Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i12_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ LYS 32.A O no hydrogen 2.784 N/A LEU 3.A N ARG 34.A O no hydrogen 3.186 N/A ARG 4.A N ASP 99.A OD2 no hydrogen 2.789 N/A ARG 4.A NE THR 97.A O no hydrogen 2.854 N/A ARG 4.A NH2 PRO 96.A O no hydrogen 2.950 N/A VAL 5.A N ASP 36.A O no hydrogen 2.739 N/A GLY 6.A N VAL 100.A O no hydrogen 2.806 N/A ILE 7.A N VAL 38.A O no hydrogen 3.092 N/A VAL 8.A N PHE 102.A O no hydrogen 2.985 N/A PHE 9.A N LEU 40.A O no hydrogen 3.255 N/A GLY 10.A N SER 19.A OG no hydrogen 2.881 N/A GLY 11.A N ILE 42.A O no hydrogen 2.793 N/A SER 13.A OG GLU 15.A OE1 no hydrogen 2.847 N/A SER 13.A OG HIS 106.A O no hydrogen 2.821 N/A GLU 15.A N SER 13.A OG no hydrogen 2.911 N/A HIS 16.A N SER 13.A O no hydrogen 3.137 N/A GLU 17.A N GLU 17.A OE1 no hydrogen 2.882 N/A SER 19.A N GLU 15.A O no hydrogen 2.852 N/A SER 19.A OG ILE 104.A O no hydrogen 2.674 N/A LEU 20.A N HIS 16.A O no hydrogen 2.841 N/A GLN 21.A N GLU 17.A O no hydrogen 3.298 N/A SER 22.A N VAL 18.A O no hydrogen 2.843 N/A SER 22.A OG VAL 18.A O no hydrogen 3.393 N/A ALA 23.A N SER 19.A O no hydrogen 2.942 N/A LYS 24.A N LEU 20.A O no hydrogen 2.966 N/A LYS 24.A NZ ALA 60.A O no hydrogen 3.045 N/A ASN 25.A N GLN 21.A O no hydrogen 3.076 N/A ILE 26.A N SER 22.A O no hydrogen 2.951 N/A VAL 27.A N ALA 23.A O no hydrogen 2.952 N/A ASP 28.A N LYS 24.A O no hydrogen 3.015 N/A ALA 29.A N ASN 25.A O no hydrogen 2.927 N/A ILE 30.A N ILE 26.A O no hydrogen 3.001 N/A THR 33.A N ASP 31.A OD1 no hydrogen 2.729 N/A THR 33.A OG1 ASP 31.A OD1 no hydrogen 2.567 N/A THR 33.A OG1 ASP 31.A OD2 no hydrogen 3.348 N/A ARG 34.A N ASP 31.A O no hydrogen 2.962 N/A ARG 34.A NH2 GLU 345.A OE2 no hydrogen 2.970 N/A PHE 35.A N ASP 31.A O no hydrogen 2.985 N/A ASP 36.A N LEU 3.A O no hydrogen 2.896 N/A VAL 38.A N VAL 5.A O no hydrogen 2.880 N/A LEU 40.A N ILE 7.A O no hydrogen 2.829 N/A ILE 42.A N PHE 9.A O no hydrogen 2.785 N/A ASP 43.A N GLN 47.A O no hydrogen 2.946 N/A LYS 44.A NZ GLU 17.A OE2 no hydrogen 2.698 N/A GLY 46.A N ASP 43.A O no hydrogen 2.814 N/A HIS 49.A N GLY 41.A O no hydrogen 2.785 N/A HIS 49.A ND1 ILE 73.A O no hydrogen 2.917 N/A HIS 49.A NE2 ASP 43.A OD2 no hydrogen 3.021 N/A ASN 51.A N LEU 39.A O no hydrogen 2.822 N/A ASN 51.A ND2 HIS 49.A O no hydrogen 3.561 N/A GLN 58.A N ALA 67.A O no hydrogen 2.730 N/A ASP 62.A N ASN 59.A O no hydrogen 3.028 N/A HIS 65.A N ASP 62.A O no hydrogen 2.729 N/A ILE 66.A N ASP 62.A O no hydrogen 2.828 N/A ARG 69.A N TYR 56.A O no hydrogen 2.879 N/A LEU 75.A N TRP 48.A O no hydrogen 2.914 N/A ALA 76.A N ILE 87.A O no hydrogen 2.818 N/A GLN 77.A NE2 MET 118.A O no hydrogen 3.347 N/A VAL 78.A N GLN 85.A O no hydrogen 2.781 N/A GLY 80.A N VAL 121.A O no hydrogen 3.088 N/A HIS 84.A N THR 97.A OG1 no hydrogen 2.707 N/A HIS 84.A ND1 LEU 95.A O no hydrogen 2.956 N/A GLN 85.A N GLN 85.A OE1 no hydrogen 2.787 N/A GLN 85.A NE2 ALA 122.A O no hydrogen 2.871 N/A ILE 87.A N ALA 76.A O no hydrogen 2.923 N/A ASN 88.A N GLN 93.A O no hydrogen 2.666 N/A ALA 89.A N SER 74.A O no hydrogen 2.726 N/A GLN 90.A N ASN 88.A OD1 no hydrogen 2.861 N/A ASN 91.A N ASN 88.A OD1 no hydrogen 3.381 N/A GLY 92.A N ASN 88.A O no hydrogen 2.917 N/A GLN 93.A N ASN 91.A OD1 no hydrogen 2.841 N/A LEU 95.A N LEU 86.A O no hydrogen 2.964 N/A ASP 99.A N ARG 4.A O no hydrogen 2.833 N/A VAL 100.A N ARG 4.A O no hydrogen 3.326 N/A ILE 101.A N PRO 125.A O no hydrogen 2.808 N/A PHE 102.A N GLY 6.A O no hydrogen 2.744 N/A ILE 104.A N VAL 8.A O no hydrogen 2.690 N/A GLY 107.A N GLU 111.A OE1 no hydrogen 2.934 N/A GLU 111.A N GLY 107.A O no hydrogen 2.897 N/A SER 114.A N ASP 112.A OD1 no hydrogen 3.056 N/A SER 114.A OG ASP 112.A OD1 no hydrogen 2.870 N/A LEU 115.A N LEU 109.A O no hydrogen 3.061 N/A GLN 116.A NE2 GLY 110.A O no hydrogen 2.817 N/A GLY 117.A N GLY 113.A O no hydrogen 2.966 N/A MET 118.A N SER 114.A O no hydrogen 3.194 N/A LEU 119.A N LEU 115.A O no hydrogen 2.910 N/A ARG 120.A N GLN 116.A O no hydrogen 2.895 N/A ARG 120.A NE ASP 130.A OD2 no hydrogen 3.167 N/A ARG 120.A NH2 ASP 130.A OD2 no hydrogen 2.508 N/A VAL 121.A N GLY 117.A O no hydrogen 2.838 N/A ALA 122.A N MET 118.A O no hydrogen 2.935 N/A ASN 123.A N ARG 120.A O no hydrogen 3.104 N/A LEU 124.A N LEU 119.A O no hydrogen 3.045 N/A VAL 127.A N ILE 101.A O no hydrogen 2.898 N/A SER 129.A OG ALA 293.A O no hydrogen 3.175 N/A VAL 131.A N ASP 130.A OD2 no hydrogen 2.690 N/A SER 133.A OG LEU 290.A O no hydrogen 2.736 N/A SER 134.A N ASP 130.A O no hydrogen 2.936 N/A SER 134.A OG SER 129.A O no hydrogen 3.270 N/A SER 134.A OG ASP 130.A O no hydrogen 2.855 N/A ALA 135.A N VAL 131.A O no hydrogen 2.853 N/A ALA 136.A N LEU 132.A O no hydrogen 2.771 N/A CYS 137.A N SER 133.A O no hydrogen 2.883 N/A CYS 137.A SG SER 133.A O no hydrogen 3.329 N/A MET 138.A N SER 134.A O no hydrogen 3.167 N/A ASP 139.A N ALA 135.A O no hydrogen 3.152 N/A ASP 139.A N ALA 136.A O no hydrogen 3.238 N/A LYS 140.A N ALA 186.A O no hydrogen 2.865 N/A VAL 142.A N ASP 139.A OD1 no hydrogen 3.068 N/A ALA 143.A N ASP 139.A O no hydrogen 2.898 N/A LYS 144.A N LYS 140.A O no hydrogen 3.109 N/A LYS 144.A NZ ALA 155.A O no hydrogen 3.229 N/A LYS 144.A NZ GLU 220.A OE2 no hydrogen 2.944 N/A ARG 145.A N ASP 141.A O no hydrogen 2.958 N/A ARG 145.A NE ASP 141.A OD1 no hydrogen 3.394 N/A ARG 145.A NE ASP 141.A OD2 no hydrogen 3.428 N/A ARG 145.A NH2 ASP 141.A OD2 no hydrogen 2.717 N/A LEU 146.A N VAL 142.A O no hydrogen 2.961 N/A LEU 147.A N ALA 143.A O no hydrogen 2.829 N/A ARG 148.A N LYS 144.A O no hydrogen 2.891 N/A ASP 149.A N ARG 145.A O no hydrogen 2.965 N/A ALA 150.A N LEU 146.A O no hydrogen 3.059 N/A GLY 151.A N ARG 148.A O no hydrogen 3.046 N/A LEU 152.A N LEU 147.A O no hydrogen 2.964 N/A ILE 158.A N VAL 219.A O no hydrogen 2.839 N/A THR 159.A OG1 ASP 141.A OD1 no hydrogen 2.663 N/A LEU 160.A N VAL 217.A O no hydrogen 2.657 N/A THR 163.A N THR 161.A OG1 no hydrogen 3.138 N/A ASN 164.A N THR 161.A OG1 no hydrogen 3.025 N/A ASN 164.A ND2 THR 161.A O no hydrogen 3.427 N/A ALA 167.A N ASN 164.A O no hydrogen 2.875 N/A SER 169.A OG GLU 172.A OE2 no hydrogen 3.328 N/A GLU 172.A N SER 169.A OG no hydrogen 3.072 N/A VAL 173.A N SER 169.A O no hydrogen 2.951 N/A GLU 174.A N PHE 170.A O no hydrogen 2.751 N/A SER 175.A N ALA 171.A O no hydrogen 2.710 N/A SER 175.A OG GLU 172.A O no hydrogen 2.832 N/A ARG 176.A N GLU 172.A O no hydrogen 2.991 N/A LEU 177.A N VAL 173.A O no hydrogen 2.978 N/A GLY 178.A N GLU 174.A O no hydrogen 2.956 N/A LEU 181.A N VAL 197.A O no hydrogen 2.879 N/A PHE 182.A N GLU 220.A O no hydrogen 2.841 N/A VAL 183.A N SER 195.A O no hydrogen 2.984 N/A LYS 184.A N VAL 218.A O no hydrogen 2.802 N/A LYS 184.A NZ GLU 220.A OE1 no hydrogen 2.753 N/A ALA 186.A N LYS 216.A O no hydrogen 2.915 N/A SER 190.A OG GLY 189.A O no hydrogen 2.823 N/A SER 190.A OG SER 190.A O no hydrogen 2.294 N/A VAL 192.A N GLY 189.A O no hydrogen 3.281 N/A VAL 194.A N SER 191.A O no hydrogen 2.808 N/A SER 195.A N VAL 183.A O no hydrogen 2.898 N/A VAL 197.A N LEU 181.A O no hydrogen 2.732 N/A ALA 198.A N GLN 202.A OE1 no hydrogen 2.856 N/A GLN 202.A N ASN 199.A OD1 no hydrogen 2.906 N/A TYR 203.A N ASN 199.A O no hydrogen 2.879 N/A GLN 204.A N GLU 200.A O no hydrogen 3.083 N/A GLN 204.A N ALA 201.A O no hydrogen 3.156 N/A GLN 205.A N ALA 201.A O no hydrogen 3.155 N/A ALA 206.A N GLN 202.A O no hydrogen 2.611 N/A VAL 207.A N TYR 203.A O no hydrogen 3.038 N/A ALA 208.A N GLN 204.A O no hydrogen 3.132 N/A LEU 209.A N GLN 205.A O no hydrogen 2.996 N/A ALA 210.A N ALA 206.A O no hydrogen 3.184 N/A PHE 211.A N VAL 207.A O no hydrogen 3.007 N/A GLU 212.A N LEU 209.A O no hydrogen 2.711 N/A PHE 213.A N ALA 210.A O no hydrogen 2.930 N/A ASP 214.A N ALA 210.A O no hydrogen 3.325 N/A HIS 215.A N ASP 214.A OD1 no hydrogen 3.021 N/A LYS 216.A NZ ASP 139.A OD1 no hydrogen 3.378 N/A LYS 216.A NZ ASP 139.A OD2 no hydrogen 2.769 N/A LYS 216.A NZ ASP 141.A OD2 no hydrogen 2.770 N/A VAL 217.A N LEU 160.A O no hydrogen 2.931 N/A VAL 218.A N LYS 184.A O no hydrogen 2.668 N/A VAL 219.A N ILE 158.A O no hydrogen 2.964 N/A GLU 220.A N PHE 182.A O no hydrogen 2.814 N/A GLN 221.A N PRO 156.A O no hydrogen 2.859 N/A GLN 221.A NE2 LEU 177.A O no hydrogen 3.521 N/A GLY 222.A N PRO 180.A O no hydrogen 2.967 N/A LYS 224.A NZ GLY 222.A O no hydrogen 3.467 N/A ARG 226.A N LEU 302.A O no hydrogen 2.953 N/A ARG 226.A NE GLU 245.A OE2 no hydrogen 3.110 N/A ARG 226.A NH2 GLU 245.A OE1 no hydrogen 2.919 N/A ARG 226.A NH2 GLN 270.A O no hydrogen 3.050 N/A ILE 228.A N VAL 300.A O no hydrogen 2.947 N/A GLU 229.A N GLY 244.A O no hydrogen 2.761 N/A CYS 230.A N VAL 298.A O no hydrogen 2.911 N/A CYS 230.A SG SER 241.A O no hydrogen 3.571 N/A ALA 231.A N SER 241.A OG no hydrogen 2.819 N/A VAL 232.A N ALA 296.A O no hydrogen 2.901 N/A LEU 233.A N GLN 239.A O no hydrogen 2.798 N/A GLY 234.A N GLY 294.A O no hydrogen 2.899 N/A ASN 235.A ND2 LEU 346.A O no hydrogen 2.902 N/A GLN 239.A N LEU 233.A O no hydrogen 2.712 N/A SER 241.A N ALA 231.A O no hydrogen 2.812 N/A SER 241.A OG ALA 231.A O no hydrogen 3.194 N/A SER 241.A OG THR 242.A O no hydrogen 2.811 N/A THR 242.A N SER 332.A OG no hydrogen 2.861 N/A CYS 243.A N ASN 276.A OD1 no hydrogen 2.934 N/A CYS 243.A SG ASN 276.A O no hydrogen 3.932 N/A GLY 244.A N GLU 229.A O no hydrogen 2.915 N/A GLU 245.A N VAL 266.A O no hydrogen 2.810 N/A ILE 246.A N GLU 227.A O no hydrogen 3.097 N/A VAL 247.A N GLN 264.A O no hydrogen 2.968 N/A GLU 251.A N ASN 249.A OD1 no hydrogen 2.890 N/A LYS 256.A N TYR 253.A O no hydrogen 3.433 N/A ILE 258.A N THR 255.A O no hydrogen 3.354 N/A ASN 261.A ND2 THR 255.A O no hydrogen 3.122 N/A GLY 262.A N ASP 259.A O no hydrogen 3.172 N/A ALA 263.A N ASP 260.A O no hydrogen 2.902 N/A VAL 266.A N GLU 245.A O no hydrogen 2.829 N/A ALA 269.A N CYS 243.A O no hydrogen 2.814 N/A ILE 271.A N ALA 269.A O no hydrogen 2.874 N/A SER 273.A OG GLU 274.A OE1 no hydrogen 3.313 N/A GLU 274.A N GLU 274.A OE1 no hydrogen 2.836 N/A ASN 276.A N PRO 272.A O no hydrogen 2.888 N/A ASN 276.A ND2 THR 242.A OG1 no hydrogen 2.854 N/A ASP 277.A N SER 273.A O no hydrogen 2.775 N/A LYS 278.A N GLU 274.A O no hydrogen 3.050 N/A LYS 278.A NZ ASN 306.A O no hydrogen 2.825 N/A ILE 279.A N VAL 275.A O no hydrogen 2.949 N/A ARG 280.A N ASN 276.A O no hydrogen 2.888 N/A ARG 280.A NE ALA 240.A O no hydrogen 3.228 N/A ARG 280.A NE SER 241.A O no hydrogen 2.946 N/A ARG 280.A NH1 ASP 277.A OD1 no hydrogen 2.911 N/A ARG 280.A NH2 ALA 240.A O no hydrogen 2.876 N/A ALA 281.A N ASP 277.A O no hydrogen 2.973 N/A ILE 282.A N LYS 278.A O no hydrogen 3.200 N/A ALA 283.A N ILE 279.A O no hydrogen 2.809 N/A ILE 284.A N ARG 280.A O no hydrogen 3.079 N/A GLN 285.A N ALA 281.A O no hydrogen 3.167 N/A ALA 286.A N ILE 282.A O no hydrogen 2.893 N/A TYR 287.A N ALA 283.A O no hydrogen 2.964 N/A TYR 287.A OH GLY 234.A O no hydrogen 2.694 N/A GLN 288.A N ILE 284.A O no hydrogen 2.957 N/A THR 289.A N GLN 285.A O no hydrogen 2.947 N/A THR 289.A OG1 GLN 285.A O no hydrogen 2.841 N/A LEU 290.A N ALA 286.A O no hydrogen 2.991 N/A GLY 291.A N GLN 288.A O no hydrogen 3.108 N/A CYS 292.A N TYR 287.A O no hydrogen 3.191 N/A CYS 292.A SG SER 133.A OG no hydrogen 3.521 N/A CYS 292.A SG TYR 287.A O no hydrogen 3.802 N/A ALA 293.A N SER 129.A OG no hydrogen 3.053 N/A GLY 294.A N GLY 234.A O no hydrogen 2.872 N/A GLY 294.A N ASN 235.A OD1 no hydrogen 3.082 N/A MET 295.A N ALA 293.A O no hydrogen 2.924 N/A ALA 296.A N VAL 232.A O no hydrogen 3.107 N/A ARG 297.A N ASN 314.A O no hydrogen 2.864 N/A ARG 297.A NE ASP 299.A OD1 no hydrogen 2.869 N/A ARG 297.A NH2 ASP 299.A OD2 no hydrogen 2.909 N/A VAL 298.A N CYS 230.A O no hydrogen 2.952 N/A ASP 299.A N GLU 312.A O no hydrogen 2.957 N/A VAL 300.A N ILE 228.A O no hydrogen 2.798 N/A PHE 301.A N VAL 309.A O no hydrogen 2.745 N/A LEU 302.A N ARG 226.A O no hydrogen 2.796 N/A THR 303.A N GLU 307.A O no hydrogen 2.846 N/A THR 303.A OG1 GLU 307.A O no hydrogen 3.440 N/A ASN 306.A N THR 303.A O no hydrogen 2.745 N/A GLU 307.A N THR 303.A OG1 no hydrogen 3.065 N/A VAL 309.A N PHE 301.A O no hydrogen 2.834 N/A ILE 310.A N ASN 153.A O no hydrogen 2.816 N/A ASN 311.A N ASP 299.A O no hydrogen 2.855 N/A GLU 312.A N ASP 299.A O no hydrogen 3.198 N/A ASN 314.A N ARG 297.A O no hydrogen 2.956 N/A ASN 314.A ND2 ARG 297.A O no hydrogen 3.384 N/A ASN 314.A ND2 ASP 299.A OD2 no hydrogen 3.009 N/A LEU 316.A N GLU 111.A OE2 no hydrogen 2.848 N/A PHE 319.A N SER 22.A OG no hydrogen 2.895 N/A THR 320.A N SER 323.A OG no hydrogen 2.846 N/A THR 320.A OG1 SER 323.A OG no hydrogen 2.601 N/A ILE 322.A N THR 320.A OG1 no hydrogen 3.228 N/A SER 323.A N THR 320.A O no hydrogen 3.036 N/A SER 323.A OG ASP 259.A OD2 no hydrogen 2.687 N/A SER 323.A OG THR 320.A OG1 no hydrogen 2.601 N/A TYR 325.A OH VAL 232.A O no hydrogen 2.706 N/A LYS 327.A N SER 323.A O no hydrogen 3.185 N/A LYS 327.A NZ ASN 321.A O no hydrogen 3.524 N/A LYS 327.A NZ TYR 336.A OH no hydrogen 2.875 N/A LEU 328.A N MET 324.A O no hydrogen 2.801 N/A TRP 329.A N TYR 325.A O no hydrogen 3.344 N/A GLN 330.A N PRO 326.A O no hydrogen 2.880 N/A ALA 331.A N LYS 327.A O no hydrogen 2.880 N/A SER 332.A N TRP 329.A O no hydrogen 2.761 N/A SER 332.A OG LEU 328.A O no hydrogen 2.709 N/A GLY 333.A N GLN 330.A O no hydrogen 3.454 N/A LEU 334.A N TRP 329.A O no hydrogen 2.916 N/A TYR 336.A OH ASN 321.A O no hydrogen 2.290 N/A THR 337.A OG1 ALA 29.A O no hydrogen 2.507 N/A LEU 339.A N GLY 335.A O no hydrogen 2.844 N/A ILE 340.A N TYR 336.A O no hydrogen 3.028 N/A SER 341.A N THR 337.A O no hydrogen 3.072 N/A SER 341.A OG THR 337.A O no hydrogen 3.493 N/A ARG 342.A N ASP 338.A O no hydrogen 2.878 N/A ARG 342.A NH1 GLU 345.A OE1 no hydrogen 2.784 N/A LEU 343.A N LEU 339.A O no hydrogen 2.918 N/A ILE 344.A N ILE 340.A O no hydrogen 3.061 N/A GLU 345.A N SER 341.A O no hydrogen 2.934 N/A LEU 346.A N ARG 342.A O no hydrogen 2.904 N/A ALA 347.A N LEU 343.A O no hydrogen 3.069 N/A LEU 348.A N ILE 344.A O no hydrogen 2.996 N/A GLU 349.A N GLU 345.A O no hydrogen 2.987 N/A ARG 350.A N LEU 346.A O no hydrogen 3.024 N/A ARG 350.A NH2 ASP 130.A OD1 no hydrogen 2.361 N/A HIS 351.A N ALA 347.A O no hydrogen 3.034 N/A THR 352.A N LEU 348.A O no hydrogen 3.061 N/A THR 352.A OG1 LEU 348.A O no hydrogen 3.010 N/A ALA 353.A N GLU 349.A O no hydrogen 2.924 N/A ASN 354.A N ARG 350.A O no hydrogen 2.879 N/A ASN 355.A N HIS 351.A O no hydrogen 2.866 N/A ASN 355.A ND2 HIS 351.A O no hydrogen 3.625 N/A ALA 356.A N THR 352.A O no hydrogen 3.034 N/A LEU 357.A N ASN 354.A O no hydrogen 3.158 N/A