Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7a3u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASP 42.A OD2 no hydrogen 3.154 N/A ILE 1.A N SER 142.A O no hydrogen 3.455 N/A ILE 1.A N SER 142.A OG no hydrogen 2.695 N/A ARG 2.A NE GLU 44.A OE1 no hydrogen 2.797 N/A ARG 2.A NH2 GLU 44.A OE1 no hydrogen 3.264 N/A CYS 3.A N ASP 42.A OD2 no hydrogen 2.997 N/A CYS 3.A SG VAL 31.A O no hydrogen 3.475 N/A ILE 4.A N ILE 1.A O no hydrogen 3.047 N/A VAL 6.A N CYS 3.A O no hydrogen 3.239 N/A ARG 9.A NE THR 32.A OG1 no hydrogen 2.967 N/A ARG 9.A NH1 GLU 372.A OE1 no hydrogen 2.770 N/A ARG 9.A NH2 THR 32.A OG1 no hydrogen 2.743 N/A ARG 9.A NH2 GLU 372.A OE2 no hydrogen 3.147 N/A ASP 10.A N CYS 30.A O no hydrogen 3.019 N/A VAL 12.A N THR 32.A O no hydrogen 3.265 N/A GLY 14.A N MET 34.A O no hydrogen 2.961 N/A GLY 18.A N MET 15.A O no hydrogen 3.051 N/A VAL 21.A N LEU 288.A O no hydrogen 2.903 N/A VAL 23.A N CYS 286.A O no hydrogen 2.881 N/A LEU 25.A N LEU 284.A O no hydrogen 2.904 N/A HIS 27.A N GLY 282.A O no hydrogen 3.453 N/A HIS 27.A NE2 THR 48.A OG1 no hydrogen 2.514 N/A GLY 29.A N GLU 26.A O no hydrogen 2.983 N/A CYS 30.A N ASN 8.A O no hydrogen 3.298 N/A CYS 30.A SG ILE 43.A O no hydrogen 3.958 N/A VAL 31.A N ILE 43.A O no hydrogen 2.964 N/A THR 32.A N ASP 10.A O no hydrogen 3.085 N/A THR 32.A OG1 ASP 42.A OD1 no hydrogen 2.498 N/A VAL 33.A N VAL 41.A O no hydrogen 2.851 N/A MET 34.A N VAL 12.A O no hydrogen 3.278 N/A LYS 38.A N ALA 35.A O no hydrogen 3.053 N/A LYS 38.A NZ MET 290.A O no hydrogen 2.471 N/A LYS 38.A NZ LEU 293.A O no hydrogen 2.439 N/A THR 40.A OG1 ILE 354.A O no hydrogen 2.562 N/A VAL 41.A N VAL 33.A O no hydrogen 2.938 N/A ASP 42.A N SER 142.A O no hydrogen 2.816 N/A ILE 43.A N VAL 31.A O no hydrogen 2.849 N/A GLU 44.A N MET 140.A O no hydrogen 2.976 N/A VAL 46.A N ARG 138.A O no hydrogen 2.966 N/A THR 48.A OG1 HIS 27.A NE2 no hydrogen 2.514 N/A THR 49.A N GLU 136.A O no hydrogen 2.984 N/A VAL 50.A N GLY 277.A O no hydrogen 2.867 N/A SER 51.A OG ASN 134.A O no hydrogen 3.411 N/A VAL 56.A N GLY 127.A O no hydrogen 2.679 N/A ARG 57.A N GLY 127.A O no hydrogen 3.015 N/A ARG 57.A NH1 TYR 59.A OH no hydrogen 2.774 N/A SER 58.A N HIS 221.A O no hydrogen 2.960 N/A SER 58.A OG THR 126.A OG1 no hydrogen 3.263 N/A TYR 59.A N MET 125.A O no hydrogen 2.873 N/A TYR 59.A OH PHE 213.A O no hydrogen 2.790 N/A CYS 60.A N PRO 219.A O no hydrogen 2.855 N/A CYS 60.A SG GLU 62.A O no hydrogen 3.409 N/A CYS 60.A SG LYS 123.A O no hydrogen 3.946 N/A TYR 61.A N LYS 123.A O no hydrogen 3.068 N/A GLU 62.A N LYS 123.A O no hydrogen 2.996 N/A SER 64.A N ALA 120.A O no hydrogen 2.913 N/A SER 66.A N LYS 118.A O no hydrogen 3.155 N/A ALA 69.A N CYS 116.A O no hydrogen 2.921 N/A ASP 71.A N VAL 114.A O no hydrogen 2.915 N/A ARG 73.A N SER 112.A O no hydrogen 2.955 N/A ARG 73.A NE ASP 71.A OD2 no hydrogen 3.161 N/A ARG 73.A NH2 ASP 71.A OD1 no hydrogen 3.534 N/A ARG 73.A NH2 ASP 71.A OD2 no hydrogen 3.470 N/A CYS 74.A SG GLY 104.A O no hydrogen 3.948 N/A THR 76.A OG1 PRO 75.A O no hydrogen 2.444 N/A GLN 77.A N CYS 74.A O no hydrogen 3.102 N/A ALA 80.A N SER 112.A OG no hydrogen 2.873 N/A TYR 81.A N ASP 71.A OD2 no hydrogen 2.886 N/A LEU 82.A N GLN 85.A OE1 no hydrogen 2.772 N/A GLN 85.A N LEU 82.A O no hydrogen 2.984 N/A SER 86.A N ASP 83.A O no hydrogen 2.932 N/A SER 86.A OG ASP 83.A O no hydrogen 2.861 N/A ASP 87.A N LYS 84.A O no hydrogen 3.045 N/A GLN 89.A N ASP 87.A OD1 no hydrogen 2.879 N/A TYR 90.A N ASP 87.A O no hydrogen 3.038 N/A TYR 90.A OH ASP 67.A OD2 no hydrogen 2.496 N/A VAL 91.A N ALA 117.A O no hydrogen 2.889 N/A LYS 93.A N THR 115.A O no hydrogen 2.948 N/A THR 95.A N LEU 113.A O no hydrogen 2.859 N/A LEU 96.A N THR 95.A OG1 no hydrogen 2.753 N/A VAL 97.A N GLY 111.A O no hydrogen 2.913 N/A ASP 98.A N ALA 245.A O no hydrogen 2.973 N/A ARG 99.A N GLY 109.A O no hydrogen 2.879 N/A ARG 99.A NE ASN 103.A OD1 no hydrogen 3.147 N/A ARG 99.A NH2 ASN 103.A O no hydrogen 3.160 N/A GLY 100.A N ASN 103.A OD1 no hydrogen 2.768 N/A TRP 101.A NE1 GLY 106.A O no hydrogen 2.948 N/A ASN 103.A N GLY 100.A O no hydrogen 3.130 N/A ASN 103.A ND2 ASP 98.A O no hydrogen 3.323 N/A GLY 104.A N TRP 101.A O no hydrogen 3.370 N/A CYS 105.A N GLY 100.A O no hydrogen 2.957 N/A GLY 109.A N ARG 99.A O no hydrogen 2.946 N/A LYS 110.A NZ ASP 98.A OD1 no hydrogen 2.741 N/A GLY 111.A N VAL 97.A O no hydrogen 2.873 N/A LEU 113.A N THR 95.A O no hydrogen 2.889 N/A VAL 114.A N ASP 71.A O no hydrogen 2.897 N/A THR 115.A N LYS 93.A O no hydrogen 2.942 N/A THR 115.A OG1 LYS 93.A O no hydrogen 3.542 N/A THR 115.A OG1 GLN 248.A OE1 no hydrogen 2.516 N/A CYS 116.A N ALA 69.A O no hydrogen 2.915 N/A ALA 117.A N VAL 91.A O no hydrogen 2.933 N/A LYS 118.A N SER 66.A O no hydrogen 2.795 N/A PHE 119.A N GLN 89.A O no hydrogen 2.752 N/A ALA 120.A N SER 64.A O no hydrogen 3.214 N/A CYS 121.A SG GLU 62.A O no hydrogen 3.585 N/A CYS 121.A SG LYS 123.A O no hydrogen 3.454 N/A SER 122.A N GLU 62.A O no hydrogen 2.647 N/A LYS 123.A N GLU 62.A O no hydrogen 2.944 N/A LYS 124.A NZ HIS 221.A NE2 no hydrogen 3.042 N/A MET 125.A N TYR 59.A O no hydrogen 2.842 N/A THR 126.A N THR 200.A O no hydrogen 2.871 N/A THR 126.A OG1 SER 58.A OG no hydrogen 3.263 N/A GLY 127.A N ARG 57.A O no hydrogen 2.808 N/A LYS 128.A N TYR 198.A O no hydrogen 2.879 N/A SER 129.A N ALA 54.A O no hydrogen 2.578 N/A SER 129.A OG ALA 54.A O no hydrogen 3.192 N/A GLU 133.A N GLU 133.A OE2 no hydrogen 2.614 N/A ASN 134.A N GLN 131.A O no hydrogen 2.898 N/A ASN 134.A ND2 SER 51.A O no hydrogen 3.422 N/A GLU 136.A N THR 49.A O no hydrogen 2.789 N/A TYR 137.A N ILE 164.A O no hydrogen 2.884 N/A ARG 138.A N THR 47.A O no hydrogen 3.123 N/A ARG 138.A NE GLU 163.A OE1 no hydrogen 3.558 N/A ILE 139.A N VAL 162.A O no hydrogen 2.828 N/A MET 140.A N GLU 44.A O no hydrogen 2.843 N/A LEU 141.A N ALA 160.A O no hydrogen 2.866 N/A SER 142.A N ASP 42.A O no hydrogen 2.885 N/A VAL 143.A N ASN 158.A O no hydrogen 2.842 N/A HIS 144.A N THR 40.A O no hydrogen 2.662 N/A SER 146.A OG GLY 145.A O no hydrogen 2.670 N/A SER 146.A OG VAL 359.A O no hydrogen 2.262 N/A GLN 147.A N GLN 147.A OE1 no hydrogen 2.346 N/A GLN 147.A NE2 VAL 143.A O no hydrogen 2.493 N/A ASN 158.A N ASP 156.A OD1 no hydrogen 2.649 N/A ALA 160.A N LEU 141.A O no hydrogen 2.912 N/A VAL 162.A N ILE 139.A O no hydrogen 2.910 N/A ILE 164.A N TYR 137.A O no hydrogen 2.924 N/A THR 165.A N SER 168.A O no hydrogen 3.222 N/A THR 165.A OG1 ASN 167.A OD1 no hydrogen 2.944 N/A THR 165.A OG1 SER 168.A OG no hydrogen 2.988 N/A SER 168.A N THR 165.A O no hydrogen 2.999 N/A SER 168.A N THR 165.A OG1 no hydrogen 3.144 N/A SER 168.A OG THR 165.A OG1 no hydrogen 2.988 N/A SER 168.A OG SER 168.A O no hydrogen 2.372 N/A ALA 171.A N LEU 183.A O no hydrogen 2.944 N/A ALA 173.A N LEU 181.A O no hydrogen 2.916 N/A LEU 175.A N GLY 179.A O no hydrogen 2.896 N/A GLY 177.A N GLU 157.A OE2 no hydrogen 2.407 N/A PHE 178.A N LEU 175.A O no hydrogen 3.227 N/A GLY 179.A N GLY 176.A O no hydrogen 2.971 N/A SER 180.A N LYS 292.A O no hydrogen 3.213 N/A LEU 181.A N ALA 173.A O no hydrogen 2.944 N/A GLY 182.A N LYS 289.A O no hydrogen 2.967 N/A LEU 183.A N ALA 171.A O no hydrogen 2.880 N/A ASP 184.A N ARG 287.A O no hydrogen 2.901 N/A CYS 185.A N PRO 169.A O no hydrogen 3.181 N/A GLU 186.A N LYS 285.A O no hydrogen 2.881 N/A THR 189.A N GLU 186.A O no hydrogen 3.186 N/A THR 189.A OG1 GLU 186.A O no hydrogen 2.142 N/A SER 194.A OG ASP 195.A OD1 no hydrogen 2.946 N/A LEU 196.A N PHE 193.A O no hydrogen 3.371 N/A TYR 197.A N VAL 208.A O no hydrogen 2.853 N/A TYR 198.A N LYS 128.A O no hydrogen 2.881 N/A LEU 199.A N TRP 206.A O no hydrogen 2.865 N/A THR 200.A N THR 126.A O no hydrogen 2.856 N/A THR 200.A OG1 HIS 205.A ND1 no hydrogen 2.870 N/A MET 201.A N LYS 204.A O no hydrogen 2.900 N/A LYS 204.A N MET 201.A O no hydrogen 2.887 N/A HIS 205.A ND1 THR 200.A OG1 no hydrogen 2.870 N/A TRP 206.A N LEU 199.A O no hydrogen 2.897 N/A LEU 207.A N LEU 268.A O no hydrogen 2.908 N/A VAL 208.A N TYR 197.A O no hydrogen 2.938 N/A LYS 210.A N ASP 195.A O no hydrogen 2.726 N/A LYS 210.A NZ ASP 195.A OD1 no hydrogen 3.214 N/A PHE 213.A N HIS 209.A O no hydrogen 3.134 N/A HIS 214.A N LYS 210.A O no hydrogen 2.942 N/A HIS 214.A ND1 LYS 210.A O no hydrogen 2.703 N/A ASP 215.A N GLU 211.A O no hydrogen 3.122 N/A ASP 215.A N TRP 212.A O no hydrogen 3.208 N/A LEU 218.A N ILE 216.A O no hydrogen 3.064 N/A TRP 220.A N ASN 232.A O no hydrogen 3.113 N/A HIS 221.A N SER 58.A O no hydrogen 2.866 N/A HIS 221.A ND1 ALA 222.A O no hydrogen 3.056 N/A ASP 225.A N ALA 222.A O no hydrogen 2.889 N/A HIS 230.A N ASP 225.A OD2 no hydrogen 2.855 N/A ASN 232.A N TRP 220.A O no hydrogen 2.948 N/A LYS 234.A NZ THR 88.A O no hydrogen 3.086 N/A LYS 234.A NZ TRP 231.A O no hydrogen 2.694 N/A ALA 236.A N ASN 233.A O no hydrogen 3.123 N/A LEU 237.A N LYS 234.A O no hydrogen 3.025 N/A GLU 239.A N VAL 251.A O no hydrogen 2.947 N/A LYS 241.A N THR 249.A O no hydrogen 2.916 N/A ALA 243.A N ARG 247.A O no hydrogen 2.814 N/A LYS 246.A N ALA 243.A O no hydrogen 2.902 N/A ARG 247.A N ALA 243.A O no hydrogen 3.067 N/A GLN 248.A NE2 ASP 242.A OD1 no hydrogen 3.565 N/A THR 249.A N LYS 241.A O no hydrogen 2.887 N/A VAL 251.A N GLU 239.A O no hydrogen 2.902 N/A LEU 253.A N LEU 237.A O no hydrogen 2.889 N/A SER 255.A OG GLU 62.A OE1 no hydrogen 2.568 N/A GLN 256.A N TYR 61.A O no hydrogen 3.079 N/A GLN 256.A NE2 GLY 254.A O no hydrogen 2.744 N/A VAL 260.A N GLN 256.A O no hydrogen 3.011 N/A HIS 261.A N GLU 257.A O no hydrogen 2.966 N/A THR 262.A N GLY 258.A O no hydrogen 2.866 N/A THR 262.A OG1 GLY 258.A O no hydrogen 3.133 N/A ALA 263.A N ALA 259.A O no hydrogen 2.873 N/A LEU 264.A N VAL 260.A O no hydrogen 2.756 N/A LEU 264.A N HIS 261.A O no hydrogen 3.269 N/A ALA 265.A N THR 262.A O no hydrogen 3.198 N/A ALA 270.A N HIS 205.A O no hydrogen 2.917 N/A GLU 271.A N ARG 278.A O no hydrogen 2.940 N/A ASP 273.A N LYS 276.A O no hydrogen 2.880 N/A LYS 276.A N ASP 273.A O no hydrogen 2.950 N/A GLY 277.A N VAL 50.A O no hydrogen 2.886 N/A ARG 278.A N GLU 271.A O no hydrogen 2.853 N/A LEU 279.A N THR 48.A O no hydrogen 2.878 N/A LEU 284.A N LEU 25.A O no hydrogen 2.885 N/A CYS 286.A N VAL 23.A O no hydrogen 2.912 N/A ARG 287.A N ASP 184.A O no hydrogen 2.869 N/A ARG 287.A NE ASP 22.A OD1 no hydrogen 3.358 N/A LEU 288.A N VAL 21.A O no hydrogen 2.923 N/A LYS 289.A N GLY 182.A O no hydrogen 2.877 N/A MET 290.A N THR 19.A O no hydrogen 2.907 N/A LYS 292.A NZ SER 180.A OG no hydrogen 3.195 N/A LEU 293.A N MET 290.A O no hydrogen 2.937 N/A ARG 294.A N PHE 178.A O no hydrogen 2.622 N/A LYS 296.A NZ GLU 157.A OE1 no hydrogen 3.395 N/A TYR 300.A N GLY 297.A O no hydrogen 3.227 N/A CYS 303.A N LYS 335.A O no hydrogen 2.843 N/A CYS 303.A SG LYS 335.A O no hydrogen 3.038 N/A THR 304.A N ASP 331.A OD2 no hydrogen 3.266 N/A THR 304.A OG1 ASP 331.A OD2 no hydrogen 3.424 N/A ALA 305.A N TYR 327.A OH no hydrogen 2.964 N/A THR 308.A N GLN 326.A O no hydrogen 2.917 N/A THR 310.A N GLU 324.A O no hydrogen 3.323 N/A THR 310.A OG1 GLU 324.A O no hydrogen 3.519 N/A THR 310.A OG1 GLU 324.A OE1 no hydrogen 3.024 N/A LYS 311.A NZ GLU 324.A OE2 no hydrogen 2.893 N/A ALA 314.A N THR 322.A O no hydrogen 3.294 N/A THR 316.A N THR 320.A O no hydrogen 2.869 N/A THR 316.A OG1 THR 320.A O no hydrogen 3.467 N/A HIS 318.A NE2 VAL 6.A O no hydrogen 3.356 N/A GLY 319.A N THR 316.A O no hydrogen 3.034 N/A VAL 321.A N LEU 373.A O no hydrogen 2.936 N/A THR 322.A N ALA 314.A O no hydrogen 3.018 N/A THR 322.A OG1 ALA 314.A O no hydrogen 3.496 N/A VAL 323.A N LEU 371.A O no hydrogen 2.932 N/A VAL 325.A N MET 369.A O no hydrogen 2.940 N/A GLN 326.A N THR 308.A O no hydrogen 2.811 N/A TYR 327.A N SER 367.A O no hydrogen 2.859 N/A TYR 327.A OH ASP 331.A OD1 no hydrogen 2.555 N/A TYR 327.A OH ASP 331.A OD2 no hydrogen 3.208 N/A ASP 331.A N ASP 331.A OD1 no hydrogen 2.532 N/A CYS 334.A N ILE 360.A O no hydrogen 2.830 N/A LYS 335.A N SER 301.A O no hydrogen 2.976 N/A LYS 335.A NZ GLY 297.A O no hydrogen 3.475 N/A LYS 335.A NZ VAL 298.A O no hydrogen 3.040 N/A LYS 335.A NZ TYR 300.A O no hydrogen 2.190 N/A VAL 336.A N PRO 358.A O no hydrogen 3.112 N/A GLN 339.A N VAL 383.A O no hydrogen 2.944 N/A ALA 341.A N TYR 381.A O no hydrogen 2.962 N/A THR 346.A N ASP 343.A OD2 no hydrogen 2.767 N/A THR 346.A OG1 THR 348.A OG1 no hydrogen 2.475 N/A LEU 347.A N ASP 343.A O no hydrogen 3.063 N/A THR 348.A OG1 THR 346.A OG1 no hydrogen 2.475 N/A VAL 350.A N MET 340.A O no hydrogen 3.109 N/A ARG 352.A N ASP 374.A O no hydrogen 3.212 N/A ARG 352.A NE ASP 374.A OD2 no hydrogen 3.462 N/A ARG 352.A NH1 GLU 13.A OE1 no hydrogen 2.632 N/A ILE 354.A N GLU 372.A O no hydrogen 3.002 N/A THR 355.A N GLU 372.A O no hydrogen 3.300 N/A ALA 356.A N THR 40.A OG1 no hydrogen 3.382 N/A ASN 357.A ND2 GLY 297.A O no hydrogen 3.649 N/A ILE 360.A N CYS 334.A O no hydrogen 2.938 N/A THR 361.A OG1 GLU 362.A OE2 no hydrogen 3.073 N/A SER 363.A OG THR 330.A O no hydrogen 3.325 N/A THR 364.A OG1 GLU 365.A O no hydrogen 3.526 N/A ASN 366.A ND2 GLN 326.A OE1 no hydrogen 2.679 N/A SER 367.A N TYR 327.A O no hydrogen 2.959 N/A LYS 368.A NZ GLU 324.A OE1 no hydrogen 2.540 N/A MET 369.A N VAL 325.A O no hydrogen 2.906 N/A MET 370.A N SER 146.A O no hydrogen 3.356 N/A LEU 371.A N VAL 323.A O no hydrogen 2.918 N/A LEU 373.A N VAL 321.A O no hydrogen 2.901 N/A ASP 374.A N ARG 352.A O no hydrogen 2.876 N/A GLY 378.A N ARG 397.A O no hydrogen 2.930 N/A SER 380.A N TRP 395.A O no hydrogen 2.930 N/A SER 380.A OG ASP 379.A O no hydrogen 2.637 N/A TYR 381.A N ALA 341.A O no hydrogen 2.867 N/A ILE 382.A N HIS 393.A O no hydrogen 2.901 N/A VAL 383.A N GLN 339.A O no hydrogen 2.937 N/A ILE 384.A N ILE 391.A O no hydrogen 2.936 N/A GLY 385.A N PRO 337.A O no hydrogen 2.856 N/A ILE 391.A N ILE 384.A O no hydrogen 2.887 N/A HIS 393.A N ILE 382.A O no hydrogen 2.942 N/A HIS 394.A NE2 ASP 379.A OD2 no hydrogen 3.186 N/A TRP 395.A N SER 380.A O no hydrogen 2.872 N/A ARG 397.A N GLY 378.A O no hydrogen 2.912 N/A ARG 397.A NH1 GLY 319.A O no hydrogen 3.102 N/A ARG 397.A NH1 ASP 374.A OD1 no hydrogen 3.377 N/A