Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lxp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N CYS 76.A O no hydrogen 3.015 N/A HIS 6.A N TYR 29.A OH no hydrogen 3.030 N/A ARG 8.A NH1 ARG 8.A O no hydrogen 3.047 N/A TYR 9.A N HIS 6.A O no hydrogen 2.932 N/A LEU 10.A N LYS 7.A O no hydrogen 3.104 N/A LYS 11.A N CYS 28.A O no hydrogen 2.791 N/A LYS 12.A NZ ASP 15.A OD2 no hydrogen 2.787 N/A ILE 13.A N LEU 26.A O no hydrogen 2.804 N/A ARG 14.A N LEU 26.A O no hydrogen 3.405 N/A ARG 14.A NH2 TYR 91.A OH no hydrogen 2.886 N/A LEU 16.A N VAL 24.A O no hydrogen 2.806 N/A GLY 17.A N VAL 24.A O no hydrogen 3.154 N/A GLY 19.A N GLY 22.A O no hydrogen 2.810 N/A HIS 20.A N ASP 152.A OD2 no hydrogen 2.856 N/A HIS 20.A NE2 ASP 134.A OD2 no hydrogen 2.508 N/A LYS 23.A N ALA 42.A O no hydrogen 2.920 N/A VAL 24.A N GLY 17.A O no hydrogen 2.796 N/A SER 25.A N VAL 40.A O no hydrogen 2.874 N/A SER 25.A OG ASP 15.A OD2 no hydrogen 2.863 N/A LEU 26.A N ARG 14.A O no hydrogen 2.663 N/A TYR 27.A N VAL 38.A O no hydrogen 2.881 N/A CYS 28.A N LYS 11.A O no hydrogen 2.788 N/A TYR 29.A N GLU 36.A O no hydrogen 2.824 N/A ASP 30.A N TYR 9.A O no hydrogen 2.957 N/A GLU 36.A N TYR 29.A O no hydrogen 3.148 N/A VAL 38.A N TYR 27.A O no hydrogen 2.867 N/A ALA 39.A N MET 89.A O no hydrogen 2.899 N/A VAL 40.A N SER 25.A O no hydrogen 2.871 N/A LYS 41.A N LEU 87.A O no hydrogen 2.815 N/A LYS 41.A NZ GLU 58.A OE2 no hydrogen 2.577 N/A LYS 41.A NZ ASP 152.A OD1 no hydrogen 3.112 N/A ALA 42.A N LYS 23.A O no hydrogen 2.966 N/A LYS 44.A N PHE 21.A O no hydrogen 2.959 N/A LYS 44.A NZ GLU 18.A OE1 no hydrogen 2.864 N/A LYS 44.A NZ GLY 19.A O no hydrogen 2.849 N/A LYS 44.A NZ HIS 20.A O no hydrogen 3.216 N/A HIS 51.A N GLY 48.A O no hydrogen 3.203 N/A ARG 52.A N GLY 48.A O no hydrogen 3.051 N/A ARG 52.A NH1 ALA 82.A O no hydrogen 2.989 N/A ARG 52.A NH1 ALA 83.A O no hydrogen 3.184 N/A ARG 52.A NH2 ALA 82.A O no hydrogen 2.988 N/A SER 53.A N PRO 49.A O no hydrogen 3.093 N/A GLY 54.A N GLN 50.A O no hydrogen 3.154 N/A TRP 55.A N HIS 51.A O no hydrogen 2.861 N/A TRP 55.A NE1 LEU 85.A O no hydrogen 2.971 N/A LYS 56.A N ARG 52.A O no hydrogen 2.992 N/A GLN 57.A N SER 53.A O no hydrogen 3.097 N/A GLN 57.A NE2 SER 53.A O no hydrogen 3.135 N/A GLN 57.A NE2 SER 53.A OG no hydrogen 3.309 N/A GLU 58.A N GLY 54.A O no hydrogen 2.934 N/A ILE 59.A N TRP 55.A O no hydrogen 3.114 N/A ASP 60.A N LYS 56.A O no hydrogen 2.966 N/A ILE 61.A N GLN 57.A O no hydrogen 2.926 N/A LEU 62.A N GLU 58.A O no hydrogen 2.969 N/A ARG 63.A N ILE 59.A O no hydrogen 2.942 N/A THR 64.A N ILE 61.A O no hydrogen 2.927 N/A THR 64.A OG1 ILE 61.A O no hydrogen 2.744 N/A THR 64.A OG1 TYR 130.A OH no hydrogen 3.009 N/A LEU 65.A N ILE 61.A O no hydrogen 3.278 N/A LEU 65.A N LEU 62.A O no hydrogen 3.155 N/A TYR 66.A N TYR 124.A OH no hydrogen 2.881 N/A HIS 69.A N HIS 67.A ND1 no hydrogen 2.999 N/A HIS 69.A ND1 VAL 148.A O no hydrogen 2.781 N/A ILE 70.A N HIS 67.A O no hydrogen 3.148 N/A ILE 71.A N ILE 150.A O no hydrogen 2.954 N/A LYS 72.A N GLU 90.A OE1 no hydrogen 2.880 N/A LYS 74.A N VAL 88.A O no hydrogen 2.808 N/A LYS 74.A NZ GLU 36.A OE2 no hydrogen 2.611 N/A GLY 75.A N VAL 88.A O no hydrogen 3.270 N/A CYS 76.A N THR 3.A O no hydrogen 3.147 N/A CYS 76.A SG TYR 73.A OH no hydrogen 3.445 N/A CYS 76.A SG GLN 86.A O no hydrogen 3.683 N/A CYS 77.A N GLN 86.A O no hydrogen 2.962 N/A CYS 77.A SG PHE 5.A O no hydrogen 3.635 N/A CYS 77.A SG GLU 78.A O no hydrogen 3.845 N/A CYS 77.A SG GLN 86.A OE1 no hydrogen 3.608 N/A ASP 79.A N SER 84.A O no hydrogen 2.913 N/A ALA 82.A N ASP 79.A O no hydrogen 3.110 N/A ALA 82.A N ASP 79.A OD2 no hydrogen 3.286 N/A ALA 83.A N ALA 80.A O no hydrogen 3.325 N/A SER 84.A N ASP 79.A O no hydrogen 3.208 N/A SER 84.A OG LEU 85.A O no hydrogen 3.409 N/A GLN 86.A N CYS 77.A O no hydrogen 2.698 N/A LEU 87.A N LYS 41.A O no hydrogen 2.836 N/A VAL 88.A N GLY 75.A O no hydrogen 2.813 N/A MET 89.A N ALA 39.A O no hydrogen 2.746 N/A GLU 90.A N LYS 72.A O no hydrogen 3.005 N/A LEU 94.A N LEU 142.A O no hydrogen 3.326 N/A GLY 95.A N VAL 92.A O no hydrogen 3.219 N/A SER 96.A OG ASP 99.A OD1 no hydrogen 3.454 N/A LEU 97.A N VAL 140.A O no hydrogen 2.799 N/A ASP 99.A N SER 96.A O no hydrogen 3.196 N/A ASP 99.A N SER 96.A OG no hydrogen 3.280 N/A TYR 100.A N SER 96.A O no hydrogen 2.948 N/A LEU 101.A N LEU 97.A O no hydrogen 2.904 N/A ARG 103.A N TYR 100.A O no hydrogen 2.973 N/A HIS 104.A ND1 TYR 100.A O no hydrogen 3.165 N/A GLN 110.A NE2 GLN 110.A O no hydrogen 2.926 N/A LEU 111.A N GLY 107.A O no hydrogen 3.097 N/A LEU 112.A N LEU 108.A O no hydrogen 2.958 N/A LEU 113.A N ALA 109.A O no hydrogen 3.056 N/A PHE 114.A N GLN 110.A O no hydrogen 2.979 N/A ALA 115.A N LEU 111.A O no hydrogen 3.001 N/A GLN 116.A N LEU 112.A O no hydrogen 2.941 N/A GLN 116.A NE2 GLU 120.A OE2 no hydrogen 2.775 N/A GLN 117.A N LEU 113.A O no hydrogen 3.004 N/A ILE 118.A N PHE 114.A O no hydrogen 2.902 N/A CYS 119.A N ALA 115.A O no hydrogen 2.998 N/A CYS 119.A SG ALA 115.A O no hydrogen 3.416 N/A GLU 120.A N GLN 116.A O no hydrogen 2.924 N/A GLY 121.A N GLN 117.A O no hydrogen 3.003 N/A MET 122.A N ILE 118.A O no hydrogen 2.895 N/A ALA 123.A N CYS 119.A O no hydrogen 2.778 N/A TYR 124.A N GLU 120.A O no hydrogen 3.119 N/A LEU 125.A N GLY 121.A O no hydrogen 2.854 N/A HIS 126.A N MET 122.A O no hydrogen 2.962 N/A HIS 126.A NE2 ASP 190.A OD2 no hydrogen 2.856 N/A ALA 127.A N ALA 123.A O no hydrogen 3.041 N/A GLN 128.A N TYR 124.A O no hydrogen 3.210 N/A GLN 128.A N LEU 125.A O no hydrogen 3.091 N/A HIS 129.A N HIS 126.A O no hydrogen 2.966 N/A TYR 130.A N LEU 125.A O no hydrogen 3.304 N/A TYR 130.A OH THR 64.A OG1 no hydrogen 3.009 N/A ILE 131.A N LYS 157.A O no hydrogen 2.933 N/A HIS 132.A N ASP 190.A OD2 no hydrogen 2.916 N/A HIS 132.A NE2 GLY 151.A O no hydrogen 2.780 N/A ARG 133.A N ASP 190.A OD1 no hydrogen 3.062 N/A ARG 133.A NE LEU 155.A O no hydrogen 2.696 N/A ARG 133.A NH2 LEU 155.A O no hydrogen 2.997 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 2.995 N/A ALA 137.A N GLU 200.A OE2 no hydrogen 2.904 N/A ARG 138.A NE ASP 134.A OD2 no hydrogen 3.279 N/A ARG 138.A NH2 ASP 134.A OD1 no hydrogen 2.827 N/A ASN 139.A N ALA 136.A O no hydrogen 2.929 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.769 N/A ASN 139.A ND2 ASP 134.A OD2 no hydrogen 2.927 N/A VAL 140.A N ALA 137.A O no hydrogen 3.152 N/A LEU 141.A N LYS 149.A O no hydrogen 2.896 N/A LEU 142.A N GLY 95.A O no hydrogen 2.804 N/A ASP 143.A N LEU 147.A O no hydrogen 3.043 N/A ASP 145.A N ASP 143.A OD1 no hydrogen 2.770 N/A ARG 146.A N ASP 143.A O no hydrogen 2.879 N/A LEU 147.A N ASP 143.A OD1 no hydrogen 2.939 N/A VAL 148.A N GLN 117.A OE1 no hydrogen 2.709 N/A LYS 149.A N LEU 141.A O no hydrogen 2.804 N/A LYS 149.A NZ GLU 68.A O no hydrogen 2.714 N/A ILE 150.A N HIS 69.A O no hydrogen 2.866 N/A GLY 151.A N ASN 139.A O no hydrogen 2.790 N/A GLY 154.A N ASP 152.A OD1 no hydrogen 3.024 N/A ALA 156.A N PHE 153.A O no hydrogen 3.075 N/A LYS 157.A N ILE 131.A O no hydrogen 2.999 N/A LYS 157.A NZ GLN 57.A OE1 no hydrogen 3.473 N/A LYS 157.A NZ LEU 155.A O no hydrogen 3.527 N/A LYS 157.A NZ ALA 156.A O no hydrogen 3.380 N/A VAL 159.A N HIS 129.A O no hydrogen 2.894 N/A HIS 163.A N PRO 160.A O no hydrogen 3.012 N/A TYR 165.A N PHE 185.A O no hydrogen 2.929 N/A VAL 167.A N TYR 183.A O no hydrogen 2.674 N/A VAL 172.A N SER 170.A O no hydrogen 2.820 N/A TRP 174.A N PRO 171.A O no hydrogen 2.920 N/A TRP 174.A NE1 GLU 200.A OE2 no hydrogen 2.843 N/A TYR 175.A N VAL 172.A O no hydrogen 3.066 N/A TYR 175.A OH ARG 133.A O no hydrogen 2.573 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.850 N/A CYS 179.A N ALA 176.A O no hydrogen 3.066 N/A CYS 179.A SG LYS 184.A O no hydrogen 3.659 N/A LEU 180.A N ALA 176.A O no hydrogen 3.357 N/A LYS 181.A N PRO 177.A O no hydrogen 2.857 N/A LYS 181.A NZ GLU 236.A OE2 no hydrogen 2.584 N/A GLU 182.A N GLU 178.A O no hydrogen 2.837 N/A LYS 184.A N GLU 178.A O no hydrogen 3.288 N/A PHE 185.A N TYR 165.A O no hydrogen 2.893 N/A TYR 186.A N SER 189.A OG no hydrogen 2.861 N/A TYR 187.A N GLU 164.A O no hydrogen 3.391 N/A SER 189.A N TYR 186.A O no hydrogen 2.878 N/A SER 189.A OG GLU 178.A OE2 no hydrogen 2.685 N/A SER 189.A OG TYR 186.A O no hydrogen 3.373 N/A ASP 190.A N TYR 187.A O no hydrogen 3.057 N/A TRP 192.A N ALA 188.A O no hydrogen 3.152 N/A SER 193.A N SER 189.A O no hydrogen 3.188 N/A SER 193.A OG TRP 174.A O no hydrogen 2.779 N/A SER 193.A OG SER 189.A O no hydrogen 3.275 N/A PHE 194.A N ASP 190.A O no hydrogen 2.864 N/A GLY 195.A N VAL 191.A O no hydrogen 3.009 N/A VAL 196.A N TRP 192.A O no hydrogen 3.111 N/A THR 197.A N SER 193.A O no hydrogen 2.881 N/A THR 197.A OG1 LEU 135.A O no hydrogen 2.903 N/A THR 197.A OG1 SER 193.A O no hydrogen 3.141 N/A LEU 198.A N PHE 194.A O no hydrogen 2.760 N/A TYR 199.A N GLY 195.A O no hydrogen 3.002 N/A TYR 199.A OH GLN 209.A O no hydrogen 2.638 N/A GLU 200.A N VAL 196.A O no hydrogen 2.918 N/A LEU 201.A N THR 197.A O no hydrogen 2.885 N/A LEU 202.A N LEU 198.A O no hydrogen 3.007 N/A THR 203.A N TYR 199.A O no hydrogen 2.987 N/A THR 203.A OG1 TYR 199.A O no hydrogen 3.035 N/A THR 203.A OG1 GLU 200.A O no hydrogen 3.069 N/A HIS 204.A N LEU 201.A O no hydrogen 2.978 N/A CYS 205.A N GLU 200.A O no hydrogen 2.880 N/A CYS 205.A SG LEU 97.A O no hydrogen 3.859 N/A CYS 205.A SG GLU 200.A O no hydrogen 3.844 N/A ASP 206.A N THR 203.A O no hydrogen 3.026 N/A SER 208.A N ASP 206.A OD2 no hydrogen 3.087 N/A SER 208.A OG ASP 206.A OD1 no hydrogen 3.267 N/A SER 208.A OG ASP 206.A OD2 no hydrogen 2.879 N/A GLN 209.A N ASP 206.A O no hydrogen 3.043 N/A GLN 209.A NE2 ASP 206.A OD1 no hydrogen 2.928 N/A SER 210.A N SER 207.A O no hydrogen 3.171 N/A SER 210.A OG SER 207.A O no hydrogen 3.105 N/A SER 210.A OG THR 213.A OG1 no hydrogen 3.027 N/A THR 213.A N SER 210.A OG no hydrogen 3.171 N/A THR 213.A OG1 SER 207.A O no hydrogen 2.852 N/A THR 213.A OG1 SER 210.A OG no hydrogen 3.027 N/A LYS 214.A N SER 210.A O no hydrogen 2.930 N/A PHE 215.A N PRO 211.A O no hydrogen 2.976 N/A LEU 216.A N PRO 212.A O no hydrogen 2.793 N/A GLU 217.A N THR 213.A O no hydrogen 3.067 N/A LEU 218.A N PHE 215.A O no hydrogen 2.942 N/A ILE 219.A N PHE 215.A O no hydrogen 2.886 N/A GLY 220.A N LEU 216.A O no hydrogen 2.738 N/A THR 227.A N GLN 223.A O no hydrogen 2.884 N/A THR 227.A OG1 ALA 222.A O no hydrogen 3.274 N/A THR 227.A OG1 GLN 223.A O no hydrogen 2.956 N/A VAL 228.A N GLY 224.A O no hydrogen 2.940 N/A LEU 229.A N GLN 225.A O no hydrogen 2.949 N/A ARG 230.A N MET 226.A O no hydrogen 2.933 N/A ARG 230.A NH1 ILE 219.A O no hydrogen 2.897 N/A LEU 231.A N THR 227.A O no hydrogen 2.888 N/A THR 232.A N VAL 228.A O no hydrogen 2.905 N/A THR 232.A OG1 VAL 228.A O no hydrogen 2.721 N/A GLU 233.A N LEU 229.A O no hydrogen 3.056 N/A LEU 234.A N ARG 230.A O no hydrogen 3.113 N/A LEU 235.A N LEU 231.A O no hydrogen 3.054 N/A GLU 236.A N THR 232.A O no hydrogen 2.857 N/A ARG 237.A N GLU 233.A O no hydrogen 3.060 N/A GLY 238.A N LEU 235.A O no hydrogen 3.033 N/A GLU 239.A N LEU 234.A O no hydrogen 2.943 N/A ARG 240.A NE TRP 259.A O no hydrogen 3.098 N/A ARG 240.A NH1 LEU 235.A O no hydrogen 2.939 N/A ARG 240.A NH1 GLU 239.A O no hydrogen 2.848 N/A ARG 240.A NH2 TRP 259.A O no hydrogen 2.817 N/A ARG 240.A NH2 THR 261.A OG1 no hydrogen 2.837 N/A ARG 243.A NH1 CYS 247.A O no hydrogen 2.859 N/A CYS 247.A N PRO 244.A O no hydrogen 3.026 N/A CYS 247.A SG PRO 248.A O no hydrogen 3.456 N/A TYR 252.A N PRO 248.A O no hydrogen 3.024 N/A TYR 252.A OH LEU 241.A O no hydrogen 2.641 N/A HIS 253.A N ALA 249.A O no hydrogen 2.847 N/A LEU 254.A N GLU 250.A O no hydrogen 3.023 N/A MET 255.A N VAL 251.A O no hydrogen 3.051 N/A LYS 256.A N TYR 252.A O no hydrogen 2.929 N/A ASN 257.A N HIS 253.A O no hydrogen 2.893 N/A CYS 258.A N LEU 254.A O no hydrogen 2.979 N/A CYS 258.A SG LEU 254.A O no hydrogen 3.425 N/A TRP 259.A N MET 255.A O no hydrogen 2.991 N/A TRP 259.A N LYS 256.A O no hydrogen 3.090 N/A GLU 260.A N ASN 257.A O no hydrogen 3.277 N/A SER 264.A N GLU 262.A OE2 no hydrogen 3.067 N/A SER 264.A OG GLU 262.A OE2 no hydrogen 2.739 N/A PHE 265.A N GLU 262.A O no hydrogen 3.023 N/A ARG 266.A N ALA 263.A O no hydrogen 3.172 N/A ARG 266.A NE GLU 260.A O no hydrogen 2.860 N/A ARG 266.A NH1 GLU 178.A OE2 no hydrogen 2.740 N/A ARG 266.A NH1 ALA 188.A O no hydrogen 3.070 N/A ARG 266.A NH2 GLU 178.A OE1 no hydrogen 2.883 N/A ARG 266.A NH2 GLU 178.A OE2 no hydrogen 3.548 N/A ARG 266.A NH2 GLU 260.A O no hydrogen 2.982 N/A ASN 271.A N THR 268.A OG1 no hydrogen 3.048 N/A LEU 272.A N THR 268.A O no hydrogen 2.958 N/A ILE 273.A N PHE 269.A O no hydrogen 3.222 N/A ILE 275.A N ASN 271.A O no hydrogen 3.454 N/A LEU 276.A N LEU 272.A O no hydrogen 2.841 N/A LYS 277.A N ILE 273.A O no hydrogen 2.906 N/A THR 278.A N PRO 274.A O no hydrogen 2.872 N/A THR 278.A OG1 PRO 274.A O no hydrogen 2.746 N/A VAL 279.A N ILE 275.A O no hydrogen 3.133 N/A HIS 280.A N LEU 276.A O no hydrogen 2.830 N/A HIS 280.A ND1 ALA 109.A O no hydrogen 2.924 N/A GLU 281.A N LYS 277.A O no hydrogen 3.030 N/A LYS 282.A N THR 278.A O no hydrogen 3.005 N/A LYS 282.A NZ GLU 250.A OE2 no hydrogen 2.752 N/A TYR 283.A N VAL 279.A O no hydrogen 3.089 N/A TYR 283.A OH GLU 250.A OE2 no hydrogen 2.557 N/A GLN 284.A N HIS 280.A O no hydrogen 2.919 N/A GLY 285.A N GLU 281.A O no hydrogen 3.278 N/A