Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lxk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N VAL 75.A O no hydrogen 2.951 N/A GLU 4.A N TYR 27.A OH no hydrogen 2.960 N/A ARG 6.A NE GLU 4.A OE1 no hydrogen 3.257 N/A ARG 6.A NH1 GLU 4.A OE1 no hydrogen 3.493 N/A ARG 6.A NH1 GLU 4.A OE2 no hydrogen 3.385 N/A HIS 7.A N GLU 4.A O no hydrogen 3.041 N/A LEU 8.A N GLU 5.A O no hydrogen 3.062 N/A LYS 9.A N ARG 26.A O no hydrogen 2.844 N/A ILE 11.A N LEU 24.A O no hydrogen 2.861 N/A SER 12.A N LEU 24.A O no hydrogen 3.183 N/A GLN 13.A NE2 TYR 10.A OH no hydrogen 2.917 N/A GLN 13.A NE2 GLU 23.A OE2 no hydrogen 3.144 N/A LEU 14.A N VAL 22.A O no hydrogen 2.809 N/A GLY 15.A N VAL 22.A O no hydrogen 3.222 N/A GLY 17.A N GLY 20.A O no hydrogen 2.968 N/A ASN 18.A ND2 ASP 135.A OD2 no hydrogen 2.985 N/A GLY 20.A N GLY 17.A O no hydrogen 2.703 N/A SER 21.A N GLN 42.A O no hydrogen 2.983 N/A VAL 22.A N GLY 15.A O no hydrogen 2.960 N/A GLU 23.A N VAL 40.A O no hydrogen 2.800 N/A LEU 24.A N SER 12.A O no hydrogen 2.722 N/A CYS 25.A N VAL 38.A O no hydrogen 3.110 N/A ARG 26.A N LYS 9.A O no hydrogen 2.854 N/A ARG 26.A NH1 GLY 35.A O no hydrogen 2.919 N/A TYR 27.A N ALA 36.A O no hydrogen 2.801 N/A ASP 28.A N HIS 7.A O no hydrogen 2.852 N/A GLY 31.A N ASP 28.A O no hydrogen 3.000 N/A ASN 33.A N ASP 28.A OD1 no hydrogen 2.841 N/A THR 34.A N ASP 28.A OD2 no hydrogen 3.266 N/A THR 34.A N ASP 32.A OD1 no hydrogen 3.103 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.515 N/A THR 34.A OG1 ASP 32.A OD2 no hydrogen 3.402 N/A GLY 35.A N ASP 28.A OD2 no hydrogen 2.929 N/A VAL 38.A N CYS 25.A O no hydrogen 2.944 N/A ALA 39.A N MET 88.A O no hydrogen 2.908 N/A VAL 40.A N GLU 23.A O no hydrogen 2.878 N/A LYS 41.A N LEU 86.A O no hydrogen 2.781 N/A LYS 41.A NZ GLU 57.A OE2 no hydrogen 2.756 N/A LYS 41.A NZ ASP 153.A OD1 no hydrogen 2.691 N/A LYS 41.A NZ ASP 153.A OD2 no hydrogen 3.376 N/A GLN 42.A N SER 21.A O no hydrogen 3.115 N/A GLN 42.A NE2 SER 21.A OG no hydrogen 3.233 N/A GLN 42.A NE2 VAL 40.A O no hydrogen 2.983 N/A GLN 44.A N PHE 19.A O no hydrogen 3.025 N/A GLN 51.A N GLY 47.A O no hydrogen 3.362 N/A ARG 52.A N PRO 48.A O no hydrogen 3.181 N/A ASP 53.A N ASP 49.A O no hydrogen 3.131 N/A PHE 54.A N GLN 50.A O no hydrogen 2.777 N/A GLN 55.A N GLN 51.A O no hydrogen 3.043 N/A ARG 56.A N ARG 52.A O no hydrogen 3.284 N/A GLU 57.A N ASP 53.A O no hydrogen 2.915 N/A ILE 58.A N PHE 54.A O no hydrogen 2.980 N/A GLN 59.A N GLN 55.A O no hydrogen 3.156 N/A ILE 60.A N ARG 56.A O no hydrogen 2.916 N/A LEU 61.A N GLU 57.A O no hydrogen 2.958 N/A LYS 62.A N ILE 58.A O no hydrogen 2.853 N/A ALA 63.A N GLN 59.A O no hydrogen 3.295 N/A ALA 63.A N ILE 60.A O no hydrogen 3.143 N/A LEU 64.A N LEU 61.A O no hydrogen 2.981 N/A HIS 65.A N TYR 125.A OH no hydrogen 2.873 N/A PHE 68.A N SER 66.A OG no hydrogen 3.020 N/A ILE 69.A N SER 66.A O no hydrogen 3.278 N/A VAL 70.A N ILE 151.A O no hydrogen 2.914 N/A LYS 71.A N GLU 89.A OE2 no hydrogen 2.854 N/A ARG 73.A N VAL 87.A O no hydrogen 2.676 N/A GLY 74.A N VAL 87.A O no hydrogen 3.072 N/A VAL 75.A N THR 1.A O no hydrogen 2.971 N/A SER 76.A N ARG 85.A O no hydrogen 2.995 N/A SER 76.A OG GLU 5.A OE1 no hydrogen 2.671 N/A GLY 78.A N GLN 82.A O no hydrogen 3.199 N/A LEU 84.A N SER 76.A O no hydrogen 2.843 N/A ARG 85.A N SER 76.A O no hydrogen 3.066 N/A ARG 85.A NE GLU 5.A OE1 no hydrogen 2.836 N/A ARG 85.A NE GLU 5.A OE2 no hydrogen 3.337 N/A ARG 85.A NH1 GLN 42.A OE1 no hydrogen 3.074 N/A ARG 85.A NH2 GLU 5.A OE2 no hydrogen 2.994 N/A LEU 86.A N LYS 41.A O no hydrogen 2.790 N/A VAL 87.A N GLY 74.A O no hydrogen 2.764 N/A MET 88.A N ALA 39.A O no hydrogen 2.744 N/A GLU 89.A N LYS 71.A O no hydrogen 3.023 N/A GLY 94.A N LEU 91.A O no hydrogen 3.079 N/A CYS 95.A SG ALA 138.A O no hydrogen 3.592 N/A CYS 95.A SG ARG 139.A O no hydrogen 3.516 N/A CYS 95.A SG ILE 141.A O no hydrogen 3.981 N/A LEU 96.A N ILE 141.A O no hydrogen 2.780 N/A PHE 99.A N CYS 95.A O no hydrogen 2.970 N/A LEU 100.A N LEU 96.A O no hydrogen 2.850 N/A GLN 101.A N ARG 97.A O no hydrogen 3.277 N/A ARG 102.A N ASP 98.A O no hydrogen 3.051 N/A HIS 103.A N PHE 99.A O no hydrogen 2.991 N/A ARG 106.A N HIS 103.A O no hydrogen 2.868 N/A ARG 106.A NH1 GLU 146.A OE1 no hydrogen 3.488 N/A LEU 107.A N HIS 103.A O no hydrogen 3.177 N/A LEU 107.A N ARG 104.A O no hydrogen 3.414 N/A ARG 111.A N ASP 108.A OD2 no hydrogen 3.107 N/A LEU 112.A N ASP 108.A O no hydrogen 3.178 N/A LEU 113.A N ALA 109.A O no hydrogen 2.922 N/A LEU 114.A N SER 110.A O no hydrogen 2.908 N/A TYR 115.A N ARG 111.A O no hydrogen 2.915 N/A TYR 115.A OH GLU 146.A O no hydrogen 2.506 N/A SER 116.A N LEU 112.A O no hydrogen 2.879 N/A SER 116.A OG LEU 112.A O no hydrogen 2.725 N/A SER 117.A N LEU 113.A O no hydrogen 2.894 N/A SER 117.A OG ASP 277.A OD1 no hydrogen 2.580 N/A GLN 118.A N LEU 114.A O no hydrogen 3.021 N/A GLN 118.A NE2 ALA 147.A O no hydrogen 2.933 N/A ILE 119.A N TYR 115.A O no hydrogen 2.926 N/A CYS 120.A N SER 116.A O no hydrogen 2.933 N/A CYS 120.A SG PHE 269.A O no hydrogen 3.301 N/A LYS 121.A N SER 117.A O no hydrogen 2.891 N/A GLY 122.A N GLN 118.A O no hydrogen 2.967 N/A MET 123.A N ILE 119.A O no hydrogen 2.919 N/A GLU 124.A N CYS 120.A O no hydrogen 2.859 N/A TYR 125.A N LYS 121.A O no hydrogen 2.942 N/A LEU 126.A N GLY 122.A O no hydrogen 2.868 N/A GLY 127.A N MET 123.A O no hydrogen 2.973 N/A SER 128.A N GLU 124.A O no hydrogen 3.048 N/A SER 128.A OG TYR 125.A O no hydrogen 2.662 N/A ARG 129.A N TYR 125.A O no hydrogen 3.241 N/A ARG 129.A N LEU 126.A O no hydrogen 3.046 N/A ARG 130.A N GLY 127.A O no hydrogen 2.973 N/A ARG 130.A NE LEU 160.A O no hydrogen 3.046 N/A ARG 130.A NH1 PRO 161.A O no hydrogen 2.938 N/A ARG 130.A NH1 LYS 164.A O no hydrogen 3.299 N/A ARG 130.A NH1 ASP 165.A OD1 no hydrogen 2.951 N/A CYS 131.A N LEU 126.A O no hydrogen 3.028 N/A CYS 131.A SG VAL 132.A O no hydrogen 3.839 N/A CYS 131.A SG LYS 158.A O no hydrogen 3.866 N/A VAL 132.A N LYS 158.A O no hydrogen 2.840 N/A HIS 133.A N ASP 195.A OD1 no hydrogen 2.791 N/A HIS 133.A NE2 ASP 153.A O no hydrogen 2.615 N/A ARG 134.A N ASP 195.A OD2 no hydrogen 2.977 N/A ARG 134.A NE TYR 167.A OH no hydrogen 2.304 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 3.119 N/A ALA 138.A N GLU 205.A OE2 no hydrogen 2.825 N/A ARG 139.A NH1 ASP 135.A OD1 no hydrogen 3.048 N/A ASN 140.A N ALA 137.A O no hydrogen 2.926 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.777 N/A ASN 140.A ND2 ASP 135.A OD2 no hydrogen 3.094 N/A ILE 141.A N ALA 138.A O no hydrogen 3.057 N/A LEU 142.A N LYS 150.A O no hydrogen 2.800 N/A VAL 143.A N GLY 94.A O no hydrogen 2.857 N/A GLU 144.A N HIS 148.A O no hydrogen 2.824 N/A SER 145.A N HIS 148.A O no hydrogen 3.156 N/A ALA 147.A N SER 145.A OG no hydrogen 3.190 N/A HIS 148.A N SER 145.A O no hydrogen 3.048 N/A HIS 148.A NE2 ASP 67.A O no hydrogen 2.586 N/A VAL 149.A N GLN 118.A OE1 no hydrogen 2.933 N/A LYS 150.A N LEU 142.A O no hydrogen 2.867 N/A LYS 150.A NZ GLU 89.A OE1 no hydrogen 3.545 N/A LYS 150.A NZ GLU 89.A OE2 no hydrogen 2.649 N/A ILE 151.A N PHE 68.A O no hydrogen 2.796 N/A ALA 152.A N ASN 140.A O no hydrogen 2.918 N/A GLY 155.A N ASP 153.A OD2 no hydrogen 3.065 N/A ALA 157.A N PHE 154.A O no hydrogen 3.206 N/A LYS 158.A N VAL 132.A O no hydrogen 2.897 N/A LEU 160.A N ARG 130.A O no hydrogen 2.749 N/A LYS 164.A N PRO 161.A O no hydrogen 3.324 N/A TYR 167.A N PHE 190.A O no hydrogen 3.005 N/A VAL 169.A N ASN 188.A O no hydrogen 3.117 N/A GLN 174.A NE2 GLN 174.A O no hydrogen 3.184 N/A SER 175.A N TYR 180.A OH no hydrogen 3.185 N/A TRP 179.A NE1 GLU 205.A OE2 no hydrogen 2.952 N/A TYR 180.A N ILE 177.A O no hydrogen 3.274 N/A GLU 183.A N GLU 183.A OE2 no hydrogen 2.783 N/A SER 184.A N ALA 181.A O no hydrogen 2.929 N/A SER 184.A OG ILE 189.A O no hydrogen 2.579 N/A LEU 185.A N ALA 181.A O no hydrogen 3.054 N/A SER 186.A N PRO 182.A O no hydrogen 2.795 N/A SER 186.A OG PRO 182.A O no hydrogen 2.973 N/A SER 186.A OG ASP 187.A OD2 no hydrogen 2.930 N/A ASP 187.A N GLU 183.A O no hydrogen 3.045 N/A ASN 188.A N SER 184.A O no hydrogen 2.917 N/A ILE 189.A N GLU 183.A O no hydrogen 3.274 N/A PHE 190.A N TYR 167.A O no hydrogen 3.067 N/A SER 191.A N SER 194.A OG no hydrogen 2.901 N/A ARG 192.A NH1 GLY 127.A O no hydrogen 2.859 N/A GLN 193.A N SER 191.A OG no hydrogen 3.086 N/A GLN 193.A NE2 PRO 263.A O no hydrogen 3.444 N/A GLN 193.A NE2 PRO 267.A O no hydrogen 3.321 N/A SER 194.A N SER 191.A OG no hydrogen 3.221 N/A SER 194.A OG SER 191.A O no hydrogen 2.810 N/A ASP 195.A N SER 191.A O no hydrogen 3.066 N/A VAL 196.A N ARG 192.A O no hydrogen 3.156 N/A TRP 197.A N GLN 193.A O no hydrogen 3.319 N/A SER 198.A N SER 194.A O no hydrogen 3.102 N/A SER 198.A OG TRP 179.A O no hydrogen 2.761 N/A SER 198.A OG SER 194.A O no hydrogen 3.430 N/A PHE 199.A N ASP 195.A O no hydrogen 2.855 N/A GLY 200.A N VAL 196.A O no hydrogen 3.072 N/A VAL 201.A N TRP 197.A O no hydrogen 3.363 N/A VAL 202.A N SER 198.A O no hydrogen 2.892 N/A LEU 203.A N PHE 199.A O no hydrogen 2.815 N/A TYR 204.A N GLY 200.A O no hydrogen 3.028 N/A TYR 204.A OH CYS 214.A O no hydrogen 2.598 N/A GLU 205.A N VAL 201.A O no hydrogen 2.846 N/A LEU 206.A N VAL 202.A O no hydrogen 2.914 N/A PHE 207.A N LEU 203.A O no hydrogen 3.050 N/A THR 208.A N TYR 204.A O no hydrogen 2.987 N/A THR 208.A OG1 TYR 204.A O no hydrogen 2.857 N/A THR 208.A OG1 GLU 205.A O no hydrogen 3.107 N/A TYR 209.A N LEU 206.A O no hydrogen 2.971 N/A TYR 209.A OH LEU 107.A O no hydrogen 2.685 N/A CYS 210.A N GLU 205.A O no hydrogen 2.773 N/A CYS 210.A SG GLU 205.A O no hydrogen 3.633 N/A ASP 211.A N THR 208.A O no hydrogen 2.896 N/A SER 213.A N ASP 211.A OD1 no hydrogen 2.900 N/A SER 213.A OG ASP 211.A OD1 no hydrogen 2.521 N/A SER 215.A N LYS 212.A O no hydrogen 3.354 N/A SER 215.A OG LYS 212.A O no hydrogen 3.135 N/A SER 215.A OG SER 217.A OG no hydrogen 3.240 N/A SER 217.A OG SER 215.A OG no hydrogen 3.240 N/A ALA 218.A N SER 215.A OG no hydrogen 3.154 N/A GLU 219.A N SER 215.A O no hydrogen 2.866 N/A PHE 220.A N PRO 216.A O no hydrogen 2.961 N/A LEU 221.A N SER 217.A O no hydrogen 2.952 N/A ARG 222.A N ALA 218.A O no hydrogen 3.067 N/A ARG 222.A NE GLU 219.A OE1 no hydrogen 2.901 N/A ARG 222.A NH1 GLU 219.A OE2 no hydrogen 2.838 N/A MET 223.A N GLU 219.A O no hydrogen 2.870 N/A MET 224.A N PHE 220.A O no hydrogen 2.748 N/A ARG 230.A N PRO 226.A O no hydrogen 2.911 N/A LEU 231.A N ALA 227.A O no hydrogen 2.858 N/A LEU 232.A N LEU 228.A O no hydrogen 2.885 N/A GLU 233.A N SER 229.A O no hydrogen 2.816 N/A LEU 234.A N ARG 230.A O no hydrogen 2.892 N/A LEU 235.A N LEU 231.A O no hydrogen 2.846 N/A GLU 236.A N LEU 232.A O no hydrogen 2.680 N/A GLU 237.A N GLU 233.A O no hydrogen 2.960 N/A GLY 238.A N LEU 235.A O no hydrogen 2.962 N/A GLN 239.A N LEU 234.A O no hydrogen 3.129 N/A GLN 239.A NE2 GLU 237.A OE2 no hydrogen 3.528 N/A ARG 240.A NE TRP 259.A O no hydrogen 3.146 N/A ARG 240.A NH1 TRP 259.A O no hydrogen 2.903 N/A ARG 240.A NH2 LEU 235.A O no hydrogen 3.031 N/A ARG 240.A NH2 GLN 239.A O no hydrogen 2.940 N/A CYS 247.A N PRO 244.A O no hydrogen 2.940 N/A CYS 247.A SG PRO 248.A O no hydrogen 3.358 N/A GLU 250.A N GLU 250.A OE2 no hydrogen 2.640 N/A HIS 252.A N PRO 248.A O no hydrogen 3.191 N/A GLU 253.A N ALA 249.A O no hydrogen 2.945 N/A LEU 254.A N GLU 250.A O no hydrogen 3.022 N/A MET 255.A N VAL 251.A O no hydrogen 2.917 N/A LYS 256.A N HIS 252.A O no hydrogen 3.018 N/A LYS 256.A NZ GLU 253.A OE1 no hydrogen 3.393 N/A LYS 256.A NZ GLU 253.A OE2 no hydrogen 2.813 N/A LEU 257.A N GLU 253.A O no hydrogen 3.152 N/A CYS 258.A N LEU 254.A O no hydrogen 3.045 N/A CYS 258.A SG LEU 254.A O no hydrogen 3.470 N/A TRP 259.A N MET 255.A O no hydrogen 2.960 N/A ALA 260.A N LEU 257.A O no hydrogen 3.114 N/A SER 262.A OG ASP 265.A OD1 no hydrogen 2.384 N/A ASP 265.A N SER 262.A O no hydrogen 2.981 N/A ARG 266.A N PRO 263.A O no hydrogen 3.350 N/A ARG 266.A NE ALA 260.A O no hydrogen 2.901 N/A ARG 266.A NH1 GLU 183.A OE1 no hydrogen 3.569 N/A ARG 266.A NH1 GLU 183.A OE2 no hydrogen 2.837 N/A ARG 266.A NH1 ALA 260.A O no hydrogen 3.262 N/A ARG 266.A NH1 PRO 261.A O no hydrogen 3.135 N/A ARG 266.A NH2 GLU 183.A OE1 no hydrogen 2.760 N/A ARG 266.A NH2 GLN 193.A O no hydrogen 3.044 N/A ALA 271.A N SER 268.A OG no hydrogen 2.744 N/A LEU 272.A N SER 268.A O no hydrogen 2.886 N/A GLY 273.A N PHE 269.A O no hydrogen 3.067 N/A LEU 276.A N LEU 272.A O no hydrogen 2.867 N/A ASP 277.A N GLY 273.A O no hydrogen 2.938 N/A MET 278.A N PRO 274.A O no hydrogen 2.915 N/A LEU 279.A N GLN 275.A O no hydrogen 3.214 N/A