrogen 2.801 N/A ARG 82.A NH2 GLY 84.A O no hydrogen 3.367 N/A ALA 83.A N SER 86.A O no hydrogen 2.856 N/A SER 86.A N ALA 83.A O no hydrogen 3.223 N/A ALA 87.A N ASN 110.A O no hydrogen 2.911 N/A TYR 88.A N TYR 81.A O no hydrogen 2.869 N/A PHE 89.A N TYR 112.A O no hydrogen 2.873 N/A PHE 90.A N VAL 79.A O no hydrogen 3.037 N/A HIS 91.A N PHE 116.A O no hydrogen 2.888 N/A ASP 97.A N ASN 94.A OD1 no hydrogen 2.857 N/A ALA 98.A N ASN 94.A O no hydrogen 2.993 N/A GLU 99.A N GLN 95.A O no hydrogen 2.934 N/A ALA 100.A N GLU 96.A O no hydrogen 2.931 N/A ILE 101.A N ASP 97.A O no hydrogen 3.123 N/A THR 102.A N GLU 99.A O no hydrogen 3.134 N/A THR 102.A OG1 GLU 99.A O no hydrogen 2.735 N/A HIS 103.A N ALA 100.A O no hydrogen 3.016 N/A HIS 103.A NE2 GLU 99.A OE2 no hydrogen 3.005 N/A LEU 104.A N ILE 101.A O no hydrogen 3.041 N/A VAL 108.A N PHE 105.A O no hydrogen 3.131 N/A ASN 110.A N ASN 85.A O no hydrogen 2.998 N/A ARG 111.A NH1 LEU 104.A O no hydrogen 2.761 N/A ARG 111.A NH2 ILE 101.A O no hydrogen 2.925 N/A ARG 111.A NH2 LEU 104.A O no hydrogen 3.255 N/A TYR 112.A N ALA 87.A O no hydrogen 2.877 N/A PHE 114.A N PHE 89.A O no hydrogen 2.802 N/A TYR 120.A OH GLU 174.A OE2 no hydrogen 2.558 N/A ARG 122.A N ASP 121.A OD1 no hydrogen 2.798 N/A ARG 122.A NH1 ARG 122.A O no hydrogen 3.078 N/A LEU 123.A N ASN 119.A O no hydrogen 2.982 N/A GLU 124.A N TYR 120.A O no hydrogen 2.762 N/A GLN 125.A N ASP 121.A O no hydrogen 3.072 N/A LEU 126.A N ARG 122.A O no hydrogen 2.990 N/A ALA 127.A N LEU 123.A O no hydrogen 2.767 N/A GLY 128.A N GLN 125.A O no hydrogen 3.218 N/A ASN 129.A N GLU 124.A O no hydrogen 3.267 N/A ARG 131.A N GLU 124.A OE2 no hydrogen 2.930 N/A ARG 131.A NE GLU 124.A OE2 no hydrogen 2.986 N/A ARG 131.A NH1 GLU 205.A OE1 no hydrogen 2.866 N/A ARG 131.A NH1 ASN 206.A OD1 no hydrogen 2.968 N/A ARG 131.A NH2 ASN 206.A OD1 no hydrogen 2.870 N/A ASN 133.A N LEU 130.A O no hydrogen 2.857 N/A ILE 134.A N ARG 131.A O no hydrogen 3.153 N/A LEU 136.A N SER 195.A O no hydrogen 2.894 N/A ASN 138.A ND2 THR 10.A O no hydrogen 2.942 N/A LEU 141.A N GLY 137.A O no hydrogen 2.972 N/A GLU 142.A N ASN 138.A O no hydrogen 2.919 N/A GLU 143.A N GLY 139.A O no hydrogen 3.109 N/A ALA 144.A N PRO 140.A O no hydrogen 2.817 N/A ILE 145.A N LEU 141.A O no hydrogen 2.940 N/A SER 146.A N GLU 142.A O no hydrogen 3.211 N/A ALA 147.A N GLU 143.A O no hydrogen 2.925 N/A LEU 148.A N ALA 144.A O no hydrogen 2.957 N/A TYR 149.A N ILE 145.A O no hydrogen 2.946 N/A TYR 150.A N SER 146.A O no hydrogen 2.977 N/A TYR 151.A N LEU 148.A O no hydrogen 3.295 N/A THR 153.A N TYR 150.A O no hydrogen 3.216 N/A THR 153.A OG1 TYR 150.A O no hydrogen 2.863 N/A GLY 154.A N TYR 151.A O no hydrogen 3.184 N/A GLY 155.A N TYR 150.A O no hydrogen 3.313 N/A THR 156.A OG1 ALA 147.A O no hydrogen 2.792 N/A LEU 161.A N GLN 157.A O no hydrogen 2.990 N/A ALA 162.A N LEU 158.A O no hydrogen 2.916 N/A ARG 163.A N PRO 159.A O no hydrogen 2.954 N/A SER 164.A N THR 160.A O no hydrogen 2.968 N/A SER 164.A OG THR 160.A O no hydrogen 2.758 N/A PHE 165.A N LEU 161.A O no hydrogen 2.951 N/A ILE 166.A N ALA 162.A O no hydrogen 2.991 N/A ILE 167.A N ARG 163.A O no hydrogen 3.007 N/A CYS 168.A N SER 164.A O no hydrogen 2.995 N/A CYS 168.A SG SER 164.A O no hydrogen 3.479 N/A ILE 169.A N PHE 165.A O no hydrogen 2.850 N/A GLN 170.A N ILE 166.A O no hydrogen 3.248 N/A GLN 170.A NE2 ILE 166.A O no hydrogen 3.188 N/A MET 171.A N ILE 167.A O no hydrogen 2.989 N/A ILE 172.A N CYS 168.A O no hydrogen 2.999 N/A SER 173.A OG ALA 76.A O no hydrogen 2.804 N/A GLU 174.A N ILE 169.A O no hydrogen 2.973 N/A ALA 175.A N GLN 170.A O no hydrogen 3.258 N/A ALA 176.A N ILE 172.A O no hydrogen 2.920 N/A ARG 177.A N SER 173.A O no hydrogen 2.919 N/A ARG 177.A NE ASN 75.A O no hydrogen 3.387 N/A ARG 177.A NH2 ASN 75.A O no hydrogen 2.786 N/A PHE 178.A N GLU 174.A O no hydrogen 2.891 N/A GLN 179.A N GLN 179.A OE1 no hydrogen 2.779 N/A GLN 179.A NE2 ILE 246.A O no hydrogen 3.432 N/A TYR 180.A N ILE 248.A O no hydrogen 3.256 N/A TYR 180.A OH SER 200.A OG no hydrogen 2.689 N/A ILE 181.A N PHE 178.A O no hydrogen 2.925 N/A GLU 182.A N PHE 178.A O no hydrogen 2.972 N/A GLY 183.A N GLN 179.A O no hydrogen 2.818 N/A GLU 184.A N TYR 180.A O no hydrogen 3.009 N/A MET 185.A N ILE 181.A O no hydrogen 3.079 N/A ARG 186.A N GLU 182.A O no hydrogen 2.841 N/A ARG 186.A NE GLU 182.A OE2 no hydrogen 3.104 N/A ARG 186.A NH2 GLU 182.A OE2 no hydrogen 2.594 N/A THR 187.A N GLY 183.A O no hydrogen 2.896 N/A THR 187.A OG1 GLY 183.A O no hydrogen 3.169 N/A ARG 188.A N GLU 184.A O no hydrogen 3.228 N/A ARG 188.A NE SER 195.A O no hydrogen 3.144 N/A ARG 188.A NH1 GLU 184.A O no hydrogen 3.016 N/A ARG 188.A NH1 GLU 184.A OE1 no hydrogen 2.989 N/A ARG 188.A NH2 SER 195.A O no hydrogen 3.378 N/A ARG 188.A NH2 ALA 196.A O no hydrogen 2.980 N/A ILE 189.A N MET 185.A O no hydrogen 2.984 N/A ARG 190.A N ARG 186.A O no hydrogen 2.783 N/A ARG 190.A NH1 ARG 190.A O no hydrogen 2.927 N/A TYR 191.A N THR 187.A O no hydrogen 3.125 N/A ASN 192.A N ILE 189.A O no hydrogen 3.122 N/A ARG 193.A N ARG 188.A O no hydrogen 2.801 N/A ARG 194.A NE GLU 135.A OE1 no hydrogen 2.741 N/A ARG 194.A NH1 GLU 143.A OE2 no hydrogen 3.041 N/A ARG 194.A NH2 GLU 135.A OE1 no hydrogen 3.488 N/A ARG 194.A NH2 GLU 143.A OE1 no hydrogen 2.988 N/A SER 195.A N LEU 136.A O no hydrogen 3.082 N/A SER 200.A OG TYR 180.A OH no hydrogen 2.689 N/A SER 200.A OG ASP 198.A OD1 no hydrogen 2.591 N/A VAL 201.A N ASP 198.A OD1 no hydrogen 3.367 N/A ILE 202.A N ASP 198.A O no hydrogen 3.131 N/A THR 203.A N PRO 199.A O no hydrogen 2.946 N/A THR 203.A OG1 PRO 199.A O no hydrogen 3.524 N/A THR 203.A OG1 GLN 230.A OE1 no hydrogen 2.653 N/A LEU 204.A N SER 200.A O no hydrogen 3.121 N/A GLU 205.A N VAL 201.A O no hydrogen 2.954 N/A ASN 206.A N ILE 202.A O no hydrogen 2.894 N/A SER 207.A N LEU 204.A O no hydrogen 3.042 N/A SER 207.A OG THR 203.A O no hydrogen 2.708 N/A TRP 208.A N GLU 205.A O no hydrogen 3.416 N/A TRP 208.A NE1 LEU 251.A O no hydrogen 2.992 N/A LEU 211.A N SER 207.A O no hydrogen 2.734 N/A SER 212.A N TRP 208.A O no hydrogen 2.899 N/A SER 212.A OG TRP 208.A O no hydrogen 2.925 N/A THR 213.A N GLY 209.A O no hydrogen 2.965 N/A THR 213.A OG1 GLY 209.A O no hydrogen 3.112 N/A ALA 214.A N ARG 210.A O no hydrogen 2.950 N/A ILE 215.A N LEU 211.A O no hydrogen 2.908 N/A GLN 216.A N SER 212.A O no hydrogen 3.126 N/A GLN 216.A NE2 SER 212.A O no hydrogen 3.186 N/A GLN 216.A NE2 VAL 253.A O no hydrogen 2.848 N/A GLU 217.A N THR 213.A O no hydrogen 2.920 N/A SER 218.A N ILE 215.A O no hydrogen 3.165 N/A SER 218.A OG ILE 215.A O no hydrogen 2.909 N/A ASN 219.A N ALA 222.A O no hydrogen 2.940 N/A GLY 221.A N SER 218.A OG no hydrogen 3.121 N/A ALA 222.A N ASN 219.A O no hydrogen 2.962 N/A PHE 223.A N TYR 240.A O no hydrogen 2.921 N/A ILE 227.A N VAL 239.A O no hydrogen 2.933 N/A LEU 229.A N PHE 237.A O no hydrogen 2.964 N/A GLN 230.A NE2 GLY 234.A O no hydrogen 2.961 N/A ARG 231.A N SER 235.A O no hydrogen 2.773 N/A ARG 232.A NH1 GLU 184.A OE1 no hydrogen 3.391 N/A ARG 232.A NH1 GLU 184.A OE2 no hydrogen 2.891 N/A ARG 232.A NH1 ASP 198.A OD2 no hydrogen 2.831 N/A ARG 232.A NH2 GLU 184.A OE2 no hydrogen 2.519 N/A GLY 234.A N ARG 231.A O no hydrogen 3.081 N/A SER 235.A N ASN 233.A OD1 no hydrogen 2.845 N/A SER 235.A OG ASN 233.A OD1 no hydrogen 2.776 N/A PHE 237.A N LEU 229.A O no hydrogen 2.984 N/A VAL 239.A N ILE 227.A O no hydrogen 2.741 N/A VAL 242.A N GLY 221.A O no hydrogen 2.872 N/A SER 243.A N ASP 241.A OD2 no hydrogen 2.847 N/A SER 243.A OG ASP 241.A OD2 no hydrogen 3.234 N/A ILE 244.A N ASP 241.A O no hydrogen 3.444 N/A LEU 245.A N VAL 242.A O no hydrogen 2.831 N/A ILE 246.A N SER 243.A O no hydrogen 3.420 N/A ILE 248.A N LEU 245.A O no hydrogen 2.856 N/A ILE 249.A N LEU 245.A O no hydrogen 3.046 N/A ALA 250.A N ARG 177.A O no hydrogen 2.797 N/A LEU 251.A N ARG 177.A O no hydrogen 3.268 N/A MET 252.A N PRO 40.A O no hydrogen 2.986 N/A VAL 253.A N SER 212.A OG no hydrogen 3.224 N/A ARG 255.A N GLN 216.A OE1 no hydrogen 3.074 N/A ARG 255.A NE THR 213.A OG1 no hydrogen 2.752 N/A ARG 255.A NH1 TYR 254.A O no hydrogen 3.142 N/A ARG 255.A NH2 GLY 209.A O no hydrogen 3.288 N/A ARG 255.A NH2 THR 213.A OG1 no hydrogen 3.299 N/A