Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1brl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N ASP 306.A O no hydrogen 2.912 N/A ASN 5.A N THR 38.A O no hydrogen 2.977 N/A PHE 6.A N CYS 310.A O no hydrogen 2.586 N/A LEU 7.A N TRP 40.A O no hydrogen 2.944 N/A LEU 8.A N GLU 313.A OE2 no hydrogen 2.500 N/A THR 9.A N GLU 313.A OE1 no hydrogen 2.865 N/A GLN 11.A N GLU 48.A O no hydrogen 2.598 N/A GLN 11.A NE2 LEU 15.A O no hydrogen 2.925 N/A LEU 15.A N PRO 12.A O no hydrogen 3.189 N/A SER 16.A N GLU 19.A OE1 no hydrogen 2.747 N/A SER 16.A OG GLU 19.A OE1 no hydrogen 2.544 N/A VAL 20.A N SER 16.A O no hydrogen 3.062 N/A MET 21.A N GLN 17.A O no hydrogen 2.937 N/A LYS 22.A N THR 18.A O no hydrogen 2.867 N/A ARG 23.A N GLU 19.A O no hydrogen 2.973 N/A ARG 23.A NE GLY 316.A O no hydrogen 3.063 N/A ARG 23.A NH1 TYR 10.A O no hydrogen 3.440 N/A ARG 23.A NH2 GLY 316.A O no hydrogen 2.266 N/A LEU 24.A N VAL 20.A O no hydrogen 2.710 N/A VAL 25.A N MET 21.A O no hydrogen 3.178 N/A ASN 26.A N LYS 22.A O no hydrogen 3.022 N/A LEU 27.A N ARG 23.A O no hydrogen 3.130 N/A GLY 28.A N LEU 24.A O no hydrogen 3.277 N/A LYS 29.A N VAL 25.A O no hydrogen 3.174 N/A ALA 30.A N ASN 26.A O no hydrogen 2.958 N/A SER 31.A N LEU 27.A O no hydrogen 2.896 N/A SER 31.A OG LEU 27.A O no hydrogen 2.467 N/A SER 31.A OG GLY 28.A O no hydrogen 3.390 N/A CYS 34.A N ALA 30.A O no hydrogen 3.233 N/A CYS 34.A N SER 31.A O no hydrogen 2.795 N/A CYS 34.A SG ALA 30.A O no hydrogen 3.935 N/A GLY 35.A N GLU 32.A O no hydrogen 2.769 N/A ASP 37.A N PHE 3.A O no hydrogen 2.937 N/A THR 38.A OG1 ASP 37.A O no hydrogen 2.388 N/A VAL 39.A N ASN 70.A O no hydrogen 2.712 N/A TRP 40.A N ASN 5.A O no hydrogen 2.954 N/A LEU 41.A N GLY 72.A O no hydrogen 2.877 N/A LEU 42.A N LEU 7.A O no hydrogen 3.150 N/A HIS 44.A N LEU 52.A O no hydrogen 3.327 N/A HIS 45.A NE2 GLU 43.A OE2 no hydrogen 2.868 N/A GLY 50.A N THR 47.A O no hydrogen 3.208 N/A LEU 51.A N THR 9.A O no hydrogen 2.914 N/A TYR 56.A OH GLN 86.A OE1 no hydrogen 3.210 N/A ALA 58.A N ASN 54.A O no hydrogen 3.359 N/A ALA 59.A N PRO 55.A O no hydrogen 2.657 N/A ALA 60.A N TYR 56.A O no hydrogen 2.842 N/A HIS 61.A N VAL 57.A O no hydrogen 3.050 N/A LEU 62.A N ALA 58.A O no hydrogen 3.098 N/A LEU 63.A N ALA 59.A O no hydrogen 2.778 N/A GLY 64.A N ALA 60.A O no hydrogen 2.859 N/A ALA 65.A N HIS 61.A O no hydrogen 3.037 N/A THR 66.A N LEU 63.A O no hydrogen 3.354 N/A THR 66.A OG1 LEU 62.A O no hydrogen 2.785 N/A THR 66.A OG1 LEU 63.A O no hydrogen 3.232 N/A THR 68.A OG1 GLU 32.A OE1 no hydrogen 2.694 N/A THR 68.A OG1 GLU 32.A OE2 no hydrogen 2.803 N/A ASN 70.A ND2 THR 68.A O no hydrogen 3.273 N/A VAL 71.A N ARG 100.A O no hydrogen 3.052 N/A GLY 72.A N VAL 39.A O no hydrogen 2.601 N/A THR 73.A N ARG 102.A O no hydrogen 2.960 N/A THR 73.A OG1 GLY 104.A O no hydrogen 3.099 N/A ALA 74.A N LEU 41.A O no hydrogen 2.812 N/A ALA 75.A N LEU 41.A O no hydrogen 3.289 N/A ILE 76.A N GLY 104.A O no hydrogen 2.906 N/A LEU 78.A N CYS 106.A O no hydrogen 3.029 N/A GLN 86.A N HIS 82.A O no hydrogen 2.909 N/A GLN 86.A NE2 LEU 78.A O no hydrogen 2.917 N/A ALA 87.A N PRO 83.A O no hydrogen 2.724 N/A GLU 88.A N VAL 84.A O no hydrogen 2.931 N/A ASP 89.A N ARG 85.A O no hydrogen 3.222 N/A VAL 90.A N GLN 86.A O no hydrogen 2.823 N/A ASN 91.A N ALA 87.A O no hydrogen 2.861 N/A LEU 92.A N GLU 88.A O no hydrogen 2.930 N/A LEU 93.A N ASP 89.A O no hydrogen 3.046 N/A ASP 94.A N VAL 90.A O no hydrogen 2.742 N/A GLN 95.A N ASN 91.A O no hydrogen 2.957 N/A GLN 95.A NE2 SER 161.A O no hydrogen 2.267 N/A MET 96.A N LEU 92.A O no hydrogen 2.464 N/A SER 97.A N LEU 93.A O no hydrogen 2.851 N/A SER 97.A OG LEU 93.A O no hydrogen 2.268 N/A SER 97.A OG ASP 94.A O no hydrogen 3.261 N/A LYS 98.A N GLN 95.A O no hydrogen 3.298 N/A GLY 99.A N ASP 94.A O no hydrogen 2.738 N/A ARG 100.A NE SER 97.A O no hydrogen 3.089 N/A ARG 100.A NH1 LEU 63.A O no hydrogen 3.456 N/A ARG 100.A NH1 THR 66.A O no hydrogen 2.918 N/A ARG 100.A NH1 THR 66.A OG1 no hydrogen 2.856 N/A ARG 100.A NH1 LEU 69.A O no hydrogen 3.155 N/A ARG 100.A NH2 LEU 63.A O no hydrogen 2.788 N/A ARG 100.A NH2 THR 66.A O no hydrogen 2.941 N/A ARG 102.A N VAL 71.A O no hydrogen 2.756 N/A ARG 102.A NH1 GLY 99.A O no hydrogen 3.348 N/A ARG 102.A NH1 PHE 101.A O no hydrogen 3.050 N/A PHE 103.A N PRO 169.A O no hydrogen 2.821 N/A GLY 104.A N ARG 102.A O no hydrogen 3.104 N/A ILE 105.A N TYR 171.A O no hydrogen 2.654 N/A ARG 107.A NE SER 124.A OG no hydrogen 2.627 N/A LYS 112.A NZ HIS 45.A O no hydrogen 2.872 N/A LYS 112.A NZ ASP 113.A OD1 no hydrogen 2.437 N/A PHE 114.A N ASP 111.A O no hydrogen 2.457 N/A ARG 115.A N ASP 111.A O no hydrogen 3.089 N/A VAL 116.A N LYS 112.A O no hydrogen 2.971 N/A PHE 117.A N ASP 113.A O no hydrogen 3.089 N/A THR 119.A N PHE 114.A O no hydrogen 3.152 N/A LEU 127.A N ASN 123.A O no hydrogen 3.021 N/A MET 128.A N SER 124.A O no hydrogen 3.493 N/A ASP 129.A N ARG 125.A O no hydrogen 2.856 N/A CYS 130.A N ALA 126.A O no hydrogen 2.575 N/A TRP 131.A N LEU 127.A O no hydrogen 2.646 N/A TRP 131.A NE1 ALA 81.A O no hydrogen 2.475 N/A TYR 132.A N MET 128.A O no hydrogen 3.177 N/A ASP 133.A N ASP 129.A O no hydrogen 3.355 N/A LEU 134.A N CYS 130.A O no hydrogen 3.164 N/A MET 135.A N TRP 131.A O no hydrogen 2.999 N/A LYS 136.A N TYR 132.A O no hydrogen 2.750 N/A GLU 137.A N ASP 133.A O no hydrogen 2.642 N/A GLY 138.A N LEU 134.A O no hydrogen 2.773 N/A PHE 139.A N MET 135.A O no hydrogen 2.929 N/A ASN 140.A N GLU 137.A O no hydrogen 3.411 N/A GLU 141.A N GLU 137.A O no hydrogen 3.166 N/A GLY 142.A N GLY 138.A O no hydrogen 3.185 N/A ALA 146.A N PHE 153.A O no hydrogen 3.199 N/A ASP 147.A N ILE 151.A O no hydrogen 3.271 N/A ILE 156.A N ILE 144.A O no hydrogen 3.372 N/A LEU 158.A N GLY 142.A O no hydrogen 2.942 N/A TYR 163.A N ASP 94.A OD2 no hydrogen 2.995 N/A THR 164.A N ASP 94.A OD2 no hydrogen 2.727 N/A THR 164.A OG1 ASP 94.A OD1 no hydrogen 2.363 N/A THR 164.A OG1 ASP 94.A OD2 no hydrogen 2.890 N/A GLY 167.A N THR 164.A O no hydrogen 2.718 N/A TYR 171.A N PHE 103.A O no hydrogen 3.508 N/A VAL 172.A N PRO 189.A O no hydrogen 3.154 N/A VAL 173.A N ILE 105.A O no hydrogen 3.013 N/A ALA 174.A N ILE 191.A O no hydrogen 3.388 N/A THR 180.A N SER 176.A O no hydrogen 3.075 N/A THR 180.A OG1 SER 176.A O no hydrogen 2.834 N/A THR 180.A OG1 GLN 204.A OE1 no hydrogen 3.136 N/A GLU 181.A N ALA 177.A O no hydrogen 2.792 N/A TRP 182.A N SER 178.A O no hydrogen 2.917 N/A TRP 182.A NE1 ASP 129.A OD1 no hydrogen 3.314 N/A ALA 183.A N THR 179.A O no hydrogen 3.086 N/A ALA 184.A N THR 180.A O no hydrogen 3.234 N/A GLU 185.A N GLU 181.A O no hydrogen 2.816 N/A ARG 186.A N ALA 183.A O no hydrogen 2.627 N/A GLY 187.A N ALA 184.A O no hydrogen 2.641 N/A LEU 188.A N ALA 183.A O no hydrogen 3.214 N/A ILE 191.A N VAL 172.A O no hydrogen 2.951 N/A LEU 192.A N CYS 225.A O no hydrogen 2.901 N/A ILE 195.A N SER 193.A OG no hydrogen 2.917 N/A ASN 197.A N GLU 200.A OE1 no hydrogen 3.191 N/A THR 198.A OG1 ASP 299.A OD1 no hydrogen 2.869 N/A GLU 200.A N ASN 197.A OD1 no hydrogen 3.103 N/A LYS 201.A N ASN 197.A O no hydrogen 2.461 N/A LYS 202.A N THR 198.A O no hydrogen 2.721 N/A LYS 202.A NZ ASP 206.A OD2 no hydrogen 3.502 N/A ALA 203.A N HIS 199.A O no hydrogen 2.644 N/A GLN 204.A N LYS 201.A O no hydrogen 2.648 N/A LEU 205.A N LYS 201.A O no hydrogen 3.021 N/A ASP 206.A N LYS 202.A O no hydrogen 3.365 N/A TYR 208.A N GLN 204.A O no hydrogen 2.844 N/A ASN 209.A N LEU 205.A O no hydrogen 2.615 N/A GLU 210.A N ASP 206.A O no hydrogen 2.881 N/A VAL 211.A N TYR 208.A O no hydrogen 3.347 N/A ALA 212.A N TYR 208.A O no hydrogen 3.022 N/A THR 213.A N ASN 209.A O no hydrogen 2.751 N/A THR 213.A OG1 ASN 209.A O no hydrogen 2.281 N/A HIS 215.A N VAL 211.A O no hydrogen 2.840 N/A HIS 215.A ND1 VAL 211.A O no hydrogen 2.871 N/A GLY 216.A N THR 213.A O no hydrogen 2.518 N/A TYR 217.A N ALA 212.A O no hydrogen 2.786 N/A TYR 217.A OH GLU 185.A O no hydrogen 3.219 N/A THR 220.A N ASP 218.A OD1 no hydrogen 3.292 N/A THR 220.A OG1 ASP 218.A OD1 no hydrogen 2.285 N/A LYS 221.A N ASP 218.A O no hydrogen 2.897 N/A CYS 225.A N MET 190.A O no hydrogen 2.402 N/A CYS 225.A SG ASN 307.A O no hydrogen 3.511 N/A LEU 226.A N ASN 307.A O no hydrogen 3.078 N/A SER 227.A OG LEU 192.A O no hydrogen 2.861 N/A TYR 228.A N CYS 309.A O no hydrogen 3.027 N/A TYR 228.A OH ASP 299.A OD2 no hydrogen 3.173 N/A THR 230.A N GLY 311.A O no hydrogen 3.158 N/A SER 231.A N PRO 285.A O no hydrogen 2.777 N/A SER 231.A OG ALA 239.A O no hydrogen 3.181 N/A HIS 234.A N ASP 233.A OD1 no hydrogen 2.580 N/A ASP 235.A N ASP 233.A OD1 no hydrogen 3.247 N/A SER 236.A OG ASN 237.A OD1 no hydrogen 3.534 N/A ARG 238.A N ASP 235.A OD1 no hydrogen 2.801 N/A ALA 239.A N ASP 235.A O no hydrogen 3.310 N/A LYS 240.A N SER 236.A O no hydrogen 3.053 N/A LYS 240.A NZ GLU 291.A OE1 no hydrogen 3.269 N/A LYS 240.A NZ GLU 291.A OE2 no hydrogen 3.523 N/A ASP 241.A N ASN 237.A O no hydrogen 2.816 N/A ILE 242.A N ARG 238.A O no hydrogen 2.846 N/A CYS 243.A N ALA 239.A O no hydrogen 3.301 N/A ARG 244.A N LYS 240.A O no hydrogen 2.889 N/A ASN 245.A N ASP 241.A O no hydrogen 3.248 N/A PHE 246.A N ILE 242.A O no hydrogen 3.184 N/A LEU 247.A N CYS 243.A O no hydrogen 3.305 N/A GLY 248.A N ASN 245.A O no hydrogen 2.844 N/A HIS 249.A N ASN 245.A O no hydrogen 3.181 N/A TRP 250.A N PHE 246.A O no hydrogen 2.639 N/A TYR 251.A N LEU 247.A O no hydrogen 3.000 N/A ASP 252.A N GLY 248.A O no hydrogen 2.662 N/A SER 253.A N HIS 249.A O no hydrogen 2.636 N/A SER 253.A OG HIS 249.A O no hydrogen 2.782 N/A TYR 254.A N TRP 250.A O no hydrogen 2.609 N/A VAL 255.A N TYR 251.A O no hydrogen 2.787 N/A ASN 256.A N ASP 252.A O no hydrogen 2.896 N/A ALA 257.A N SER 253.A O no hydrogen 3.240 N/A THR 258.A N VAL 255.A O no hydrogen 3.079 N/A THR 258.A OG1 VAL 255.A O no hydrogen 3.384 N/A SER 264.A N ASP 262.A O no hydrogen 2.671 N/A THR 273.A OG1 ASP 272.A O no hydrogen 2.833 N/A ARG 276.A NE ASP 278.A OD1 no hydrogen 2.631 N/A ARG 276.A NE ASP 278.A OD2 no hydrogen 2.820 N/A ARG 276.A NH2 ASP 278.A OD2 no hydrogen 3.035 N/A SER 280.A N ILE 277.A O no hydrogen 3.114 N/A SER 280.A OG ILE 277.A O no hydrogen 2.384 N/A GLU 282.A N TYR 279.A O no hydrogen 2.982 N/A ILE 283.A N SER 280.A O no hydrogen 3.362 N/A ASN 284.A ND2 TRP 194.A O no hydrogen 3.107 N/A ASN 284.A ND2 SER 280.A O no hydrogen 2.275 N/A VAL 286.A N ASN 284.A O no hydrogen 2.414 N/A GLY 287.A N SER 231.A O no hydrogen 2.770 N/A THR 288.A OG1 GLU 290.A OE2 no hydrogen 3.341 N/A THR 288.A OG1 GLU 291.A OE2 no hydrogen 3.463 N/A CYS 292.A N THR 288.A O no hydrogen 2.987 N/A CYS 292.A SG GLY 287.A O no hydrogen 3.534 N/A CYS 292.A SG THR 288.A O no hydrogen 3.497 N/A ILE 293.A N PRO 289.A O no hydrogen 2.734 N/A ALA 294.A N GLU 290.A O no hydrogen 3.135 N/A ILE 295.A N GLU 291.A O no hydrogen 3.160 N/A ILE 296.A N CYS 292.A O no hydrogen 3.141 N/A GLN 297.A N ILE 293.A O no hydrogen 3.311 N/A GLN 298.A N ALA 294.A O no hydrogen 3.210 N/A ILE 300.A N ILE 296.A O no hydrogen 2.925 N/A ASP 301.A N GLN 297.A O no hydrogen 2.636 N/A ALA 302.A N ASP 299.A O no hydrogen 3.282 N/A THR 303.A N ILE 300.A O no hydrogen 2.728 N/A THR 303.A OG1 ASP 299.A O no hydrogen 2.286 N/A THR 303.A OG1 ILE 300.A O no hydrogen 3.200 N/A GLY 304.A N ILE 300.A O no hydrogen 2.807 N/A ILE 308.A N LYS 2.A O no hydrogen 2.867 N/A CYS 309.A N LEU 226.A O no hydrogen 2.755 N/A CYS 309.A SG LEU 226.A O no hydrogen 3.124 N/A CYS 310.A N GLY 4.A O no hydrogen 2.868 N/A GLY 311.A N TYR 228.A O no hydrogen 2.913 N/A ASN 315.A N PHE 312.A O no hydrogen 3.208 N/A GLY 316.A N GLU 313.A O no hydrogen 2.763 N/A SER 317.A N ASN 315.A O no hydrogen 2.794 N/A GLU 320.A N SER 317.A OG no hydrogen 3.293 N/A ILE 321.A N SER 317.A O no hydrogen 3.010 N/A ILE 322.A N GLU 318.A O no hydrogen 3.225 N/A ILE 322.A N GLU 319.A O no hydrogen 2.878 N/A ALA 323.A N GLU 319.A O no hydrogen 2.927 N/A SER 324.A N GLU 320.A O no hydrogen 2.876 N/A MET 325.A N ILE 322.A O no hydrogen 2.505 N/A LYS 326.A N ILE 322.A O no hydrogen 2.811 N/A LYS 326.A N ALA 323.A O no hydrogen 3.054 N/A LEU 327.A N ALA 323.A O no hydrogen 2.806 N/A GLN 329.A N MET 325.A O no hydrogen 3.026 N/A SER 330.A N LYS 326.A O no hydrogen 2.960 N/A SER 330.A OG LYS 326.A O no hydrogen 2.450 N/A ASP 331.A N LEU 327.A O no hydrogen 2.600 N/A VAL 332.A N PHE 328.A O no hydrogen 2.866 N/A MET 333.A N PHE 328.A O no hydrogen 2.740 N/A LYS 337.A N GLN 297.A OE1 no hydrogen 2.543 N/A LYS 339.A NZ GLN 340.A OE1 no hydrogen 3.071 N/A