Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ixd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N LEU 65.A O no hydrogen 2.129 N/A GLU 2.A N LEU 65.A O no hydrogen 2.995 N/A VAL 3.A N LEU 13.A O no hydrogen 3.471 N/A ILE 4.A N LEU 67.A O no hydrogen 2.745 N/A TYR 6.A OH HIS 68.A ND1 no hydrogen 2.943 N/A LEU 15.A N VAL 1.A O no hydrogen 3.135 N/A TYR 20.A N ILE 60.A O no hydrogen 2.812 N/A TYR 20.A OH GLY 16.A O no hydrogen 2.651 N/A ALA 22.A N ARG 58.A O no hydrogen 3.237 N/A GLU 23.A N PRO 56.A O no hydrogen 3.198 N/A LEU 25.A N THR 21.A O no hydrogen 3.341 N/A CYS 26.A N ALA 22.A O no hydrogen 2.824 N/A CYS 26.A SG ALA 22.A O no hydrogen 3.430 N/A ILE 27.A N GLU 23.A O no hydrogen 2.761 N/A ARG 28.A N GLU 24.A O no hydrogen 2.852 N/A ALA 29.A N LEU 25.A O no hydrogen 2.790 N/A ALA 30.A N CYS 26.A O no hydrogen 2.802 N/A GLN 31.A N ILE 27.A O no hydrogen 2.786 N/A ALA 32.A N ARG 28.A O no hydrogen 2.802 N/A CYS 33.A N ALA 29.A O no hydrogen 2.981 N/A CYS 33.A SG ALA 29.A O no hydrogen 3.305 N/A ARG 34.A N GLN 31.A O no hydrogen 3.330 N/A ILE 35.A N ALA 30.A O no hydrogen 2.819 N/A CYS 39.A N SER 36.A O no hydrogen 3.164 N/A CYS 39.A SG SER 36.A OG no hydrogen 3.333 N/A CYS 39.A SG ASP 98.A OD1 no hydrogen 3.410 N/A HIS 40.A N SER 36.A O no hydrogen 3.172 N/A LEU 42.A N CYS 39.A O no hydrogen 2.827 N/A PHE 43.A N HIS 40.A O no hydrogen 3.167 N/A ALA 44.A N ARG 70.A O no hydrogen 2.844 N/A TYR 46.A N HIS 68.A O no hydrogen 2.817 N/A ASP 47.A N LEU 52.A O no hydrogen 3.110 N/A THR 50.A N ASN 49.A OD1 no hydrogen 2.502 N/A TRP 53.A N SER 313.A OG no hydrogen 3.345 N/A TYR 54.A N LEU 45.A O no hydrogen 3.118 N/A TYR 54.A OH ASP 47.A OD2 no hydrogen 2.750 N/A ASN 57.A ND2 ASP 335.A O no hydrogen 2.739 N/A ARG 58.A N ALA 55.A O no hydrogen 3.006 N/A ILE 60.A N TYR 20.A O no hydrogen 2.784 N/A VAL 62.A N GLY 18.A O no hydrogen 3.483 N/A LEU 67.A N GLU 2.A O no hydrogen 2.879 N/A HIS 68.A N TYR 46.A O no hydrogen 2.822 N/A TYR 69.A N ILE 4.A O no hydrogen 2.939 N/A ARG 70.A N ALA 44.A O no hydrogen 2.883 N/A ARG 70.A NE TYR 6.A OH no hydrogen 2.884 N/A ARG 70.A NH1 ASP 112.A OD2 no hydrogen 3.368 N/A ARG 70.A NH2 TYR 6.A OH no hydrogen 2.639 N/A ARG 70.A NH2 ASP 112.A OD1 no hydrogen 2.535 N/A MET 71.A N GLN 108.A OE1 no hydrogen 2.678 N/A ARG 72.A N LEU 42.A O no hydrogen 2.956 N/A ARG 72.A NE GLU 229.A OE1 no hydrogen 2.730 N/A ARG 72.A NH1 SER 316.A OG no hydrogen 3.065 N/A ARG 72.A NH2 GLU 229.A OE1 no hydrogen 3.509 N/A ARG 72.A NH2 SER 313.A O no hydrogen 2.749 N/A PHE 73.A N LEU 42.A O no hydrogen 3.337 N/A TYR 74.A N TYR 321.A OH no hydrogen 3.007 N/A TYR 74.A OH GLU 220.A OE1 no hydrogen 2.464 N/A ASN 77.A N GLU 220.A OE1 no hydrogen 3.047 N/A ASN 77.A N GLU 220.A OE2 no hydrogen 3.349 N/A ASN 77.A ND2 ASN 82.A O no hydrogen 3.435 N/A ASN 77.A ND2 GLN 86.A O no hydrogen 2.885 N/A TRP 78.A N PHE 75.A O no hydrogen 3.292 N/A TRP 78.A NE1 TYR 74.A OH no hydrogen 2.924 N/A HIS 79.A NE2 GLU 220.A OE2 no hydrogen 3.176 N/A GLY 80.A N ASN 77.A O no hydrogen 3.067 N/A THR 81.A N HIS 79.A ND1 no hydrogen 3.212 N/A THR 81.A OG1 HIS 79.A ND1 no hydrogen 2.641 N/A ASN 84.A N ASN 82.A OD1 no hydrogen 3.095 N/A ARG 90.A N THR 94.A O no hydrogen 2.672 N/A HIS 91.A ND1 SER 414.A O no hydrogen 3.289 N/A ASP 98.A N ASP 98.A OD1 no hydrogen 2.533 N/A SER 100.A OG ARG 34.A O no hydrogen 2.804 N/A LEU 102.A N ASP 98.A O no hydrogen 3.189 N/A GLU 103.A N ALA 99.A O no hydrogen 2.861 N/A TYR 104.A N SER 100.A O no hydrogen 3.434 N/A TYR 104.A OH TYR 69.A O no hydrogen 2.316 N/A LEU 105.A N SER 101.A O no hydrogen 2.848 N/A PHE 106.A N LEU 102.A O no hydrogen 2.793 N/A ALA 107.A N GLU 103.A O no hydrogen 2.900 N/A GLN 108.A N TYR 104.A O no hydrogen 2.810 N/A GLN 108.A NE2 MET 71.A O no hydrogen 3.504 N/A GLY 109.A N LEU 105.A O no hydrogen 2.783 N/A GLN 110.A N PHE 106.A O no hydrogen 2.915 N/A TYR 111.A N ALA 107.A O no hydrogen 2.891 N/A ASP 112.A N GLN 108.A O no hydrogen 2.830 N/A LEU 113.A N GLY 109.A O no hydrogen 2.859 N/A VAL 114.A N GLN 110.A O no hydrogen 2.903 N/A LYS 115.A N TYR 111.A O no hydrogen 2.826 N/A CYS 116.A N LEU 113.A O no hydrogen 3.368 N/A CYS 116.A SG VAL 114.A O no hydrogen 3.650 N/A ALA 118.A N ASP 112.A O no hydrogen 3.094 N/A ARG 121.A N LEU 222.A O no hydrogen 3.008 N/A ARG 121.A NH1 ASP 128.A OD1 no hydrogen 2.942 N/A ARG 121.A NH2 ASP 128.A OD1 no hydrogen 3.430 N/A ARG 121.A NH2 ASP 128.A OD2 no hydrogen 2.750 N/A LYS 124.A N ASP 128.A OD2 no hydrogen 3.020 N/A GLY 129.A N THR 125.A O no hydrogen 2.893 N/A HIS 130.A N GLU 126.A O no hydrogen 2.911 N/A ASP 131.A N GLN 127.A O no hydrogen 2.786 N/A ILE 132.A N ASP 128.A O no hydrogen 2.787 N/A GLU 133.A N GLY 129.A O no hydrogen 2.903 N/A ASN 134.A N HIS 130.A O no hydrogen 2.836 N/A GLU 135.A N ASP 131.A O no hydrogen 2.838 N/A CYS 136.A N ILE 132.A O no hydrogen 2.802 N/A CYS 136.A SG ILE 132.A O no hydrogen 3.475 N/A LEU 137.A N GLU 133.A O no hydrogen 2.939 N/A GLY 138.A N ASN 134.A O no hydrogen 2.863 N/A MET 139.A N GLU 135.A O no hydrogen 2.781 N/A ALA 140.A N CYS 136.A O no hydrogen 2.869 N/A VAL 141.A N LEU 137.A O no hydrogen 2.859 N/A LEU 142.A N GLY 138.A O no hydrogen 2.829 N/A ALA 143.A N MET 139.A O no hydrogen 2.841 N/A ILE 144.A N ALA 140.A O no hydrogen 2.898 N/A SER 145.A N VAL 141.A O no hydrogen 2.805 N/A SER 145.A OG VAL 141.A O no hydrogen 2.501 N/A HIS 146.A N LEU 142.A O no hydrogen 2.854 N/A TYR 147.A N ALA 143.A O no hydrogen 2.903 N/A ALA 148.A N ILE 144.A O no hydrogen 2.800 N/A MET 149.A N SER 145.A O no hydrogen 2.847 N/A MET 150.A N HIS 146.A O no hydrogen 2.856 N/A LYS 151.A N TYR 147.A O no hydrogen 3.089 N/A LYS 152.A N MET 149.A O no hydrogen 3.337 N/A MET 153.A N ALA 148.A O no hydrogen 3.287 N/A GLU 157.A N GLN 154.A O no hydrogen 3.081 N/A LEU 158.A N GLN 154.A O no hydrogen 3.224 N/A TYR 165.A N TYR 162.A O no hydrogen 3.312 N/A GLU 168.A N VAL 114.A O no hydrogen 3.040 N/A ASN 171.A N PRO 167.A O no hydrogen 3.108 N/A LYS 172.A N GLU 168.A O no hydrogen 2.867 N/A SER 173.A N THR 169.A O no hydrogen 2.827 N/A ILE 174.A N LEU 170.A O no hydrogen 2.756 N/A ARG 175.A N ASN 171.A O no hydrogen 2.837 N/A GLN 176.A N SER 173.A O no hydrogen 3.353 N/A ARG 177.A N ILE 174.A O no hydrogen 2.823 N/A ARG 177.A NH1 GLU 133.A OE1 no hydrogen 3.541 N/A ARG 177.A NH1 GLU 133.A OE2 no hydrogen 3.064 N/A ARG 177.A NH2 GLU 133.A OE1 no hydrogen 2.784 N/A ARG 177.A NH2 SER 173.A OG no hydrogen 2.852 N/A THR 181.A N ASN 178.A OD1 no hydrogen 2.837 N/A THR 181.A OG1 ASN 178.A OD1 no hydrogen 2.683 N/A ARG 182.A N ASN 178.A O no hydrogen 3.197 N/A ARG 182.A NH1 ARG 177.A O no hydrogen 2.929 N/A MET 183.A N LEU 179.A O no hydrogen 2.864 N/A ARG 184.A N LEU 180.A O no hydrogen 2.794 N/A ILE 185.A N THR 181.A O no hydrogen 2.863 N/A ASN 186.A N ARG 182.A O no hydrogen 2.905 N/A ASN 187.A N MET 183.A O no hydrogen 2.845 N/A VAL 188.A N ARG 184.A O no hydrogen 2.864 N/A PHE 189.A N ILE 185.A O no hydrogen 2.845 N/A LYS 190.A N ASN 186.A O no hydrogen 2.884 N/A ASP 191.A N ASN 187.A O no hydrogen 2.798 N/A PHE 192.A N VAL 188.A O no hydrogen 2.877 N/A LEU 193.A N PHE 189.A O no hydrogen 2.838 N/A LYS 194.A N LYS 190.A O no hydrogen 2.856 N/A GLU 195.A N ASP 191.A O no hydrogen 2.864 N/A PHE 196.A N PHE 192.A O no hydrogen 2.878 N/A ASN 197.A N LEU 193.A O no hydrogen 2.830 N/A ASN 198.A N LYS 194.A O no hydrogen 2.732 N/A LYS 199.A N GLU 195.A O no hydrogen 2.913 N/A ILE 201.A N PHE 196.A O no hydrogen 2.874 N/A CYS 202.A N LYS 199.A O no hydrogen 3.152 N/A ASP 203.A N LYS 199.A O no hydrogen 2.743 N/A SER 204.A N THR 200.A O no hydrogen 3.253 N/A VAL 206.A N ILE 201.A O no hydrogen 2.963 N/A LEU 211.A N SER 207.A O no hydrogen 3.443 N/A LYS 212.A N THR 208.A O no hydrogen 2.879 N/A VAL 213.A N HIS 209.A O no hydrogen 2.889 N/A LYS 214.A N ASP 210.A O no hydrogen 2.842 N/A TYR 215.A N LEU 211.A O no hydrogen 2.828 N/A LEU 216.A N LYS 212.A O no hydrogen 2.894 N/A ALA 217.A N VAL 213.A O no hydrogen 2.854 N/A THR 218.A N LYS 214.A O no hydrogen 2.850 N/A THR 218.A OG1 LYS 214.A O no hydrogen 2.537 N/A LEU 219.A N TYR 215.A O no hydrogen 2.819 N/A GLU 220.A N LEU 216.A O no hydrogen 2.830 N/A THR 221.A N ALA 217.A O no hydrogen 2.925 N/A THR 221.A OG1 ALA 217.A O no hydrogen 3.382 N/A THR 221.A OG1 THR 218.A O no hydrogen 2.867 N/A LEU 222.A N THR 218.A O no hydrogen 2.632 N/A LEU 222.A N LEU 219.A O no hydrogen 3.313 N/A THR 223.A N LEU 219.A O no hydrogen 3.134 N/A THR 223.A OG1 LEU 219.A O no hydrogen 2.463 N/A LYS 224.A N PRO 119.A O no hydrogen 2.882 N/A LYS 224.A NZ ASP 122.A OD1 no hydrogen 2.993 N/A LYS 224.A NZ ASP 122.A OD2 no hydrogen 2.837 N/A GLU 229.A N VAL 256.A O no hydrogen 3.339 N/A PHE 231.A N VAL 254.A O no hydrogen 2.825 N/A THR 233.A N TYR 252.A O no hydrogen 2.717 N/A THR 233.A OG1 MET 235.A O no hydrogen 3.200 N/A THR 233.A OG1 LYS 304.A O no hydrogen 2.996 N/A MET 235.A N THR 233.A OG1 no hydrogen 3.211 N/A LEU 236.A N PHE 247.A O no hydrogen 2.857 N/A LEU 237.A N GLU 302.A O no hydrogen 2.714 N/A ILE 238.A N ASN 245.A O no hydrogen 2.899 N/A SER 239.A N LYS 300.A O no hydrogen 2.903 N/A SER 240.A N GLU 243.A O no hydrogen 2.883 N/A SER 240.A OG ASN 242.A OD1 no hydrogen 3.206 N/A GLU 243.A N SER 240.A O no hydrogen 3.349 N/A ASN 245.A N ILE 238.A O no hydrogen 2.842 N/A PHE 247.A N LEU 236.A O no hydrogen 2.759 N/A SER 249.A OG HIS 248.A O no hydrogen 2.249 N/A TYR 251.A N THR 233.A O no hydrogen 3.246 N/A TYR 252.A N THR 233.A O no hydrogen 2.857 N/A GLU 253.A N ARG 265.A O no hydrogen 2.825 N/A VAL 254.A N PHE 231.A O no hydrogen 2.841 N/A MET 255.A N GLN 263.A O no hydrogen 2.748 N/A VAL 256.A N GLU 229.A O no hydrogen 2.865 N/A THR 257.A N GLY 261.A O no hydrogen 2.836 N/A LEU 260.A N THR 257.A OG1 no hydrogen 3.104 N/A GLY 261.A N THR 257.A O no hydrogen 2.729 N/A ILE 262.A N SER 276.A O no hydrogen 2.838 N/A GLN 263.A N MET 255.A O no hydrogen 2.840 N/A TRP 264.A N ASN 273.A O no hydrogen 2.936 N/A ARG 265.A N GLU 253.A O no hydrogen 2.777 N/A ARG 265.A NE GLU 253.A OE1 no hydrogen 3.143 N/A ARG 265.A NH1 GLU 270.A O no hydrogen 3.430 N/A ARG 265.A NH2 GLU 253.A OE1 no hydrogen 3.158 N/A HIS 266.A ND1 TYR 251.A O no hydrogen 2.937 N/A LYS 267.A N TYR 251.A O no hydrogen 2.656 N/A ASN 273.A N TRP 264.A O no hydrogen 2.763 N/A ASN 273.A ND2 TRP 264.A O no hydrogen 3.583 N/A PHE 275.A N ILE 262.A O no hydrogen 3.075 N/A SER 276.A N ILE 262.A O no hydrogen 3.374 N/A SER 276.A OG PHE 277.A O no hydrogen 2.573 N/A ILE 281.A N PHE 278.A O no hydrogen 3.022 N/A THR 282.A N ASN 294.A O no hydrogen 2.921 N/A THR 282.A OG1 HIS 283.A ND1 no hydrogen 2.799 N/A THR 282.A OG1 ASN 294.A O no hydrogen 3.253 N/A HIS 283.A ND1 THR 282.A OG1 no hydrogen 2.799 N/A ILE 284.A N LEU 332.A O no hydrogen 3.035 N/A VAL 285.A N SER 292.A O no hydrogen 2.811 N/A LYS 287.A N VAL 290.A O no hydrogen 2.866 N/A VAL 290.A N LYS 287.A O no hydrogen 2.910 N/A VAL 291.A N LEU 303.A O no hydrogen 2.820 N/A SER 292.A N VAL 285.A O no hydrogen 2.782 N/A SER 292.A OG GLU 302.A OE2 no hydrogen 2.523 N/A ILE 293.A N MET 301.A O no hydrogen 2.719 N/A ASN 294.A N HIS 283.A O no hydrogen 2.927 N/A LYS 295.A N LYS 299.A O no hydrogen 2.835 N/A LYS 295.A NZ PHE 275.A O no hydrogen 2.787 N/A ASN 298.A N LYS 295.A O no hydrogen 3.258 N/A LYS 300.A N SER 239.A O no hydrogen 2.751 N/A MET 301.A N ILE 293.A O no hydrogen 2.881 N/A GLU 302.A N LEU 237.A O no hydrogen 2.769 N/A LEU 303.A N VAL 291.A O no hydrogen 2.850 N/A LYS 304.A N MET 235.A O no hydrogen 3.342 N/A LEU 305.A N SER 289.A O no hydrogen 3.017 N/A SER 306.A N GLU 310.A OE1 no hydrogen 2.945 N/A SER 306.A OG GLU 310.A OE1 no hydrogen 2.509 N/A HIS 308.A ND1 GLU 288.A O no hydrogen 2.925 N/A ALA 311.A N SER 307.A O no hydrogen 3.466 N/A LEU 312.A N HIS 308.A O no hydrogen 2.853 N/A SER 313.A N GLU 309.A O no hydrogen 2.862 N/A PHE 314.A N GLU 310.A O no hydrogen 2.840 N/A VAL 315.A N ALA 311.A O no hydrogen 2.873 N/A SER 316.A N LEU 312.A O no hydrogen 2.800 N/A SER 316.A OG LEU 312.A O no hydrogen 2.853 N/A SER 316.A OG SER 313.A O no hydrogen 2.485 N/A LEU 317.A N SER 313.A O no hydrogen 2.917 N/A VAL 318.A N PHE 314.A O no hydrogen 2.921 N/A ASP 319.A N VAL 315.A O no hydrogen 2.728 N/A GLY 320.A N SER 316.A O no hydrogen 2.894 N/A TYR 321.A N LEU 317.A O no hydrogen 2.902 N/A TYR 321.A OH TYR 74.A O no hydrogen 3.402 N/A PHE 322.A N VAL 318.A O no hydrogen 2.834 N/A ARG 323.A N ASP 319.A O no hydrogen 2.886 N/A ARG 323.A NE ASP 319.A O no hydrogen 3.442 N/A LEU 324.A N GLY 320.A O no hydrogen 2.820 N/A THR 325.A N TYR 321.A O no hydrogen 2.807 N/A ALA 326.A N PHE 322.A O no hydrogen 2.600 N/A HIS 329.A N ASP 327.A OD2 no hydrogen 2.868 N/A LEU 332.A N ASP 319.A OD1 no hydrogen 3.358 N/A LEU 332.A N ASP 319.A OD2 no hydrogen 3.001 N/A CYS 333.A SG ILE 284.A O no hydrogen 3.293 N/A THR 334.A OG1 ASP 335.A OD1 no hydrogen 3.277 N/A VAL 336.A N CYS 333.A O no hydrogen 3.158 N/A ALA 337.A N THR 334.A O no hydrogen 3.434 N/A LEU 340.A N GLU 23.A OE1 no hydrogen 3.374 N/A ILE 341.A N PRO 338.A O no hydrogen 2.911 N/A VAL 342.A N PRO 338.A O no hydrogen 3.329 N/A HIS 343.A N PRO 339.A O no hydrogen 2.861 N/A ASN 344.A N LEU 340.A O no hydrogen 2.604 N/A ILE 345.A N ILE 341.A O no hydrogen 2.876 N/A GLN 346.A N VAL 342.A O no hydrogen 2.802 N/A ASN 347.A N HIS 343.A O no hydrogen 3.108 N/A ASN 347.A ND2 HIS 343.A O no hydrogen 2.719 N/A GLY 348.A N ILE 345.A O no hydrogen 3.139 N/A CYS 349.A N ASN 344.A O no hydrogen 2.580 N/A CYS 349.A SG HIS 350.A O no hydrogen 3.298 N/A CYS 349.A SG ARG 369.A O no hydrogen 3.576 N/A HIS 350.A N LEU 368.A O no hydrogen 2.742 N/A HIS 350.A ND1 LEU 368.A O no hydrogen 2.832 N/A TYR 357.A N CYS 354.A O no hydrogen 3.188 N/A ILE 359.A N THR 355.A O no hydrogen 2.817 N/A ASN 360.A N GLU 356.A O no hydrogen 2.821 N/A LYS 361.A N TYR 357.A O no hydrogen 2.804 N/A LEU 362.A N ALA 358.A O no hydrogen 2.770 N/A ARG 363.A N ILE 359.A O no hydrogen 2.745 N/A GLN 364.A N ASN 360.A O no hydrogen 3.039 N/A ARG 369.A N LEU 379.A O no hydrogen 3.276 N/A ARG 369.A NE LEU 379.A O no hydrogen 3.185 N/A SER 371.A N ASN 377.A O no hydrogen 3.356 N/A THR 373.A OG1 ASP 374.A OD1 no hydrogen 2.788 N/A ILE 378.A N ILE 380.A O no hydrogen 2.736 N/A GLU 381.A N SER 387.A O no hydrogen 2.712 N/A VAL 382.A N ASP 376.A O no hydrogen 3.236 N/A GLN 383.A N ARG 385.A O no hydrogen 2.900 N/A TYR 386.A N PHE 395.A O no hydrogen 2.762 N/A SER 387.A OG TYR 386.A O no hydrogen 2.520 N/A SER 387.A OG ARG 393.A O no hydrogen 2.306 N/A HIS 389.A ND1 GLU 381.A OE2 no hydrogen 2.467 N/A SER 391.A N LEU 388.A O no hydrogen 3.136 N/A ARG 393.A N SER 391.A OG no hydrogen 3.199 N/A PHE 395.A N TYR 386.A O no hydrogen 2.968 N/A PHE 395.A N ARG 393.A O no hydrogen 3.156 N/A LEU 401.A N SER 397.A O no hydrogen 3.101 N/A MET 402.A N LEU 398.A O no hydrogen 2.730 N/A SER 403.A N GLY 399.A O no hydrogen 2.754 N/A SER 403.A OG ASP 400.A O no hydrogen 2.614 N/A HIS 404.A N ASP 400.A O no hydrogen 3.013 N/A LEU 405.A N MET 402.A O no hydrogen 3.172 N/A CYS 406.A SG GLN 407.A O no hydrogen 3.338 N/A ARG 411.A N ASP 327.A OD1 no hydrogen 2.601 N/A GLU 412.A N LYS 409.A O no hydrogen 3.112 N/A SER 414.A OG ASN 415.A OD1 no hydrogen 3.052 N/A LEU 416.A N SER 414.A OG no hydrogen 3.430 N/A LEU 417.A N SER 414.A O no hydrogen 3.179 N/A VAL 418.A N LEU 324.A O no hydrogen 3.272 N/A ALA 419.A N TRP 89.A O no hydrogen 3.060 N/A THR 420.A OG1 VAL 418.A O no hydrogen 3.558 N/A