Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3x3n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 6.A N PRO 43.A O no hydrogen 3.387 N/A PHE 11.A N TYR 20.A O no hydrogen 2.775 N/A THR 12.A N ALA 47.A O no hydrogen 2.859 N/A THR 12.A OG1 ASP 13.A O no hydrogen 3.367 N/A ASP 13.A N GLN 18.A O no hydrogen 3.231 N/A ARG 14.A N ASP 13.A OD1 no hydrogen 2.468 N/A THR 16.A N ASP 13.A OD2 no hydrogen 2.944 N/A THR 16.A OG1 ASP 13.A OD2 no hydrogen 2.434 N/A GLN 18.A NE2 LEU 19.A O no hydrogen 2.248 N/A GLN 18.A NE2 VAL 30.A O no hydrogen 3.416 N/A TYR 20.A N PHE 11.A O no hydrogen 2.714 N/A VAL 21.A N HIS 28.A O no hydrogen 2.576 N/A LEU 22.A N SER 9.A O no hydrogen 2.732 N/A LEU 23.A N GLN 26.A O no hydrogen 2.832 N/A GLN 26.A N LEU 23.A O no hydrogen 2.947 N/A HIS 28.A N VAL 21.A O no hydrogen 2.728 N/A HIS 28.A ND1 GLN 60.A O no hydrogen 3.126 N/A VAL 30.A N LEU 19.A O no hydrogen 3.289 N/A ASN 32.A ND2 ILE 64.A O no hydrogen 2.945 N/A THR 34.A N TYR 69.A O no hydrogen 2.855 N/A THR 34.A OG1 PRO 68.A O no hydrogen 2.755 N/A THR 34.A OG1 TYR 69.A O no hydrogen 3.049 N/A SER 35.A N ASN 32.A OD1 no hydrogen 2.870 N/A SER 35.A OG ASN 32.A OD1 no hydrogen 2.823 N/A ALA 36.A N ASN 32.A O no hydrogen 3.117 N/A ARG 37.A N LEU 33.A O no hydrogen 3.082 N/A ARG 37.A NE ALA 44.A O no hydrogen 2.880 N/A ARG 37.A NH2 ALA 44.A O no hydrogen 3.166 N/A LEU 38.A N THR 34.A O no hydrogen 3.145 N/A VAL 39.A N SER 35.A O no hydrogen 3.199 N/A LEU 40.A N ALA 36.A O no hydrogen 2.994 N/A GLY 41.A N ARG 37.A O no hydrogen 2.827 N/A ALA 44.A N ASN 42.A O no hydrogen 2.740 N/A ASN 45.A N HIS 6.A O no hydrogen 2.999 N/A ALA 47.A N LEU 10.A O no hydrogen 3.001 N/A VAL 49.A N THR 12.A O no hydrogen 3.013 N/A SER 51.A OG ASP 13.A OD1 no hydrogen 3.531 N/A GLU 53.A N LYS 50.A O no hydrogen 3.084 N/A LEU 54.A N SER 51.A O no hydrogen 3.184 N/A SER 55.A N SER 52.A O no hydrogen 3.101 N/A SER 55.A OG SER 51.A O no hydrogen 3.349 N/A SER 55.A OG SER 52.A O no hydrogen 3.404 N/A VAL 62.A N PRO 29.A O no hydrogen 2.914 N/A ILE 64.A N SER 35.A OG no hydrogen 2.750 N/A ALA 67.A N ILE 64.A O no hydrogen 2.949 N/A SER 74.A N GLY 319.A O no hydrogen 3.076 N/A SER 79.A OG ASN 353.A O no hydrogen 2.386 N/A TRP 81.A N TRP 277.A O no hydrogen 2.908 N/A THR 82.A N ILE 102.A O no hydrogen 2.810 N/A THR 82.A OG1 SER 276.A OG no hydrogen 2.801 N/A LEU 83.A N TRP 275.A O no hydrogen 2.964 N/A CYS 84.A N ALA 100.A O no hydrogen 2.823 N/A ASP 85.A N LEU 273.A O no hydrogen 2.779 N/A THR 86.A N GLN 98.A O no hydrogen 2.743 N/A VAL 87.A N PRO 271.A O no hydrogen 3.118 N/A ALA 88.A N VAL 96.A O no hydrogen 2.583 N/A ARG 89.A NH2 SER 94.A O no hydrogen 3.538 N/A SER 92.A N ARG 89.A O no hydrogen 3.131 N/A SER 92.A OG THR 93.A OG1 no hydrogen 3.093 N/A SER 92.A OG SER 94.A O no hydrogen 2.877 N/A THR 93.A N SER 92.A OG no hydrogen 2.313 N/A THR 93.A OG1 SER 92.A OG no hydrogen 3.093 N/A VAL 96.A N ALA 88.A O no hydrogen 3.009 N/A GLN 98.A N THR 86.A O no hydrogen 2.745 N/A THR 99.A OG1 ASP 85.A OD1 no hydrogen 3.077 N/A ALA 100.A N CYS 84.A O no hydrogen 2.727 N/A VAL 101.A N THR 313.A O no hydrogen 2.872 N/A ILE 102.A N THR 82.A O no hydrogen 2.747 N/A ALA 103.A N TYR 315.A O no hydrogen 2.921 N/A GLU 106.A N PRO 297.A O no hydrogen 2.658 N/A ASP 108.A N ILE 111.A O no hydrogen 3.130 N/A SER 110.A N ASP 108.A OD1 no hydrogen 2.880 N/A SER 110.A OG ASP 108.A OD1 no hydrogen 2.730 N/A SER 110.A OG HIS 295.A NE2 no hydrogen 3.307 N/A ILE 111.A N ASP 108.A O no hydrogen 2.876 N/A ILE 111.A N ASP 108.A OD1 no hydrogen 3.260 N/A ASP 112.A N SER 292.A O no hydrogen 3.303 N/A LEU 114.A N VAL 290.A O no hydrogen 2.849 N/A GLN 115.A N GLU 118.A OE1 no hydrogen 2.875 N/A GLU 118.A N GLN 115.A O no hydrogen 2.986 N/A ALA 119.A N LYS 263.A O no hydrogen 2.994 N/A VAL 120.A N VAL 131.A O no hydrogen 2.957 N/A VAL 122.A N TRP 129.A O no hydrogen 2.851 N/A SER 123.A N THR 158.A O no hydrogen 2.842 N/A TYR 124.A N GLU 127.A O no hydrogen 2.905 N/A GLU 127.A N TYR 124.A O no hydrogen 3.154 N/A THR 128.A OG1 ILE 139.A O no hydrogen 2.471 N/A TRP 129.A N VAL 122.A O no hydrogen 2.727 N/A ILE 130.A N HIS 137.A O no hydrogen 2.762 N/A VAL 131.A N VAL 120.A O no hydrogen 2.828 N/A THR 132.A N GLY 135.A O no hydrogen 2.779 N/A THR 132.A OG1 HIS 137.A NE2 no hydrogen 2.897 N/A LYS 134.A N THR 132.A OG1 no hydrogen 3.192 N/A GLY 135.A N THR 132.A O no hydrogen 3.157 N/A ARG 136.A N PRO 168.A O no hydrogen 2.986 N/A ARG 136.A NE PHE 164.A O no hydrogen 2.854 N/A ARG 136.A NE LEU 167.A O no hydrogen 3.122 N/A ARG 136.A NH2 PHE 164.A O no hydrogen 3.374 N/A HIS 137.A N ILE 130.A O no hydrogen 2.824 N/A HIS 137.A NE2 THR 132.A OG1 no hydrogen 2.897 N/A ILE 139.A N THR 128.A O no hydrogen 3.114 N/A THR 142.A OG1 ASP 140.A OD1 no hydrogen 2.443 N/A ASP 143.A N ASP 140.A O no hydrogen 3.304 N/A LEU 146.A N ASP 143.A OD1 no hydrogen 3.241 N/A THR 147.A N ASP 143.A O no hydrogen 3.035 N/A THR 147.A OG1 ASP 143.A O no hydrogen 3.517 N/A THR 147.A OG1 ARG 144.A O no hydrogen 2.940 N/A SER 148.A N ARG 144.A O no hydrogen 2.810 N/A SER 148.A OG ARG 144.A O no hydrogen 2.587 N/A SER 148.A OG ALA 145.A O no hydrogen 2.854 N/A SER 149.A N ALA 145.A O no hydrogen 3.137 N/A SER 149.A OG ALA 145.A O no hydrogen 3.231 N/A SER 149.A OG LEU 146.A O no hydrogen 2.429 N/A ILE 151.A N THR 147.A O no hydrogen 2.876 N/A ALA 155.A N PRO 152.A O no hydrogen 3.225 N/A ARG 156.A NH2 ASP 91.A OD1 no hydrogen 2.538 N/A THR 158.A N LEU 121.A O no hydrogen 3.156 N/A ILE 160.A N SER 123.A O no hydrogen 3.088 N/A SER 161.A N ASP 85.A OD2 no hydrogen 2.649 N/A SER 161.A OG ASP 85.A OD1 no hydrogen 2.665 N/A SER 161.A OG ASP 85.A OD2 no hydrogen 3.013 N/A SER 161.A OG THR 99.A OG1 no hydrogen 3.418 N/A ASN 165.A N GLU 162.A O no hydrogen 2.932 N/A ALA 166.A N GLY 163.A O no hydrogen 2.930 N/A TRP 172.A N ALA 138.A O no hydrogen 2.597 N/A ALA 180.A N ILE 177.A O no hydrogen 3.091 N/A GLY 181.A N ILE 194.A O no hydrogen 2.722 N/A ALA 182.A N ALA 179.A O no hydrogen 3.401 N/A ASN 184.A ND2 LEU 188.A O no hydrogen 3.038 N/A ASN 184.A ND2 LEU 192.A O no hydrogen 3.040 N/A LEU 186.A N ASN 184.A OD1 no hydrogen 2.693 N/A LEU 188.A N ASN 184.A OD1 no hydrogen 3.240 N/A LEU 192.A N PRO 189.A O no hydrogen 3.052 N/A VAL 193.A N ASP 191.A O no hydrogen 2.778 N/A ILE 194.A N ALA 182.A O no hydrogen 2.708 N/A GLY 195.A N VAL 211.A O no hydrogen 2.803 N/A SER 196.A N VAL 193.A O no hydrogen 2.997 N/A SER 196.A OG VAL 193.A O no hydrogen 2.391 N/A PHE 198.A N TYR 209.A O no hydrogen 2.997 N/A GLN 199.A N PRO 239.A O no hydrogen 3.028 N/A GLN 199.A NE2 PRO 238.A O no hydrogen 2.750 N/A ILE 200.A N GLN 207.A O no hydrogen 2.967 N/A THR 202.A OG1 GLY 205.A O no hydrogen 2.834 N/A GLN 207.A N ILE 200.A O no hydrogen 3.009 N/A TYR 209.A N PHE 198.A O no hydrogen 2.915 N/A VAL 210.A N ALA 217.A O no hydrogen 2.878 N/A VAL 211.A N SER 196.A O no hydrogen 2.938 N/A LEU 212.A N GLY 215.A O no hydrogen 2.882 N/A GLY 215.A N LEU 212.A O no hydrogen 3.429 N/A ILE 216.A N ALA 249.A O no hydrogen 2.891 N/A ALA 217.A N VAL 210.A O no hydrogen 3.085 N/A VAL 219.A N TYR 208.A O no hydrogen 3.017 N/A ASN 220.A ND2 LEU 257.A O no hydrogen 2.952 N/A ASN 220.A ND2 ASP 259.A OD1 no hydrogen 3.152 N/A THR 222.A OG1 PRO 258.A O no hydrogen 2.760 N/A THR 222.A OG1 ASP 259.A O no hydrogen 3.084 N/A THR 223.A N ASN 220.A OD1 no hydrogen 2.824 N/A THR 223.A OG1 ASN 220.A OD1 no hydrogen 2.799 N/A THR 223.A OG1 SER 255.A OG no hydrogen 2.612 N/A ALA 224.A N ASN 220.A O no hydrogen 2.883 N/A ALA 225.A N ALA 221.A O no hydrogen 2.846 N/A ALA 226.A N THR 222.A O no hydrogen 2.869 N/A LEU 227.A N THR 223.A O no hydrogen 2.739 N/A ARG 228.A N ALA 224.A O no hydrogen 3.093 N/A ARG 228.A NH1 LEU 235.A O no hydrogen 3.017 N/A ARG 228.A NH2 VAL 236.A O no hydrogen 2.866 N/A ALA 229.A N ALA 225.A O no hydrogen 2.972 N/A THR 230.A N ALA 226.A O no hydrogen 3.256 N/A THR 230.A N LEU 227.A O no hydrogen 3.259 N/A GLN 231.A N LEU 227.A O no hydrogen 3.031 N/A HIS 233.A N GLN 231.A OE1 no hydrogen 2.844 N/A LEU 235.A N ALA 232.A O no hydrogen 3.213 N/A LEU 244.A N VAL 241.A O no hydrogen 2.870 N/A ILE 248.A N VAL 245.A O no hydrogen 3.078 N/A ARG 251.A N ILE 216.A O no hydrogen 2.875 N/A ARG 251.A NE GLU 250.A O no hydrogen 3.212 N/A ARG 251.A NH1 ASP 214.A OD2 no hydrogen 3.160 N/A TYR 253.A OH PRO 175.A O no hydrogen 2.541 N/A SER 255.A N TYR 253.A O no hydrogen 2.854 N/A SER 255.A OG THR 223.A OG1 no hydrogen 2.612 N/A LEU 257.A N SER 255.A OG no hydrogen 3.172 N/A LYS 263.A N HIS 117.A O no hydrogen 2.823 N/A LYS 263.A NZ ILE 264.A O no hydrogen 3.344 N/A VAL 265.A N ALA 119.A O no hydrogen 2.926 N/A ARG 267.A NE PRO 271.A O no hydrogen 2.714 N/A ARG 267.A NH1 THR 158.A OG1 no hydrogen 2.922 N/A ARG 267.A NH2 ASP 85.A O no hydrogen 3.162 N/A ARG 267.A NH2 PRO 271.A O no hydrogen 2.867 N/A GLN 269.A N SER 266.A O no hydrogen 2.955 N/A ASP 270.A N SER 266.A O no hydrogen 2.817 N/A ALA 272.A N GLY 293.A O no hydrogen 2.981 N/A LEU 273.A N ASP 85.A O no hydrogen 2.806 N/A CYS 274.A N LEU 291.A O no hydrogen 2.830 N/A TRP 275.A N LEU 83.A O no hydrogen 2.806 N/A SER 276.A N THR 289.A O no hydrogen 2.805 N/A SER 276.A OG THR 82.A OG1 no hydrogen 2.801 N/A TRP 277.A N TRP 81.A O no hydrogen 2.794 N/A GLN 278.A N GLN 287.A O no hydrogen 2.908 N/A ASP 283.A N ALA 281.A O no hydrogen 2.409 N/A GLN 284.A NE2 SER 285.A O no hydrogen 3.271 N/A GLN 287.A N GLN 278.A O no hydrogen 2.778 N/A THR 289.A N SER 276.A O no hydrogen 2.775 N/A LEU 291.A N CYS 274.A O no hydrogen 2.806 N/A SER 292.A N ASP 112.A O no hydrogen 2.927 N/A GLY 293.A N ALA 272.A O no hydrogen 2.981 N/A ARG 294.A N SER 110.A O no hydrogen 2.820 N/A HIS 295.A ND1 LEU 296.A O no hydrogen 3.035 N/A ILE 298.A N LEU 296.A O no hydrogen 2.821 N/A ALA 302.A N SER 299.A O no hydrogen 3.058 N/A ALA 302.A N SER 299.A OG no hydrogen 3.311 N/A ILE 305.A N VAL 314.A O no hydrogen 3.002 N/A GLY 310.A N GLN 307.A O no hydrogen 3.394 N/A THR 313.A N THR 99.A O no hydrogen 2.931 N/A VAL 314.A N ILE 305.A O no hydrogen 2.819 N/A TYR 315.A N VAL 101.A O no hydrogen 2.638 N/A ASP 317.A N ASP 317.A OD1 no hydrogen 2.513 N/A LYS 320.A N ILE 328.A O no hydrogen 2.834 N/A LYS 320.A NZ SER 74.A OG no hydrogen 2.845 N/A LYS 320.A NZ ASP 317.A OD1 no hydrogen 2.899 N/A VAL 322.A N TYR 326.A O no hydrogen 2.850 N/A ALA 323.A N GLN 352.A O no hydrogen 2.738 N/A LEU 324.A N SER 325.A O no hydrogen 2.885 N/A TYR 327.A N TYR 335.A O no hydrogen 2.806 N/A TYR 327.A OH PRO 72.A O no hydrogen 2.775 N/A ILE 328.A N LYS 320.A O no hydrogen 2.707 N/A ASP 329.A N VAL 333.A O no hydrogen 2.984 N/A GLY 332.A N ASP 329.A O no hydrogen 2.744 N/A VAL 333.A N ASP 329.A OD1 no hydrogen 2.818 N/A ARG 334.A N VAL 363.A O no hydrogen 2.976 N/A ARG 334.A NE LEU 362.A O no hydrogen 2.886 N/A ARG 334.A NH2 ARG 360.A O no hydrogen 3.206 N/A TYR 335.A N TYR 327.A O no hydrogen 2.716 N/A TYR 335.A OH ASP 329.A OD2 no hydrogen 2.608 N/A THR 342.A N ASN 339.A OD1 no hydrogen 2.948 N/A THR 342.A OG1 ASN 339.A OD1 no hydrogen 2.347 N/A ALA 343.A N ASN 339.A O no hydrogen 3.335 N/A LYS 344.A N ALA 340.A O no hydrogen 2.899 N/A SER 345.A N GLU 341.A O no hydrogen 2.900 N/A SER 345.A OG GLU 341.A O no hydrogen 2.844 N/A LEU 346.A N THR 342.A O no hydrogen 3.153 N/A GLY 347.A N LYS 344.A O no hydrogen 3.157 N/A LEU 348.A N ALA 343.A O no hydrogen 2.866 N/A GLN 352.A N PHE 321.A O no hydrogen 2.764 N/A GLN 352.A NE2 SER 77.A O no hydrogen 2.838 N/A ASN 353.A ND2 ALA 323.A O no hydrogen 3.609 N/A ALA 354.A N ALA 323.A O no hydrogen 3.254 N/A GLU 357.A N GLU 357.A OE1 no hydrogen 2.938 N/A ILE 358.A N PRO 355.A O no hydrogen 3.164 N/A VAL 359.A N PRO 355.A O no hydrogen 3.122 N/A ARG 360.A N TRP 356.A O no hydrogen 3.107 N/A LEU 361.A N ILE 358.A O no hydrogen 3.016 N/A LEU 362.A N VAL 359.A O no hydrogen 3.023 N/A GLY 365.A N ARG 334.A O no hydrogen 2.859 N/A LEU 368.A N GLY 336.A O no hydrogen 2.878 N/A LYS 370.A NZ THR 342.A OG1 no hydrogen 2.868 N/A ALA 373.A N SER 369.A O no hydrogen 2.836 N/A LEU 374.A N LYS 370.A O no hydrogen 2.833 N/A