Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3b8u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N THR 237.A O no hydrogen 2.876 N/A THR 5.A OG1 ALA 3.A O no hydrogen 3.182 N/A THR 5.A OG1 ALA 4.A O no hydrogen 2.560 N/A VAL 6.A N ALA 353.A O no hydrogen 2.779 N/A VAL 7.A N SER 235.A O no hydrogen 2.933 N/A ILE 8.A N LYS 355.A O no hydrogen 2.710 N/A ASN 9.A N VAL 233.A O no hydrogen 2.981 N/A ARG 10.A N VAL 357.A O no hydrogen 3.004 N/A ARG 10.A NH2 GLU 44.A OE1 no hydrogen 2.297 N/A ARG 10.A NH2 THR 48.A OG1 no hydrogen 3.407 N/A ALA 12.A N ASN 9.A OD1 no hydrogen 3.197 N/A LEU 13.A N ASN 9.A O no hydrogen 3.416 N/A ARG 14.A N ARG 10.A O no hydrogen 3.202 N/A ARG 14.A NH1 ASP 358.A O no hydrogen 3.164 N/A HIS 15.A N ALA 12.A O no hydrogen 3.253 N/A HIS 15.A NE2 GLY 229.A O no hydrogen 2.536 N/A ASN 16.A N ALA 12.A O no hydrogen 3.290 N/A ASN 16.A N LEU 13.A O no hydrogen 2.977 N/A ASN 16.A ND2 LEU 213.A O no hydrogen 3.018 N/A LEU 17.A N LEU 13.A O no hydrogen 3.391 N/A ARG 19.A N HIS 15.A O no hydrogen 2.685 N/A ARG 19.A NE PHE 228.A O no hydrogen 2.817 N/A ARG 19.A NH1 GLU 22.A OE2 no hydrogen 3.280 N/A LEU 20.A N ASN 16.A O no hydrogen 3.039 N/A ARG 21.A N LEU 17.A O no hydrogen 2.774 N/A ARG 21.A NH1 ASP 51.A O no hydrogen 3.388 N/A GLU 22.A N GLN 18.A O no hydrogen 2.889 N/A LEU 23.A N LEU 20.A O no hydrogen 3.273 N/A ALA 24.A N LEU 20.A O no hydrogen 2.982 N/A SER 27.A N ALA 24.A O no hydrogen 3.228 N/A SER 27.A OG PHE 204.A O no hydrogen 2.807 N/A LYS 28.A N ASP 205.A O no hydrogen 2.809 N/A MET 29.A N ASP 53.A OD2 no hydrogen 2.670 N/A VAL 30.A N VAL 207.A O no hydrogen 3.039 N/A ALA 31.A N ALA 54.A O no hydrogen 2.926 N/A VAL 32.A N PRO 209.A O no hydrogen 2.953 N/A VAL 33.A N GLY 56.A O no hydrogen 2.979 N/A ALA 37.A N VAL 33.A O no hydrogen 2.908 N/A TYR 38.A N LYS 34.A O no hydrogen 3.124 N/A GLY 39.A N ALA 35.A O no hydrogen 3.349 N/A GLY 39.A N ASN 36.A O no hydrogen 3.091 N/A HIS 40.A N ALA 37.A O no hydrogen 3.097 N/A HIS 40.A ND1 ALA 37.A O no hydrogen 2.918 N/A GLY 41.A N ASN 36.A O no hydrogen 2.743 N/A LEU 42.A N ASN 36.A OD1 no hydrogen 3.034 N/A THR 45.A N GLY 41.A O no hydrogen 2.944 N/A THR 45.A OG1 GLY 41.A O no hydrogen 2.855 N/A ALA 46.A N LEU 42.A O no hydrogen 3.258 N/A ARG 47.A N LEU 43.A O no hydrogen 2.922 N/A ARG 47.A NE GLU 44.A OE2 no hydrogen 3.084 N/A ARG 47.A NH2 GLU 44.A OE2 no hydrogen 2.976 N/A THR 48.A N THR 45.A O no hydrogen 3.352 N/A THR 48.A OG1 GLU 44.A O no hydrogen 2.291 N/A ASP 51.A N LEU 49.A O no hydrogen 2.280 N/A ALA 52.A N LEU 49.A O no hydrogen 3.108 N/A ASP 53.A N MET 29.A O no hydrogen 2.921 N/A PHE 55.A N PRO 74.A O no hydrogen 3.003 N/A GLY 56.A N ALA 31.A O no hydrogen 2.829 N/A VAL 57.A N LEU 76.A O no hydrogen 2.968 N/A LEU 64.A N LEU 60.A O no hydrogen 2.949 N/A LEU 66.A N ALA 63.A O no hydrogen 2.949 N/A ARG 67.A N ALA 63.A O no hydrogen 3.304 N/A ARG 67.A NE GLN 93.A O no hydrogen 2.998 N/A ARG 67.A NH1 ILE 71.A O no hydrogen 3.277 N/A ARG 67.A NH1 LYS 73.A O no hydrogen 2.580 N/A ARG 67.A NH2 LYS 73.A O no hydrogen 3.511 N/A ARG 67.A NH2 GLN 93.A O no hydrogen 2.289 N/A ALA 68.A N LEU 64.A O no hydrogen 2.915 N/A GLY 69.A N ARG 65.A O no hydrogen 3.163 N/A GLY 69.A N LEU 66.A O no hydrogen 2.541 N/A GLY 70.A N ARG 67.A O no hydrogen 3.071 N/A LEU 76.A N PHE 55.A O no hydrogen 2.642 N/A LEU 77.A N HIS 96.A O no hydrogen 2.819 N/A LEU 78.A N VAL 57.A O no hydrogen 3.090 N/A GLY 80.A N LEU 77.A O no hydrogen 3.228 N/A ARG 85.A N ASP 83.A OD2 no hydrogen 3.028 N/A ASP 86.A N ASP 83.A O no hydrogen 3.196 N/A ILE 90.A N ASP 86.A O no hydrogen 3.135 N/A SER 91.A N LEU 87.A O no hydrogen 3.244 N/A SER 91.A OG GLU 115.A O no hydrogen 3.476 N/A ALA 92.A N PRO 88.A O no hydrogen 3.214 N/A GLN 93.A N THR 89.A O no hydrogen 2.941 N/A HIS 94.A N SER 91.A O no hydrogen 3.302 N/A HIS 94.A NE2 GLU 115.A OE2 no hydrogen 3.066 N/A PHE 95.A N ILE 90.A O no hydrogen 2.920 N/A HIS 96.A N VAL 75.A O no hydrogen 2.954 N/A THR 97.A N THR 118.A O no hydrogen 3.134 N/A ALA 98.A N LEU 77.A O no hydrogen 3.178 N/A VAL 99.A N TRP 120.A O no hydrogen 2.922 N/A HIS 100.A N GLN 104.A OE1 no hydrogen 2.933 N/A HIS 100.A NE2 GLU 79.A O no hydrogen 2.961 N/A GLN 104.A NE2 PHE 81.A O no hydrogen 3.027 N/A GLN 104.A NE2 HIS 100.A NE2 no hydrogen 3.664 N/A LEU 105.A N ASN 101.A O no hydrogen 3.268 N/A LEU 108.A N GLN 104.A O no hydrogen 3.302 N/A GLU 109.A N LEU 105.A O no hydrogen 3.008 N/A ALA 111.A N ALA 107.A O no hydrogen 3.063 N/A VAL 117.A N ASN 148.A O no hydrogen 2.902 N/A TRP 120.A N THR 97.A O no hydrogen 2.807 N/A MET 121.A N ASN 154.A O no hydrogen 2.749 N/A ASP 123.A N VAL 131.A O no hydrogen 2.908 N/A THR 124.A OG1 LEU 122.A O no hydrogen 3.390 N/A THR 124.A OG1 SER 157.A OG no hydrogen 2.584 N/A GLY 125.A N ASP 123.A OD1 no hydrogen 3.352 N/A HIS 127.A N ASP 123.A OD1 no hydrogen 2.815 N/A HIS 127.A ND1 ASP 123.A OD2 no hydrogen 2.751 N/A GLN 135.A N ARG 132.A O no hydrogen 2.763 N/A ALA 136.A N PRO 133.A O no hydrogen 3.150 N/A TYR 140.A N ALA 136.A O no hydrogen 2.915 N/A HIS 141.A N GLU 137.A O no hydrogen 3.413 N/A ARG 142.A N ALA 138.A O no hydrogen 3.351 N/A ARG 142.A NH1 GLU 102.A OE2 no hydrogen 2.863 N/A ARG 142.A NH1 GLU 109.A OE1 no hydrogen 3.101 N/A ARG 142.A NH2 GLU 102.A OE2 no hydrogen 2.445 N/A LEU 143.A N PHE 139.A O no hydrogen 3.407 N/A LEU 143.A N TYR 140.A O no hydrogen 3.012 N/A THR 144.A N TYR 140.A O no hydrogen 3.324 N/A THR 144.A OG1 HIS 141.A O no hydrogen 3.140 N/A GLN 145.A N ARG 142.A O no hydrogen 3.293 N/A CYS 146.A N LEU 143.A O no hydrogen 3.311 N/A CYS 146.A SG GLU 109.A OE2 no hydrogen 3.479 N/A CYS 146.A SG ARG 142.A O no hydrogen 3.551 N/A ASN 148.A ND2 LEU 108.A O no hydrogen 3.354 N/A ASN 148.A ND2 ALA 111.A O no hydrogen 2.579 N/A ARG 150.A N VAL 117.A O no hydrogen 2.516 N/A ARG 150.A NE THR 118.A OG1 no hydrogen 3.300 N/A ASN 154.A N VAL 119.A O no hydrogen 3.162 N/A ASN 154.A ND2 VAL 119.A O no hydrogen 3.128 N/A ILE 155.A N GLN 187.A O no hydrogen 2.831 N/A VAL 156.A N MET 121.A O no hydrogen 3.428 N/A SER 157.A OG LEU 122.A O no hydrogen 2.821 N/A SER 157.A OG THR 124.A OG1 no hydrogen 2.584 N/A ALA 160.A N GLN 173.A OE1 no hydrogen 3.064 N/A ARG 161.A NE GLU 164.A OE2 no hydrogen 3.155 N/A ARG 161.A NH2 GLU 164.A OE1 no hydrogen 3.015 N/A GLU 164.A N ARG 161.A O no hydrogen 3.200 N/A CYS 167.A N GLU 164.A O no hydrogen 3.214 N/A CYS 167.A SG GLU 164.A O no hydrogen 3.348 N/A THR 170.A OG1 ARG 161.A O no hydrogen 3.345 N/A LYS 172.A N GLY 168.A O no hydrogen 3.151 N/A LYS 172.A N ALA 169.A O no hydrogen 2.754 N/A GLN 173.A N ALA 169.A O no hydrogen 3.233 N/A GLN 173.A N THR 170.A O no hydrogen 3.051 N/A GLN 173.A NE2 HIS 158.A O no hydrogen 2.901 N/A LEU 174.A N THR 170.A O no hydrogen 3.049 N/A ALA 175.A N GLU 171.A O no hydrogen 3.328 N/A ILE 176.A N LYS 172.A O no hydrogen 3.254 N/A PHE 177.A N GLN 173.A O no hydrogen 2.795 N/A ASN 178.A N LEU 174.A O no hydrogen 2.823 N/A THR 179.A N ALA 175.A O no hydrogen 3.095 N/A THR 179.A OG1 ALA 175.A O no hydrogen 2.879 N/A PHE 180.A N ILE 176.A O no hydrogen 3.203 N/A CYS 181.A N PHE 177.A O no hydrogen 3.110 N/A CYS 181.A SG PHE 177.A O no hydrogen 2.916 N/A LYS 184.A NZ GLU 137.A OE2 no hydrogen 2.987 N/A LYS 184.A NZ PHE 180.A O no hydrogen 2.758 N/A GLN 187.A N ASN 154.A OD1 no hydrogen 3.053 N/A ARG 188.A N ASP 205.A OD2 no hydrogen 2.915 N/A SER 189.A N ILE 155.A O no hydrogen 3.094 N/A SER 189.A OG TRP 206.A O no hydrogen 2.826 N/A ILE 196.A N ALA 192.A O no hydrogen 2.982 N/A LEU 197.A N SER 193.A O no hydrogen 3.069 N/A LEU 198.A N GLY 194.A O no hydrogen 2.903 N/A TRP 199.A N GLY 195.A O no hydrogen 2.955 N/A TRP 199.A NE1 ALA 162.A O no hydrogen 3.028 N/A SER 202.A N TRP 199.A O no hydrogen 3.204 N/A SER 202.A OG TRP 199.A O no hydrogen 2.712 N/A HIS 203.A NE2 ILE 196.A O no hydrogen 3.028 N/A ASP 205.A N ARG 188.A O no hydrogen 3.282 N/A TRP 206.A N ARG 188.A O no hydrogen 3.496 N/A TRP 206.A NE1 GLN 187.A OE1 no hydrogen 3.068 N/A VAL 207.A N LYS 28.A O no hydrogen 3.119 N/A ARG 208.A N ALA 191.A O no hydrogen 2.719 N/A ARG 208.A NH1 SER 157.A O no hydrogen 3.363 N/A ARG 208.A NH2 SER 157.A O no hydrogen 2.740 N/A ARG 208.A NH2 HIS 158.A ND1 no hydrogen 3.058 N/A ARG 208.A NH2 ILE 190.A O no hydrogen 3.433 N/A ILE 212.A N SER 193.A OG no hydrogen 3.021 N/A TYR 214.A N ILE 211.A O no hydrogen 3.281 N/A TYR 214.A OH VAL 32.A O no hydrogen 2.951 N/A GLY 215.A N ILE 212.A O no hydrogen 2.699 N/A SER 217.A OG SER 223.A OG no hydrogen 3.149 N/A LEU 219.A N SER 217.A OG no hydrogen 3.320 N/A ARG 222.A NE GLU 335.A OE2 no hydrogen 3.546 N/A SER 223.A N ASP 221.A OD1 no hydrogen 3.067 N/A SER 223.A OG SER 217.A OG no hydrogen 3.149 N/A SER 223.A OG ASP 221.A OD1 no hydrogen 2.965 N/A THR 224.A N ASP 227.A OD2 no hydrogen 3.198 N/A THR 224.A OG1 ASP 227.A OD2 no hydrogen 3.332 N/A ASP 227.A N THR 224.A O no hydrogen 3.150 N/A PHE 228.A N GLY 225.A O no hydrogen 3.067 N/A GLY 229.A N ALA 226.A O no hydrogen 3.415 N/A CYS 230.A N GLY 225.A O no hydrogen 2.856 N/A CYS 230.A SG ILE 212.A O no hydrogen 4.015 N/A GLN 231.A N ASN 16.A OD1 no hydrogen 2.488 N/A VAL 233.A N TYR 214.A O no hydrogen 2.996 N/A SER 235.A N VAL 7.A O no hydrogen 3.083 N/A LEU 236.A N TRP 324.A O no hydrogen 2.772 N/A THR 237.A N THR 5.A O no hydrogen 2.745 N/A THR 237.A OG1 THR 5.A O no hydrogen 3.366 N/A SER 238.A N VAL 321.A O no hydrogen 3.034 N/A SER 238.A OG ALA 270.A O no hydrogen 2.470 N/A SER 239.A OG GLN 2.A O no hydrogen 2.320 N/A LEU 240.A N ASP 319.A O no hydrogen 3.032 N/A ILE 241.A N VAL 268.A O no hydrogen 2.729 N/A ARG 244.A N LEU 266.A O no hydrogen 2.844 N/A HIS 246.A N THR 264.A O no hydrogen 2.848 N/A HIS 246.A NE2 GLU 250.A O no hydrogen 2.840 N/A LYS 247.A N GLU 250.A OE2 no hydrogen 3.077 N/A ALA 248.A N ASP 263.A OD2 no hydrogen 2.994 N/A GLY 249.A N SER 260.A O no hydrogen 2.569 N/A GLU 250.A N LYS 247.A O no hydrogen 3.055 N/A VAL 252.A N TRP 258.A O no hydrogen 2.920 N/A GLY 256.A N GLY 253.A O no hydrogen 3.374 N/A SER 260.A N GLU 250.A O no hydrogen 3.027 N/A SER 260.A OG ARG 262.A O no hydrogen 2.640 N/A ARG 262.A N SER 260.A OG no hydrogen 3.318 N/A THR 264.A N HIS 246.A O no hydrogen 2.989 N/A THR 264.A OG1 ASP 308.A OD1 no hydrogen 2.600 N/A ARG 265.A N THR 264.A OG1 no hydrogen 2.766 N/A ARG 265.A NE GLU 245.A OE1 no hydrogen 2.710 N/A ARG 265.A NH1 ALA 313.A O no hydrogen 2.476 N/A ARG 265.A NH2 GLU 245.A OE1 no hydrogen 3.387 N/A LEU 266.A N ARG 244.A O no hydrogen 2.847 N/A GLY 267.A N VAL 307.A O no hydrogen 2.892 N/A VAL 268.A N ALA 242.A O no hydrogen 2.805 N/A VAL 269.A N ILE 305.A O no hydrogen 2.694 N/A ALA 270.A N SER 239.A O no hydrogen 3.058 N/A GLY 272.A N ASP 275.A OD2 no hydrogen 3.119 N/A TYR 273.A N ALA 301.A O no hydrogen 3.126 N/A GLY 274.A N MET 302.A O no hydrogen 2.777 N/A ASP 275.A N GLY 272.A O no hydrogen 3.297 N/A GLY 276.A N TYR 273.A O no hydrogen 3.179 N/A TYR 277.A N GLY 272.A O no hydrogen 3.087 N/A ALA 281.A N PRO 278.A O no hydrogen 3.192 N/A GLY 284.A N ILE 296.A O no hydrogen 2.580 N/A THR 285.A N PRO 282.A O no hydrogen 3.064 N/A THR 285.A OG1 PRO 282.A O no hydrogen 2.801 N/A VAL 287.A N VAL 294.A O no hydrogen 3.002 N/A LEU 288.A N ILE 322.A O no hydrogen 2.999 N/A VAL 289.A N ARG 292.A O no hydrogen 3.086 N/A ASN 290.A N PRO 320.A O no hydrogen 3.041 N/A ASN 290.A ND2 ASP 315.A OD1 no hydrogen 3.061 N/A ASN 290.A ND2 ASP 319.A OD2 no hydrogen 3.453 N/A ARG 292.A N VAL 289.A O no hydrogen 3.154 N/A ARG 292.A NH1 LEU 309.A O no hydrogen 3.279 N/A ARG 292.A NH2 ASP 315.A OD1 no hydrogen 2.718 N/A VAL 294.A N VAL 287.A O no hydrogen 2.808 N/A ILE 296.A N THR 285.A O no hydrogen 2.969 N/A VAL 297.A N CYS 306.A O no hydrogen 2.936 N/A GLY 298.A N SER 283.A OG no hydrogen 2.927 N/A ALA 301.A N MET 304.A O no hydrogen 2.989 N/A ILE 305.A N VAL 269.A O no hydrogen 3.285 N/A VAL 307.A N GLY 267.A O no hydrogen 2.894 N/A ASP 308.A N PRO 295.A O no hydrogen 2.992 N/A LEU 309.A N ARG 265.A O no hydrogen 2.899 N/A GLY 310.A N ARG 265.A O no hydrogen 3.405 N/A ALA 313.A N GLY 310.A O no hydrogen 3.161 N/A LYS 316.A N ASP 319.A OD2 no hydrogen 2.643 N/A GLY 318.A N LEU 240.A O no hydrogen 2.634 N/A ASP 319.A N LYS 316.A O no hydrogen 3.004 N/A VAL 321.A N SER 238.A O no hydrogen 3.046 N/A ILE 322.A N LEU 288.A O no hydrogen 2.787 N/A LEU 323.A N LEU 236.A O no hydrogen 2.735 N/A TRP 324.A N LEU 236.A O no hydrogen 3.444 N/A GLY 325.A N LEU 328.A O no hydrogen 2.458 N/A LEU 328.A N GLY 325.A O no hydrogen 3.306 N/A GLU 331.A N GLU 331.A OE2 no hydrogen 2.827 N/A ALA 334.A N VAL 330.A O no hydrogen 2.969 N/A GLU 335.A N GLU 331.A O no hydrogen 3.161 N/A MET 336.A N ARG 332.A O no hydrogen 3.241 N/A THR 337.A N ILE 333.A O no hydrogen 3.092 N/A THR 337.A OG1 ILE 333.A O no hydrogen 2.517 N/A LYS 338.A N ALA 334.A O no hydrogen 2.863 N/A GLU 343.A N SER 340.A O no hydrogen 2.872 N/A LEU 344.A N SER 340.A O no hydrogen 2.946 N/A ILE 345.A N ALA 341.A O no hydrogen 3.207 N/A THR 346.A N TYR 342.A O no hydrogen 3.349 N/A THR 346.A OG1 TYR 342.A O no hydrogen 2.811 N/A ARG 347.A N GLU 343.A O no hydrogen 2.735 N/A ARG 347.A NE GLU 343.A OE2 no hydrogen 3.219 N/A ARG 347.A NH2 GLU 343.A OE2 no hydrogen 2.783 N/A LEU 348.A N THR 346.A O no hydrogen 2.818 N/A THR 349.A N ASP 275.A O no hydrogen 3.057 N/A THR 349.A OG1 GLY 274.A O no hydrogen 2.565 N/A ARG 351.A NH1 MET 302.A O no hydrogen 3.528 N/A ALA 353.A N ALA 4.A O no hydrogen 3.251 N/A LYS 355.A N VAL 6.A O no hydrogen 2.816 N/A LYS 355.A NZ MET 354.A O no hydrogen 3.438 N/A TYR 356.A OH HIS 40.A O no hydrogen 2.686 N/A VAL 357.A N ILE 8.A O no hydrogen 2.759 N/A