Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6uus_B.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 8.B N ASP 5.B O no hydrogen 3.311 N/A GLN 9.B N GLN 6.B O no hydrogen 2.968 N/A ALA 11.B N LEU 7.B O no hydrogen 2.988 N/A GLU 12.B N ARG 8.B O no hydrogen 2.866 N/A GLN 13.B N GLN 9.B O no hydrogen 3.106 N/A LEU 14.B N GLU 10.B O no hydrogen 2.897 N/A LYS 15.B N ALA 11.B O no hydrogen 3.138 N/A ASN 16.B N GLU 12.B O no hydrogen 3.329 N/A ASN 16.B ND2 GLU 12.B OE1 no hydrogen 3.303 N/A GLN 17.B N GLN 13.B O no hydrogen 3.417 N/A GLN 17.B NE2 GLN 17.B O no hydrogen 2.643 N/A ILE 18.B N LEU 14.B O no hydrogen 3.078 N/A ARG 19.B N LYS 15.B O no hydrogen 2.958 N/A ASP 20.B N ASN 16.B O no hydrogen 2.827 N/A ALA 21.B N GLN 17.B O no hydrogen 2.961 N/A ARG 22.B N ILE 18.B O no hydrogen 3.061 N/A ARG 22.B NH2 THR 221.B O no hydrogen 2.764 N/A LYS 23.B N ARG 19.B O no hydrogen 3.148 N/A ALA 24.B N ASP 20.B O no hydrogen 3.232 N/A CYS 25.B N ALA 21.B O no hydrogen 3.347 N/A ALA 26.B N LYS 23.B O no hydrogen 3.451 N/A GLN 32.B N THR 29.B O no hydrogen 2.912 N/A THR 34.B OG1 SER 31.B O no hydrogen 2.305 N/A ARG 42.B NE ILE 43.B O no hydrogen 3.108 N/A ARG 42.B NH2 ILE 43.B O no hydrogen 3.458 N/A ILE 43.B N ALA 305.B O no hydrogen 2.428 N/A ARG 48.B N ILE 338.B O no hydrogen 2.611 N/A ARG 48.B NH2 ASN 340.B O no hydrogen 3.533 N/A ARG 49.B N ILE 338.B O no hydrogen 3.310 N/A ARG 49.B NE ARG 48.B O no hydrogen 3.383 N/A ARG 49.B NH1 SER 84.B O no hydrogen 3.436 N/A LEU 51.B N LEU 336.B O no hydrogen 2.718 N/A LYS 57.B NZ GLN 75.B OE1 no hydrogen 3.387 N/A ILE 58.B N SER 331.B O no hydrogen 3.146 N/A TYR 59.B N ALA 73.B O no hydrogen 2.920 N/A ALA 60.B N ALA 73.B O no hydrogen 3.419 N/A HIS 62.B N VAL 71.B O no hydrogen 3.064 N/A GLY 64.B N LEU 69.B O no hydrogen 2.799 N/A THR 65.B OG1 PRO 107.B O no hydrogen 3.334 N/A SER 67.B N GLY 64.B O no hydrogen 3.161 N/A SER 67.B OG SER 67.B O no hydrogen 2.274 N/A SER 67.B OG ASP 323.B OD1 no hydrogen 3.331 N/A SER 67.B OG ASP 323.B OD2 no hydrogen 2.824 N/A ARG 68.B NE ASP 83.B OD1 no hydrogen 3.168 N/A ARG 68.B NE ASP 83.B OD2 no hydrogen 3.219 N/A LEU 70.B N TRP 82.B O no hydrogen 3.076 N/A VAL 71.B N HIS 62.B O no hydrogen 3.112 N/A SER 72.B N ILE 80.B O no hydrogen 3.065 N/A ALA 73.B N ALA 60.B O no hydrogen 2.889 N/A SER 74.B OG LYS 57.B O no hydrogen 3.020 N/A SER 74.B OG ASP 76.B OD1 no hydrogen 3.061 N/A GLN 75.B N LYS 57.B O no hydrogen 2.999 N/A GLN 75.B NE2 VAL 100.B O no hydrogen 2.781 N/A GLY 77.B N SER 74.B O no hydrogen 3.436 N/A LEU 79.B N ILE 93.B O no hydrogen 2.582 N/A ILE 81.B N HIS 91.B O no hydrogen 2.746 N/A TRP 82.B N LEU 70.B O no hydrogen 2.798 N/A ASP 83.B N ASN 88.B O no hydrogen 2.818 N/A SER 84.B N ARG 68.B O no hydrogen 2.919 N/A SER 84.B OG ARG 68.B O no hydrogen 2.613 N/A TYR 85.B N ASP 83.B OD1 no hydrogen 2.952 N/A THR 87.B OG1 THR 86.B O no hydrogen 2.528 N/A VAL 90.B N ILE 81.B O no hydrogen 2.812 N/A ILE 93.B N LEU 79.B O no hydrogen 2.729 N/A LEU 95.B N GLY 77.B O no hydrogen 3.155 N/A MET 101.B N GLY 115.B O no hydrogen 2.574 N/A THR 102.B N GLY 115.B O no hydrogen 3.045 N/A CYS 103.B SG VAL 71.B O no hydrogen 3.655 N/A ALA 104.B N ALA 113.B O no hydrogen 2.840 N/A TYR 105.B N HIS 62.B ND1 no hydrogen 2.988 N/A ALA 106.B N TYR 111.B O no hydrogen 3.075 N/A SER 108.B OG ASP 154.B OD1 no hydrogen 2.414 N/A SER 108.B OG ASP 154.B OD2 no hydrogen 3.191 N/A GLY 109.B N ALA 106.B O no hydrogen 2.974 N/A ASN 110.B N SER 108.B OG no hydrogen 3.425 N/A VAL 112.B N TYR 124.B O no hydrogen 3.322 N/A ALA 113.B N ALA 104.B O no hydrogen 2.964 N/A CYS 114.B N SER 122.B O no hydrogen 3.250 N/A CYS 114.B SG SER 122.B O no hydrogen 4.014 N/A GLY 115.B N THR 102.B O no hydrogen 3.118 N/A LEU 117.B N TRP 99.B O no hydrogen 3.136 N/A ASN 119.B N GLY 116.B O no hydrogen 3.216 N/A ASN 119.B ND2 HIS 142.B O no hydrogen 3.670 N/A ILE 120.B N ASP 118.B OD1 no hydrogen 3.293 N/A CYS 121.B N LEU 139.B O no hydrogen 3.096 N/A SER 122.B N CYS 114.B O no hydrogen 2.954 N/A SER 122.B OG GLU 138.B OE1 no hydrogen 2.659 N/A ILE 123.B N ARG 137.B O no hydrogen 2.781 N/A TYR 124.B N VAL 112.B O no hydrogen 3.009 N/A ASN 125.B N ARG 134.B O no hydrogen 3.095 N/A LEU 126.B N ASN 110.B O no hydrogen 2.859 N/A LYS 127.B N ASN 125.B OD1 no hydrogen 3.408 N/A LYS 127.B NZ ASN 110.B OD1 no hydrogen 3.002 N/A THR 128.B OG1 ASN 132.B O no hydrogen 2.320 N/A GLU 130.B N GLU 130.B OE1 no hydrogen 2.564 N/A GLY 131.B N THR 128.B O no hydrogen 3.125 N/A GLY 131.B N THR 128.B OG1 no hydrogen 3.249 N/A SER 136.B N ILE 123.B O no hydrogen 2.420 N/A ARG 137.B N ILE 123.B O no hydrogen 3.377 N/A LEU 139.B N CYS 121.B O no hydrogen 3.139 N/A HIS 142.B NE2 THR 159.B OG1 no hydrogen 2.835 N/A THR 143.B N ASP 163.B OD2 no hydrogen 2.905 N/A THR 143.B OG1 ASP 163.B OD2 no hydrogen 3.009 N/A TYR 145.B OH ASP 186.B OD2 no hydrogen 3.241 N/A LEU 146.B N GLY 116.B O no hydrogen 2.685 N/A SER 147.B N SER 160.B O no hydrogen 2.950 N/A SER 147.B OG SER 160.B O no hydrogen 3.232 N/A SER 147.B OG SER 160.B OG no hydrogen 2.723 N/A SER 147.B OG VAL 187.B O no hydrogen 2.763 N/A CYS 148.B SG LEU 190.B O no hydrogen 3.710 N/A ARG 150.B N VAL 158.B O no hydrogen 3.130 N/A ARG 150.B NH1 CYS 103.B O no hydrogen 3.192 N/A ARG 150.B NH1 CYS 149.B O no hydrogen 2.945 N/A LEU 152.B N GLN 156.B O no hydrogen 3.028 N/A ASP 153.B N GLN 156.B O no hydrogen 3.312 N/A ASN 155.B N ASP 153.B OD1 no hydrogen 2.779 N/A ASN 155.B ND2 ASP 170.B OD1 no hydrogen 2.787 N/A GLN 156.B NE2 ASP 153.B OD2 no hydrogen 3.463 N/A ILE 157.B N TRP 169.B O no hydrogen 3.440 N/A VAL 158.B N ARG 150.B O no hydrogen 3.233 N/A THR 159.B N ALA 167.B O no hydrogen 2.904 N/A THR 159.B OG1 HIS 142.B NE2 no hydrogen 2.835 N/A THR 159.B OG1 ALA 167.B O no hydrogen 3.530 N/A SER 160.B N CYS 148.B O no hydrogen 2.842 N/A SER 160.B OG SER 147.B OG no hydrogen 2.723 N/A SER 160.B OG CYS 148.B O no hydrogen 3.237 N/A SER 161.B N THR 165.B O no hydrogen 3.292 N/A SER 161.B OG GLY 144.B O no hydrogen 2.704 N/A SER 161.B OG TYR 145.B O no hydrogen 3.445 N/A SER 161.B OG ASP 163.B OD1 no hydrogen 3.117 N/A GLY 162.B N TYR 145.B O no hydrogen 2.680 N/A THR 164.B OG1 ASP 163.B O no hydrogen 2.488 N/A THR 164.B OG1 HIS 183.B O no hydrogen 3.482 N/A THR 165.B N ASP 163.B OD1 no hydrogen 3.300 N/A THR 165.B OG1 ASP 163.B OD1 no hydrogen 2.534 N/A CYS 166.B N PHE 180.B O no hydrogen 2.989 N/A CYS 166.B SG SER 201.B OG no hydrogen 3.514 N/A ALA 167.B N THR 159.B O no hydrogen 3.090 N/A LEU 168.B N THR 178.B O no hydrogen 2.726 N/A TRP 169.B N ILE 157.B O no hydrogen 2.832 N/A TRP 169.B NE1 THR 159.B OG1 no hydrogen 2.589 N/A ASP 170.B N GLN 175.B O no hydrogen 2.963 N/A ILE 171.B N ASN 155.B O no hydrogen 2.742 N/A GLU 172.B N ASP 170.B OD1 no hydrogen 3.037 N/A THR 173.B N ASP 170.B OD1 no hydrogen 3.316 N/A GLY 174.B N ASP 170.B O no hydrogen 2.598 N/A GLN 175.B NE2 THR 173.B O no hydrogen 3.439 N/A THR 177.B N LEU 168.B O no hydrogen 2.955 N/A THR 178.B OG1 THR 177.B O no hydrogen 2.771 N/A PHE 180.B N CYS 166.B O no hydrogen 2.515 N/A HIS 183.B ND1 ASP 205.B OD2 no hydrogen 3.327 N/A THR 184.B N ASP 205.B OD2 no hydrogen 3.112 N/A THR 184.B OG1 ASP 205.B OD2 no hydrogen 3.010 N/A GLY 185.B N ASP 205.B OD2 no hydrogen 2.886 N/A MET 188.B N GLY 202.B O no hydrogen 2.642 N/A SER 189.B N GLY 202.B O no hydrogen 3.335 N/A SER 191.B N VAL 200.B O no hydrogen 3.385 N/A SER 191.B OG LEU 192.B O no hydrogen 3.502 N/A ALA 193.B N LEU 198.B O no hydrogen 2.922 N/A THR 196.B N ALA 193.B O no hydrogen 2.833 N/A ARG 197.B N ASP 195.B OD1 no hydrogen 3.402 N/A PHE 199.B N TRP 211.B O no hydrogen 3.325 N/A VAL 200.B N SER 191.B O no hydrogen 3.306 N/A SER 201.B N LYS 209.B O no hydrogen 3.065 N/A GLY 202.B N SER 189.B O no hydrogen 2.953 N/A CYS 204.B SG ASP 186.B O no hydrogen 3.262 N/A SER 207.B OG ASP 205.B OD1 no hydrogen 2.794 N/A ALA 208.B N PHE 222.B O no hydrogen 2.815 N/A LYS 209.B N SER 201.B O no hydrogen 3.290 N/A LEU 210.B N GLN 220.B O no hydrogen 2.798 N/A TRP 211.B N PHE 199.B O no hydrogen 3.089 N/A ASP 212.B N MET 217.B O no hydrogen 3.293 N/A VAL 213.B N ARG 197.B O no hydrogen 3.040 N/A ARG 214.B N ASP 212.B OD2 no hydrogen 2.811 N/A GLU 215.B N ASP 212.B OD2 no hydrogen 3.230 N/A GLY 216.B N ASP 212.B O no hydrogen 2.867 N/A CYS 218.B SG GLN 220.B O no hydrogen 3.523 N/A CYS 218.B SG THR 221.B OG1 no hydrogen 3.538 N/A ARG 219.B N LEU 210.B O no hydrogen 2.524 N/A ARG 219.B NE GLU 215.B OE1 no hydrogen 3.077 N/A PHE 222.B N ALA 208.B O no hydrogen 2.665 N/A HIS 225.B NE2 THR 243.B OG1 no hydrogen 2.564 N/A GLU 226.B N ASP 247.B OD2 no hydrogen 2.908 N/A ASP 228.B N SER 227.B OG no hydrogen 2.746 N/A ILE 229.B N ALA 203.B O no hydrogen 3.178 N/A ASN 230.B N GLY 244.B O no hydrogen 2.439 N/A ASN 230.B ND2 ASP 246.B OD1 no hydrogen 2.890 N/A ASN 230.B ND2 ILE 273.B O no hydrogen 3.143 N/A ALA 231.B N GLY 244.B O no hydrogen 3.120 N/A CYS 233.B N ALA 242.B O no hydrogen 3.317 N/A PHE 234.B N SER 191.B OG no hydrogen 2.906 N/A PHE 235.B N ALA 240.B O no hydrogen 2.796 N/A GLY 238.B N PHE 235.B O no hydrogen 2.908 N/A ASN 239.B N ASN 237.B OD1 no hydrogen 3.003 N/A PHE 241.B N PHE 253.B O no hydrogen 3.424 N/A ALA 242.B N CYS 233.B O no hydrogen 3.033 N/A THR 243.B N ARG 251.B O no hydrogen 2.968 N/A THR 243.B OG1 HIS 225.B NE2 no hydrogen 2.564 N/A THR 243.B OG1 ARG 251.B O no hydrogen 2.824 N/A GLY 244.B N ALA 231.B O no hydrogen 2.912 N/A SER 245.B OG SER 227.B O no hydrogen 2.775 N/A SER 245.B OG ASP 228.B O no hydrogen 2.692 N/A ASP 246.B N ASP 228.B O no hydrogen 3.030 N/A THR 249.B OG1 CYS 250.B O no hydrogen 3.466 N/A THR 249.B OG1 TYR 264.B O no hydrogen 2.879 N/A CYS 250.B N TYR 264.B O no hydrogen 2.835 N/A CYS 250.B SG THR 243.B O no hydrogen 3.661 N/A ARG 251.B N THR 243.B O no hydrogen 3.342 N/A ARG 251.B NE GLU 260.B OE1 no hydrogen 2.519 N/A LEU 252.B N MET 262.B O no hydrogen 3.186 N/A PHE 253.B N PHE 241.B O no hydrogen 2.848 N/A LEU 255.B N ASN 239.B O no hydrogen 3.176 N/A ASP 258.B N ASP 254.B O no hydrogen 3.034 N/A LEU 261.B N LEU 252.B O no hydrogen 2.880 N/A THR 263.B OG1 GLU 260.B OE2 no hydrogen 2.804 N/A TYR 264.B N CYS 250.B O no hydrogen 2.479 N/A TYR 264.B OH ALA 299.B O no hydrogen 2.774 N/A ILE 269.B N HIS 266.B O no hydrogen 3.365 N/A ILE 273.B N SER 245.B O no hydrogen 2.939 N/A THR 274.B N GLY 288.B O no hydrogen 2.521 N/A THR 274.B OG1 SER 275.B OG no hydrogen 3.387 N/A THR 274.B OG1 GLY 288.B O no hydrogen 3.108 N/A THR 274.B OG1 VAL 315.B O no hydrogen 2.417 N/A SER 275.B N GLY 288.B O no hydrogen 3.398 N/A SER 275.B OG THR 274.B OG1 no hydrogen 3.387 N/A SER 275.B OG SER 316.B O no hydrogen 3.281 N/A SER 277.B N LEU 286.B O no hydrogen 2.995 N/A SER 277.B OG PHE 278.B O no hydrogen 3.565 N/A LYS 280.B NZ ASP 322.B O no hydrogen 3.248 N/A GLY 282.B N SER 279.B OG no hydrogen 3.340 N/A ARG 283.B NE ASP 298.B OD1 no hydrogen 2.635 N/A ARG 283.B NH2 ASP 298.B OD1 no hydrogen 3.011 N/A ARG 283.B NH2 ASP 298.B OD2 no hydrogen 2.750 N/A LEU 285.B N TRP 297.B O no hydrogen 2.588 N/A LEU 286.B N SER 277.B O no hydrogen 3.060 N/A ALA 287.B N ASN 295.B O no hydrogen 3.159 N/A GLY 288.B N SER 275.B O no hydrogen 2.826 N/A TYR 289.B N ASN 293.B O no hydrogen 3.046 N/A ASP 290.B N GLY 272.B O no hydrogen 3.305 N/A ASN 293.B N ASP 291.B OD1 no hydrogen 3.178 N/A CYS 294.B N LEU 308.B O no hydrogen 3.233 N/A CYS 294.B SG ALA 287.B O no hydrogen 3.480 N/A ASN 295.B N ALA 287.B O no hydrogen 2.977 N/A VAL 296.B N GLY 306.B O no hydrogen 2.704 N/A TRP 297.B N LEU 285.B O no hydrogen 2.714 N/A TRP 297.B NE1 TYR 289.B OH no hydrogen 2.395 N/A ASP 298.B N ASP 303.B O no hydrogen 3.084 N/A ALA 299.B N ARG 283.B O no hydrogen 2.956 N/A ALA 302.B N ASP 298.B O no hydrogen 2.823 N/A ARG 304.B NH1 ASN 295.B OD1 no hydrogen 2.943 N/A ALA 305.B N VAL 296.B O no hydrogen 2.873 N/A LEU 308.B N CYS 294.B O no hydrogen 2.551 N/A ASP 312.B N ASP 333.B OD2 no hydrogen 3.265 N/A ASN 313.B ND2 TRP 332.B O no hydrogen 3.322 N/A ARG 314.B N ASN 313.B OD1 no hydrogen 2.759 N/A SER 316.B N GLY 330.B O no hydrogen 3.051 N/A SER 316.B OG ILE 58.B O no hydrogen 2.596 N/A GLY 319.B N ALA 328.B O no hydrogen 3.072 N/A THR 321.B N ALA 326.B O no hydrogen 3.250 N/A THR 321.B OG1 ASP 323.B OD2 no hydrogen 2.694 N/A GLY 324.B N THR 321.B O no hydrogen 3.093 N/A MET 325.B N THR 321.B OG1 no hydrogen 2.794 N/A VAL 327.B N TRP 339.B O no hydrogen 3.260 N/A ALA 328.B N GLY 319.B O no hydrogen 3.023 N/A THR 329.B N LYS 337.B O no hydrogen 2.876 N/A SER 331.B OG ASN 313.B O no hydrogen 2.727 N/A SER 331.B OG ARG 314.B O no hydrogen 2.643 N/A SER 331.B OG ASP 333.B OD1 no hydrogen 3.399 N/A TRP 332.B N ARG 314.B O no hydrogen 2.707 N/A SER 334.B OG HIS 54.B O no hydrogen 3.261 N/A SER 334.B OG ASP 333.B O no hydrogen 2.662 N/A PHE 335.B N ASP 333.B OD1 no hydrogen 3.360 N/A LEU 336.B N LEU 51.B O no hydrogen 3.138 N/A LYS 337.B N THR 329.B O no hydrogen 3.171 N/A ILE 338.B N ARG 49.B O no hydrogen 2.748 N/A TRP 339.B N VAL 327.B O no hydrogen 2.965 N/A