Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3l12_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N GLN 4.A OE1 no hydrogen 2.777 N/A GLN 4.A NE2 GLU 170.A O no hydrogen 2.897 N/A GLN 4.A NE2 ASP 191.A O no hydrogen 3.176 N/A LEU 5.A N PHE 2.A O no hydrogen 3.138 N/A GLU 6.A N SER 3.A O no hydrogen 3.222 N/A LEU 8.A N LEU 5.A O no hydrogen 3.022 N/A ARG 9.A N LEU 5.A O no hydrogen 2.898 N/A GLY 10.A N ASP 265.A OD2 no hydrogen 2.901 N/A HIS 11.A N.A VAL 14.A O no hydrogen 3.275 N/A HIS 11.A N.B VAL 14.A O no hydrogen 3.251 N/A VAL 14.A N HIS 11.A O.A no hydrogen 2.848 N/A VAL 14.A N HIS 11.A O.B no hydrogen 3.452 N/A VAL 15.A N SER 284.A O.A no hydrogen 3.062 N/A VAL 15.A N SER 284.A O.B no hydrogen 3.080 N/A ARG 16.A N ASP 265.A O no hydrogen 2.890 N/A ARG 16.A NE ARG 9.A O no hydrogen 2.815 N/A ARG 16.A NH1 TRP 285.A O no hydrogen 3.191 N/A ARG 16.A NH1 THR 286.A OXT.B no hydrogen 2.876 N/A ARG 16.A NH2 ARG 9.A O no hydrogen 2.905 N/A ILE 18.A N ILE 267.A O no hydrogen 2.832 N/A GLY 19.A N ALA 44.A O no hydrogen 2.955 N/A HIS 20.A N THR 269.A O no hydrogen 2.871 N/A HIS 20.A ND1 ASP 270.A OD1 no hydrogen 2.794 N/A ARG 21.A NH1 GLU 28.A OE2 no hydrogen 2.839 N/A GLY 22.A N GLY 19.A O no hydrogen 3.248 N/A ARG 24.A N HIS 20.A O no hydrogen 3.368 N/A ARG 24.A NE ASP 270.A OD1 no hydrogen 2.901 N/A ARG 24.A NH1 TYR 104.A OH no hydrogen 2.891 N/A ARG 24.A NH2 ASP 270.A OD1 no hydrogen 3.222 N/A ARG 24.A NH2 ASP 270.A OD2 no hydrogen 2.861 N/A GLY 25.A N ASP 270.A O no hydrogen 2.878 N/A VAL 26.A N ALA 23.A O no hydrogen 2.883 N/A ASN 29.A N ARG 21.A O no hydrogen 2.965 N/A ASN 29.A ND2 ASP 48.A OD2 no hydrogen 3.062 N/A THR 30.A OG1 PRO 27.A O no hydrogen 2.754 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.639 N/A GLY 33.A N THR 30.A OG1 no hydrogen 3.003 N/A PHE 34.A N THR 30.A O no hydrogen 2.870 N/A ALA 35.A N LEU 31.A O no hydrogen 2.985 N/A PHE 36.A N GLU 32.A O no hydrogen 3.053 N/A THR 37.A N GLY 33.A O no hydrogen 2.979 N/A THR 37.A OG1 GLY 33.A O no hydrogen 2.763 N/A LEU 38.A N PHE 34.A O no hydrogen 3.033 N/A ALA 39.A N ALA 35.A O no hydrogen 2.987 N/A ALA 40.A N PHE 36.A O no hydrogen 2.848 N/A ALA 40.A N THR 37.A O no hydrogen 3.192 N/A GLY 41.A N LEU 38.A O no hydrogen 3.122 N/A VAL 42.A N THR 37.A O no hydrogen 3.280 N/A ARG 43.A NH1 GLN 135.A O no hydrogen 2.617 N/A ARG 43.A NH2 ALA 136.A O no hydrogen 2.987 N/A LEU 45.A N TYR 138.A O no hydrogen 2.901 N/A GLU 46.A N GLY 19.A O no hydrogen 2.960 N/A PHE 47.A N LEU 140.A O no hydrogen 3.235 N/A VAL 49.A N GLU 142.A O no hydrogen 2.808 N/A VAL 50.A N.A VAL 57.A O no hydrogen 2.974 N/A VAL 50.A N.B VAL 57.A O no hydrogen 3.007 N/A THR 51.A OG1 ASP 53.A OD1 no hydrogen 2.680 N/A THR 51.A OG1 VAL 55.A O no hydrogen 3.481 N/A GLY 54.A N THR 51.A O no hydrogen 3.105 N/A VAL 55.A N THR 51.A OG1 no hydrogen 2.935 N/A VAL 57.A N VAL 50.A O.A no hydrogen 2.873 N/A VAL 57.A N VAL 50.A O.B no hydrogen 2.859 N/A VAL 58.A N PRO 120.A O no hydrogen 2.895 N/A THR 59.A N ASP 48.A O no hydrogen 3.269 N/A ASN 61.A ND2 HIS 63.A O no hydrogen 3.686 N/A HIS 62.A ND1 HIS 63.A ND1 no hydrogen 2.925 N/A HIS 63.A ND1 HIS 62.A ND1 no hydrogen 2.925 N/A LEU 64.A N ARG 81.A O no hydrogen 2.916 N/A ASN 66.A ND2 GLY 78.A O no hydrogen 2.963 N/A THR 68.A OG1 ALA 65.A O no hydrogen 2.731 N/A ARG 69.A N ASP 94.A O no hydrogen 2.874 N/A ARG 69.A NH1 THR 115.A OG1 no hydrogen 3.047 N/A ARG 69.A NH2 LEU 114.A O.A no hydrogen 2.793 N/A ARG 69.A NH2 LEU 114.A O.B no hydrogen 2.791 N/A ASP 70.A N HIS 74.A O no hydrogen 2.770 N/A GLN 72.A N ASP 70.A OD1 no hydrogen 2.858 N/A GLY 73.A N ASP 70.A O no hydrogen 3.064 N/A HIS 74.A N ASP 70.A OD1 no hydrogen 2.921 N/A LEU 76.A N THR 68.A O no hydrogen 2.967 N/A GLN 82.A NE2 ASP 146.A OD2 no hydrogen 2.947 N/A VAL 83.A N HIS 62.A O no hydrogen 2.789 N/A GLU 85.A N GLN 82.A O no hydrogen 3.051 N/A THR 86.A N GLU 89.A OE1 no hydrogen 2.943 N/A TYR 87.A N ASP 53.A OD1 no hydrogen 2.847 N/A TYR 87.A OH VAL 119.A O no hydrogen 2.601 N/A GLU 89.A N THR 86.A OG1 no hydrogen 3.132 N/A ILE 90.A N THR 86.A O no hydrogen 3.089 N/A ARG 91.A N TYR 87.A O no hydrogen 2.810 N/A ALA 92.A N ALA 88.A O no hydrogen 3.235 N/A LEU 93.A N ILE 90.A O no hydrogen 3.068 N/A ASP 94.A N ARG 69.A O no hydrogen 2.844 N/A VAL 95.A N ILE 117.A O no hydrogen 2.868 N/A GLY 96.A N ASP 94.A OD1 no hydrogen 2.994 N/A ASP 99.A N ALA 67.A O no hydrogen 2.865 N/A ARG 101.A N ASP 99.A OD1 no hydrogen 3.040 N/A ARG 101.A NE ASP 99.A OD1 no hydrogen 2.945 N/A ARG 101.A NE ASP 99.A OD2 no hydrogen 3.399 N/A ARG 101.A NH2 ASP 99.A OD2 no hydrogen 2.886 N/A THR 102.A N ASP 99.A O no hydrogen 3.109 N/A THR 102.A OG1 ASP 99.A O no hydrogen 2.743 N/A TYR 104.A OH GLU 28.A OE1 no hydrogen 2.499 N/A TYR 104.A OH GLU 28.A OE2 no hydrogen 3.321 N/A GLY 105.A N THR 102.A OG1 no hydrogen 2.908 N/A ARG 106.A N THR 102.A O no hydrogen 2.915 N/A ARG 106.A NH1 ARG 101.A O no hydrogen 3.064 N/A ARG 107.A N.A VAL 103.A O no hydrogen 3.262 N/A ARG 107.A N.A TYR 104.A O no hydrogen 3.042 N/A ARG 107.A N.B VAL 103.A O no hydrogen 3.224 N/A ARG 107.A N.B TYR 104.A O no hydrogen 3.028 N/A PHE 108.A N GLY 105.A O no hydrogen 3.120 N/A GLN 111.A N PHE 108.A O no hydrogen 3.441 N/A GLN 111.A NE2 ARG 24.A O no hydrogen 2.849 N/A ALA 112.A N VAL 26.A O no hydrogen 3.000 N/A LEU 114.A N.A GLY 96.A O no hydrogen 2.899 N/A LEU 114.A N.B GLY 96.A O no hydrogen 2.933 N/A GLY 116.A N ASP 94.A OD2 no hydrogen 2.743 N/A ILE 117.A N ASP 94.A OD1 no hydrogen 3.156 N/A ARG 121.A N.A GLU 124.A OE1 no hydrogen 2.882 N/A ARG 121.A N.B GLU 124.A OE1 no hydrogen 2.892 N/A LEU 122.A N PRO 56.A O no hydrogen 2.873 N/A GLU 124.A N ARG 121.A O.B no hydrogen 3.010 N/A LEU 125.A N ARG 121.A O.A no hydrogen 3.263 N/A LEU 125.A N ARG 121.A O.B no hydrogen 3.269 N/A LEU 126.A N LEU 122.A O no hydrogen 2.892 N/A ASP 127.A N GLY 123.A O no hydrogen 2.880 N/A LEU 128.A N GLU 124.A O no hydrogen 3.104 N/A CYS 129.A N LEU 125.A O no hydrogen 2.940 N/A CYS 129.A SG LEU 125.A O no hydrogen 3.448 N/A ALA 130.A N LEU 126.A O no hydrogen 2.867 N/A GLY 131.A N ASP 127.A O no hydrogen 3.091 N/A TYR 132.A N CYS 129.A O no hydrogen 3.094 N/A GLY 133.A N ALA 130.A O no hydrogen 2.999 N/A GLN 135.A N TYR 132.A O no hydrogen 2.920 N/A ALA 136.A N GLY 133.A O no hydrogen 2.897 N/A TYR 138.A N ARG 43.A O no hydrogen 2.926 N/A LEU 139.A N ARG 172.A O no hydrogen 2.760 N/A LEU 140.A N LEU 45.A O no hydrogen 2.869 N/A LEU 141.A N VAL 174.A O no hydrogen 3.001 N/A GLU 142.A N PHE 47.A O no hydrogen 2.809 N/A LEU 143.A N HIS 175.A O no hydrogen 2.843 N/A LYS 144.A N VAL 49.A O no hydrogen 3.005 N/A SER 145.A OG ASP 178.A OD2 no hydrogen 2.671 N/A ALA 148.A N ASP 146.A OD1 no hydrogen 2.910 N/A LEU 149.A N ASP 146.A O no hydrogen 3.027 N/A ASP 151.A N LEU 149.A O no hydrogen 2.691 N/A ALA 154.A N ASP 151.A OD1 no hydrogen 3.079 N/A ARG 155.A N ASP 151.A O no hydrogen 2.982 N/A ARG 155.A NH1 ASP 178.A OD2 no hydrogen 2.776 N/A ARG 155.A NH2 ASP 178.A OD1 no hydrogen 3.059 N/A ARG 155.A NH2 ASP 178.A OD2 no hydrogen 3.426 N/A ALA 156.A N HIS 152.A O no hydrogen 2.981 N/A GLU 157.A N ALA 153.A O no hydrogen 2.856 N/A ALA 159.A N ALA 156.A O no hydrogen 2.960 N/A ALA 160.A N GLU 157.A O no hydrogen 2.912 N/A LEU 162.A N VAL 158.A O no hydrogen 2.928 N/A ALA 163.A N ALA 159.A O no hydrogen 2.896 N/A ASP 164.A N ALA 160.A O no hydrogen 3.277 N/A VAL 165.A N VAL 161.A O no hydrogen 3.028 N/A ARG 166.A N LEU 162.A O no hydrogen 2.804 N/A ARG 166.A NH2 GLN 188.A O no hydrogen 3.499 N/A ARG 167.A N ALA 163.A O no hydrogen 2.897 N/A TYR 168.A N ASP 164.A O no hydrogen 3.233 N/A ARG 169.A N ARG 166.A O no hydrogen 3.011 N/A ARG 172.A NE ALA 136.A O no hydrogen 2.921 N/A ARG 172.A NH2 ASP 134.A O no hydrogen 3.334 N/A THR 173.A N GLU 170.A O no hydrogen 3.341 N/A VAL 174.A N LEU 139.A O no hydrogen 2.871 N/A HIS 175.A ND1 SER 195.A OG no hydrogen 2.756 N/A SER 176.A N SER 195.A O no hydrogen 3.033 N/A SER 176.A OG LEU 143.A O no hydrogen 2.818 N/A ASP 178.A N SER 176.A OG no hydrogen 2.928 N/A TRP 179.A NE1 LEU 197.A O no hydrogen 2.930 N/A LEU 181.A N ASP 178.A OD1 no hydrogen 3.168 N/A LEU 182.A N ASP 178.A O no hydrogen 3.162 N/A GLY 183.A N TRP 179.A O no hydrogen 3.257 N/A GLU 184.A N ALA 180.A O no hydrogen 3.298 N/A CYS 185.A N LEU 181.A O no hydrogen 2.871 N/A CYS 185.A SG LEU 181.A O no hydrogen 3.434 N/A ARG 186.A N LEU 182.A O no hydrogen 3.073 N/A ARG 186.A NH2 THR 194.A OG1 no hydrogen 3.171 N/A ARG 186.A NH2 TYR 196.A OH no hydrogen 2.796 N/A ARG 187.A N GLY 183.A O no hydrogen 3.154 N/A ARG 187.A NH2 GLU 184.A OE1 no hydrogen 3.045 N/A GLN 188.A N GLU 184.A O no hydrogen 2.957 N/A GLN 188.A NE2 ALA 156.A O no hydrogen 3.076 N/A GLN 188.A NE2 GLU 184.A OE2 no hydrogen 2.756 N/A ALA 189.A N CYS 185.A O no hydrogen 2.703 N/A LEU 192.A N ALA 189.A O no hydrogen 2.976 N/A THR 194.A N GLN 222.A OE1 no hydrogen 3.113 N/A THR 194.A OG1 GLN 222.A OE1 no hydrogen 3.443 N/A SER 195.A OG HIS 175.A ND1 no hydrogen 2.756 N/A TYR 196.A N LEU 223.A O no hydrogen 2.974 N/A LEU 197.A N SER 176.A O no hydrogen 3.067 N/A SER 198.A N CYS 225.A O no hydrogen 3.125 N/A GLN 199.A N TYR 206.A OH no hydrogen 2.968 N/A LEU 200.A N ASP 230.A OD2 no hydrogen 2.856 N/A SER 211.A OG GLU 238.A OE2 no hydrogen 2.679 N/A GLN 214.A N SER 211.A OG no hydrogen 3.150 N/A ALA 215.A N SER 211.A O no hydrogen 2.810 N/A VAL 216.A N LEU 212.A O no hydrogen 2.882 N/A ALA 217.A N PRO 213.A O no hydrogen 2.931 N/A SER 218.A N GLN 214.A O no hydrogen 2.827 N/A SER 218.A OG GLN 214.A O no hydrogen 3.171 N/A SER 218.A OG GLN 214.A OE1 no hydrogen 3.197 N/A ALA 219.A N ALA 215.A O no hydrogen 2.968 N/A GLY 220.A N VAL 216.A O no hydrogen 3.200 N/A GLY 220.A N ALA 217.A O no hydrogen 3.068 N/A GLY 221.A N VAL 216.A O no hydrogen 3.038 N/A GLN 222.A N THR 194.A O no hydrogen 2.913 N/A GLN 222.A NE2 GLY 220.A O no hydrogen 3.267 N/A LEU 223.A N THR 194.A O no hydrogen 3.247 N/A TRP 224.A N ILE 245.A O no hydrogen 2.904 N/A TRP 224.A NE1 SER 198.A OG no hydrogen 2.846 N/A CYS 225.A N TYR 196.A O no hydrogen 2.795 N/A CYS 225.A SG SER 195.A OG no hydrogen 3.167 N/A TYR 227.A N SER 198.A O no hydrogen 2.995 N/A PHE 228.A N TRP 249.A O no hydrogen 2.853 N/A ASP 230.A N TYR 227.A O no hydrogen 2.876 N/A VAL 231.A N PHE 228.A O no hydrogen 3.247 N/A GLU 234.A N GLU 234.A OE2 no hydrogen 2.565 N/A LEU 235.A N THR 232.A OG1 no hydrogen 3.103 N/A VAL 236.A N THR 232.A O no hydrogen 3.072 N/A ALA 237.A N PRO 233.A O no hydrogen 2.845 N/A GLU 238.A N GLU 234.A O no hydrogen 2.801 N/A ALA 239.A N LEU 235.A O no hydrogen 2.977 N/A HIS 240.A N VAL 236.A O no hydrogen 2.891 N/A HIS 240.A NE2 ASP 265.A OD1 no hydrogen 2.859 N/A ASP 241.A N ALA 237.A O no hydrogen 2.827 N/A LEU 242.A N GLU 238.A O no hydrogen 3.097 N/A GLY 243.A N HIS 240.A O no hydrogen 2.960 N/A LEU 244.A N ALA 239.A O no hydrogen 2.995 N/A ILE 245.A N GLN 222.A O no hydrogen 3.035 N/A VAL 246.A N ASP 265.A OD1 no hydrogen 2.782 N/A LEU 247.A N TRP 224.A O no hydrogen 3.251 N/A THR 248.A N GLY 266.A O no hydrogen 3.031 N/A THR 248.A OG1 PRO 226.A O no hydrogen 2.784 N/A TRP 249.A NE1 CYS 225.A O no hydrogen 2.827 N/A VAL 251.A N VAL 268.A O no hydrogen 2.829 N/A ASN 252.A ND2 ASP 270.A OD2 no hydrogen 2.783 N/A ILE 257.A N GLU 253.A O no hydrogen 2.895 N/A ARG 258.A N PRO 254.A O no hydrogen 2.966 N/A ARG 258.A NH2 ASP 281.A OD2 no hydrogen 2.736 N/A ARG 259.A N GLU 255.A O.A no hydrogen 3.060 N/A ARG 259.A N GLU 255.A O.B no hydrogen 2.929 N/A ARG 259.A NH1 ASP 256.A OD1 no hydrogen 3.031 N/A ARG 259.A NH2 ASP 256.A OD1 no hydrogen 3.244 N/A THR 261.A N.A ARG 258.A O no hydrogen 3.151 N/A THR 261.A N.A ARG 259.A O no hydrogen 3.130 N/A THR 261.A N.B ARG 258.A O no hydrogen 3.067 N/A THR 261.A OG1.A ARG 259.A O no hydrogen 2.763 N/A THR 261.A OG1.B ARG 258.A O no hydrogen 3.020 N/A THR 262.A N.A ARG 259.A O no hydrogen 3.097 N/A THR 262.A N.B ARG 259.A O no hydrogen 3.071 N/A THR 262.A OG1.B ARG 259.A O no hydrogen 2.994 N/A GLY 263.A N ALA 260.A O no hydrogen 3.281 N/A ASP 265.A N VAL 246.A O no hydrogen 2.856 N/A GLY 266.A N VAL 246.A O no hydrogen 3.311 N/A ILE 267.A N ARG 16.A O no hydrogen 2.855 N/A VAL 268.A N THR 248.A O no hydrogen 2.790 N/A THR 269.A N ILE 18.A O no hydrogen 2.949 N/A THR 269.A OG1 VAL 251.A O no hydrogen 2.692 N/A THR 269.A OG1 ASN 252.A OD1 no hydrogen 3.241 N/A THR 269.A OG1 THR 275.A OG1 no hydrogen 3.178 N/A ASP 270.A N ASN 252.A OD1 no hydrogen 2.928 N/A TYR 271.A N THR 269.A OG1 no hydrogen 3.046 N/A ARG 274.A NH1 ASN 252.A O no hydrogen 2.852 N/A THR 275.A N TYR 271.A O no hydrogen 3.091 N/A THR 275.A OG1 THR 269.A OG1 no hydrogen 3.178 N/A THR 275.A OG1 TYR 271.A O no hydrogen 3.132 N/A GLN 276.A N PRO 272.A O no hydrogen 2.771 N/A GLN 276.A NE2 ALA 40.A O no hydrogen 3.002 N/A ARG 277.A N GLY 273.A O no hydrogen 2.936 N/A ILE 278.A N ARG 274.A O no hydrogen 3.141 N/A LEU 279.A N THR 275.A O no hydrogen 2.949 N/A ILE 280.A N GLN 276.A O no hydrogen 2.866 N/A ASP 281.A N ARG 277.A O no hydrogen 2.903 N/A LEU 283.A N LEU 279.A O no hydrogen 2.899 N/A SER 284.A N.A SER 13.A O no hydrogen 3.034 N/A SER 284.A N.B SER 13.A O no hydrogen 2.987 N/A SER 284.A OG.A THR 286.A O.A no hydrogen 2.902 N/A SER 284.A OG.B THR 286.A O.A no hydrogen 2.747 N/A THR 286.A N.A SER 284.A OG.B no hydrogen 3.244 N/A THR 286.A OG1.A SER 284.A OG.B no hydrogen 3.392 N/A