Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gys_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N THR 3.A OG1 no hydrogen 3.255 N/A GLN 7.A N THR 3.A O no hydrogen 2.777 N/A THR 8.A N ILE 4.A O no hydrogen 3.155 N/A LEU 9.A N PRO 5.A O no hydrogen 3.137 N/A ARG 10.A N ARG 22.A O no hydrogen 3.069 N/A ARG 10.A NE LEU 9.A O no hydrogen 3.098 N/A ARG 10.A NH2 GLN 7.A O no hydrogen 2.864 N/A TYR 12.A N THR 20.A O no hydrogen 2.746 N/A ASP 14.A N HIS 18.A O no hydrogen 3.189 N/A TYR 15.A N ASN 13.A OD1 no hydrogen 2.886 N/A THR 16.A N ASP 14.A OD1 no hydrogen 2.791 N/A THR 16.A OG1 ASP 14.A O no hydrogen 2.795 N/A SER 17.A N ASP 14.A OD1 no hydrogen 2.671 N/A SER 17.A OG ASP 14.A OD2 no hydrogen 3.036 N/A HIS 18.A N ASP 14.A OD1 no hydrogen 3.188 N/A ILE 19.A N ILE 74.A O no hydrogen 2.857 N/A THR 20.A N TYR 12.A O no hydrogen 2.750 N/A CYS 21.A N CYS 72.A O no hydrogen 3.113 N/A ARG 22.A N ARG 10.A O no hydrogen 2.894 N/A ARG 22.A NH1 SER 54.A OG no hydrogen 3.213 N/A TRP 23.A N ARG 70.A O no hydrogen 3.312 N/A ASP 25.A N VAL 68.A O no hydrogen 3.388 N/A GLN 27.A N ARG 66.A O no hydrogen 3.005 N/A ALA 29.A N THR 26.A OG1 no hydrogen 3.185 N/A GLN 30.A N THR 26.A O no hydrogen 3.024 N/A ARG 31.A N ASP 28.A O no hydrogen 3.382 N/A LEU 32.A N ALA 29.A O no hydrogen 2.851 N/A VAL 33.A N ALA 29.A O no hydrogen 2.772 N/A ASN 34.A N ASP 92.A OD2 no hydrogen 2.579 N/A ASN 34.A ND2 GLN 30.A OE1 no hydrogen 3.634 N/A THR 36.A N GLN 90.A O no hydrogen 2.750 N/A ILE 38.A N SER 88.A O no hydrogen 2.875 N/A ARG 39.A N GLU 47.A O no hydrogen 2.985 N/A ARG 39.A NE GLU 47.A OE2 no hydrogen 3.417 N/A ARG 39.A NH1 ASP 85.A OD1 no hydrogen 2.904 N/A ARG 40.A N TYR 86.A O no hydrogen 3.040 N/A ASN 42.A N LEU 45.A O no hydrogen 3.319 N/A LEU 45.A N ASN 42.A O no hydrogen 2.733 N/A GLU 47.A N ARG 39.A O no hydrogen 2.797 N/A VAL 49.A N LEU 37.A O no hydrogen 2.995 N/A CYS 51.A SG VAL 49.A O no hydrogen 3.950 N/A ASP 52.A N ARG 71.A O no hydrogen 3.064 N/A SER 54.A N PRO 69.A O no hydrogen 2.791 N/A SER 54.A OG ASP 56.A O no hydrogen 3.393 N/A ASP 56.A N SER 54.A OG no hydrogen 2.907 N/A SER 60.A OG THR 8.A O no hydrogen 2.746 N/A HIS 64.A NE2 ASP 28.A OD1 no hydrogen 2.839 N/A ARG 66.A NH1 ASP 28.A OD1 no hydrogen 2.796 N/A CYS 67.A SG HIS 64.A O no hydrogen 3.876 N/A VAL 68.A N ASP 25.A O no hydrogen 2.870 N/A ARG 70.A N TRP 23.A O no hydrogen 2.742 N/A ARG 70.A NE VAL 68.A O no hydrogen 3.299 N/A ARG 71.A N ASP 52.A O no hydrogen 2.825 N/A CYS 72.A N CYS 21.A O no hydrogen 2.910 N/A CYS 72.A SG CYS 21.A O no hydrogen 3.764 N/A ILE 74.A N ILE 19.A O no hydrogen 2.709 N/A CYS 76.A N SER 17.A O no hydrogen 2.738 N/A CYS 76.A SG ILE 74.A O no hydrogen 3.854 N/A GLN 77.A N GLN 77.A OE1 no hydrogen 2.233 N/A VAL 80.A N ASP 83.A OD2 no hydrogen 3.341 N/A ASP 83.A N VAL 80.A O no hydrogen 2.878 N/A SER 88.A N ILE 38.A O no hydrogen 3.031 N/A GLN 90.A N THR 36.A O no hydrogen 2.832 N/A ASP 92.A N ASN 34.A O no hydrogen 2.949 N/A ARG 93.A NH1 LEU 32.A O no hydrogen 3.099 N/A ARG 93.A NH1 ASP 92.A OD1 no hydrogen 2.713 N/A ARG 93.A NH2 LEU 32.A O no hydrogen 2.889 N/A GLN 105.A N THR 102.A O no hydrogen 2.809 N/A HIS 106.A N LEU 103.A O no hydrogen 3.052 N/A VAL 107.A N SER 194.A O no hydrogen 2.904 N/A ARG 113.A N SER 129.A O no hydrogen 2.586 N/A ARG 113.A NE SER 129.A OG no hydrogen 3.095 N/A GLN 116.A N THR 127.A O no hydrogen 2.895 N/A SER 118.A N LEU 125.A O no hydrogen 2.793 N/A ASP 120.A N HIS 123.A O no hydrogen 2.768 N/A HIS 123.A N ASP 120.A O no hydrogen 2.682 N/A PHE 124.A N LEU 168.A O no hydrogen 2.858 N/A LEU 125.A N SER 118.A O no hydrogen 2.812 N/A LEU 126.A N ALA 166.A O no hydrogen 2.827 N/A THR 127.A N GLN 116.A O no hydrogen 2.807 N/A TRP 128.A N SER 164.A O no hydrogen 3.298 N/A SER 129.A N ARG 113.A O no hydrogen 2.819 N/A SER 136.A N ASP 139.A OD2 no hydrogen 2.756 N/A ASP 139.A N SER 136.A O no hydrogen 2.818 N/A LEU 140.A N PRO 137.A O no hydrogen 3.077 N/A GLU 141.A N ARG 186.A O no hydrogen 2.844 N/A PHE 142.A N SER 161.A O no hydrogen 2.726 N/A GLU 143.A N ARG 184.A O no hydrogen 3.087 N/A VAL 144.A N LEU 159.A O no hydrogen 2.759 N/A VAL 145.A N ARG 182.A O no hydrogen 3.089 N/A TYR 146.A N ALA 157.A O no hydrogen 3.343 N/A LYS 147.A N VAL 180.A O no hydrogen 3.047 N/A LYS 147.A NZ ARG 148.A O no hydrogen 3.106 N/A LYS 147.A NZ ASP 151.A O no hydrogen 2.936 N/A ARG 148.A NE ASP 151.A OD1 no hydrogen 3.426 N/A ARG 148.A NE ASP 151.A OD2 no hydrogen 3.042 N/A ARG 148.A NH1 GLU 234.A OE1 no hydrogen 2.602 N/A ARG 148.A NH1 GLU 234.A OE2 no hydrogen 3.139 N/A ARG 148.A NH2 ASP 151.A OD1 no hydrogen 3.050 N/A ARG 148.A NH2 GLU 234.A OE2 no hydrogen 2.773 N/A LEU 149.A N THR 178.A O no hydrogen 2.754 N/A ASP 151.A N ARG 148.A O no hydrogen 3.025 N/A GLU 154.A N SER 152.A OG no hydrogen 2.676 N/A ALA 156.A N TRP 153.A O no hydrogen 3.120 N/A LEU 159.A N VAL 144.A O no hydrogen 2.688 N/A SER 161.A N PHE 142.A O no hydrogen 2.836 N/A SER 161.A OG THR 163.A O no hydrogen 2.587 N/A SER 161.A OG GLN 165.A O no hydrogen 3.017 N/A THR 163.A N SER 161.A OG no hydrogen 2.845 N/A THR 163.A OG1 SER 161.A OG no hydrogen 3.399 N/A SER 164.A OG TRP 128.A O no hydrogen 3.315 N/A ALA 166.A N LEU 126.A O no hydrogen 2.981 N/A LEU 168.A N PHE 124.A O no hydrogen 2.806 N/A GLU 171.A N GLU 171.A OE2 no hydrogen 2.795 N/A HIS 172.A N GLY 169.A O no hydrogen 2.646 N/A HIS 172.A ND1 TYR 146.A OH no hydrogen 3.074 N/A MET 174.A N TYR 179.A OH no hydrogen 2.767 N/A SER 176.A N GLN 209.A O no hydrogen 2.762 N/A SER 177.A N SER 208.A OG no hydrogen 3.062 N/A SER 177.A OG MET 174.A O no hydrogen 2.945 N/A SER 177.A OG PRO 175.A O no hydrogen 2.654 N/A THR 178.A OG1 ASP 207.A OD1 no hydrogen 2.288 N/A TYR 179.A N TRP 206.A O no hydrogen 2.741 N/A VAL 180.A N LYS 147.A O no hydrogen 2.864 N/A ALA 181.A N VAL 204.A O no hydrogen 2.824 N/A ARG 182.A N VAL 145.A O no hydrogen 3.105 N/A VAL 183.A N SER 201.A OG no hydrogen 2.736 N/A ARG 184.A N GLU 143.A O no hydrogen 3.131 N/A ARG 184.A NE GLU 143.A OE1 no hydrogen 3.005 N/A ARG 184.A NH2 GLU 143.A OE1 no hydrogen 2.955 N/A THR 185.A N SER 198.A OG no hydrogen 2.607 N/A THR 185.A OG1 PRO 110.A O no hydrogen 2.776 N/A ARG 186.A N GLU 141.A O no hydrogen 2.712 N/A ALA 188.A N ASP 139.A O no hydrogen 2.583 N/A SER 191.A N ALA 188.A O no hydrogen 2.762 N/A SER 191.A OG ASP 139.A OD1 no hydrogen 3.318 N/A LEU 193.A N SER 191.A OG no hydrogen 2.971 N/A SER 194.A N THR 104.A O no hydrogen 2.804 N/A ARG 196.A N VAL 107.A O no hydrogen 3.024 N/A ARG 196.A NE GLN 108.A OE1 no hydrogen 2.680 N/A ARG 196.A NH2 GLN 108.A OE1 no hydrogen 3.094 N/A SER 198.A N THR 185.A O no hydrogen 2.758 N/A SER 198.A OG THR 185.A O no hydrogen 3.449 N/A SER 198.A OG LYS 199.A O no hydrogen 3.185 N/A LYS 199.A NZ GLU 111.A OE2 no hydrogen 2.517 N/A SER 201.A N VAL 183.A O no hydrogen 2.732 N/A SER 201.A OG VAL 183.A O no hydrogen 3.080 N/A SER 201.A OG PRO 202.A O no hydrogen 3.037 N/A VAL 204.A N ALA 181.A O no hydrogen 2.863 N/A TRP 206.A N TYR 179.A O no hydrogen 2.950 N/A SER 208.A N SER 177.A O no hydrogen 2.884 N/A SER 208.A OG MET 174.A O no hydrogen 2.508 N/A SER 208.A OG SER 177.A O no hydrogen 3.172 N/A GLY 211.A N SER 176.A OG no hydrogen 2.736 N/A GLU 213.A N GLY 211.A O no hydrogen 3.158 N/A GLN 215.A N ASP 212.A O no hydrogen 2.927 N/A GLN 215.A NE2 ASP 212.A OD2 no hydrogen 2.875 N/A GLN 217.A N GLU 234.A O no hydrogen 2.961 N/A GLN 217.A NE2 GLU 234.A OE1 no hydrogen 2.908 N/A ASN 218.A ND2 GLU 234.A OE2 no hydrogen 2.854 N/A GLU 220.A N SER 232.A O no hydrogen 2.714 N/A PHE 222.A N SER 230.A O no hydrogen 2.948 N/A ASP 224.A N VAL 228.A O no hydrogen 3.102 N/A ALA 226.A N ASP 224.A OD1 no hydrogen 2.967 N/A ALA 227.A N ASP 224.A OD1 no hydrogen 3.226 N/A VAL 228.A N ASP 224.A OD1 no hydrogen 3.173 N/A LEU 229.A N ILE 280.A O no hydrogen 2.690 N/A SER 230.A N PHE 222.A O no hydrogen 2.963 N/A CYS 231.A N CYS 278.A O no hydrogen 2.784 N/A CYS 231.A SG LEU 229.A O no hydrogen 3.730 N/A SER 232.A N GLU 220.A O no hydrogen 2.802 N/A TRP 233.A N HIS 276.A O no hydrogen 3.282 N/A GLU 234.A N GLN 217.A O no hydrogen 2.881 N/A VAL 235.A N THR 274.A O no hydrogen 3.098 N/A ARG 236.A NE GLU 238.A OE1 no hydrogen 2.953 N/A ARG 236.A NH2 GLU 238.A OE2 no hydrogen 2.650 N/A LYS 237.A N LEU 272.A O no hydrogen 2.708 N/A LYS 237.A NZ GLY 270.A O no hydrogen 3.494 N/A GLU 238.A N GLU 238.A OE1 no hydrogen 2.768 N/A ALA 240.A N ARG 236.A O no hydrogen 2.695 N/A SER 241.A N LYS 237.A O no hydrogen 2.971 N/A SER 241.A N GLU 238.A O no hydrogen 3.058 N/A SER 241.A OG LYS 237.A O no hydrogen 3.460 N/A SER 241.A OG GLU 238.A O no hydrogen 2.420 N/A SER 242.A N VAL 239.A O no hydrogen 2.623 N/A VAL 243.A N VAL 239.A O no hydrogen 2.814 N/A GLY 246.A N GLN 296.A O no hydrogen 2.718 N/A PHE 248.A N SER 294.A O no hydrogen 2.757 N/A TYR 249.A N GLU 259.A O no hydrogen 2.916 N/A LYS 250.A N ILE 292.A O no hydrogen 3.094 N/A ARG 257.A NE GLU 258.A O no hydrogen 3.429 N/A GLU 259.A N TYR 249.A O no hydrogen 2.761 N/A GLU 260.A N GLU 259.A OE2 no hydrogen 3.030 N/A CYS 261.A N LEU 247.A O no hydrogen 2.975 N/A CYS 261.A SG GLN 279.A O no hydrogen 3.185 N/A LEU 265.A N HIS 277.A O no hydrogen 3.021 N/A GLU 267.A N ARG 275.A O no hydrogen 2.789 N/A THR 274.A N VAL 235.A O no hydrogen 2.929 N/A THR 274.A OG1 VAL 235.A O no hydrogen 3.546 N/A ARG 275.A N GLU 267.A O no hydrogen 2.759 N/A HIS 276.A N TRP 233.A O no hydrogen 2.983 N/A HIS 277.A N LEU 265.A O no hydrogen 2.660 N/A CYS 278.A N CYS 231.A O no hydrogen 2.810 N/A CYS 278.A SG PRO 263.A O no hydrogen 3.531 N/A ILE 280.A N LEU 229.A O no hydrogen 3.161 N/A VAL 282.A N ALA 227.A O no hydrogen 2.840 N/A THR 287.A N ASP 284.A O no hydrogen 2.954 N/A THR 287.A OG1 ASP 284.A O no hydrogen 3.208 N/A HIS 288.A N ASP 284.A O no hydrogen 3.077 N/A ILE 292.A N LYS 250.A O no hydrogen 2.876 N/A SER 294.A N PHE 248.A O no hydrogen 2.765 N/A GLN 296.A N GLY 246.A O no hydrogen 3.091 N/A ARG 298.A N SER 244.A O no hydrogen 3.093 N/A ARG 298.A NH1 GLU 260.A OE2 no hydrogen 2.674 N/A VAL 308.A N LYS 305.A O no hydrogen 3.211 N/A ASN 309.A N SER 306.A O no hydrogen 3.022 N/A ILE 310.A N ASN 383.A O no hydrogen 3.091 N/A SER 316.A N GLU 328.A O no hydrogen 3.143 N/A SER 316.A OG GLU 328.A O no hydrogen 3.398 N/A GLN 318.A N ARG 326.A O no hydrogen 3.058 N/A THR 320.A N SER 324.A O no hydrogen 3.301 N/A SER 324.A N THR 320.A O no hydrogen 3.190 N/A LEU 325.A N MET 358.A O no hydrogen 2.657 N/A ARG 326.A N GLN 318.A O no hydrogen 3.511 N/A TRP 327.A N HIS 356.A O no hydrogen 2.778 N/A TRP 327.A NE1 ALA 355.A O no hydrogen 2.988 N/A GLU 328.A N SER 316.A O no hydrogen 3.155 N/A THR 332.A N ARG 376.A O no hydrogen 3.039 N/A PHE 333.A N LEU 352.A O no hydrogen 2.858 N/A GLU 334.A N ARG 374.A O no hydrogen 3.038 N/A ILE 335.A N GLU 350.A O no hydrogen 2.669 N/A GLN 336.A N ARG 372.A O no hydrogen 2.818 N/A ARG 338.A N TRP 370.A O no hydrogen 2.855 N/A ARG 338.A NE THR 343.A O no hydrogen 3.377 N/A TRP 344.A N THR 343.A OG1 no hydrogen 2.283 N/A GLU 350.A N ILE 335.A O no hydrogen 3.056 N/A LEU 352.A N PHE 333.A O no hydrogen 2.672 N/A ASN 354.A N HIS 331.A O no hydrogen 2.916 N/A MET 358.A N LEU 325.A O no hydrogen 2.590 N/A LEU 360.A N TYR 323.A O no hydrogen 3.276 N/A TRP 370.A N ARG 338.A O no hydrogen 3.426 N/A ARG 372.A N GLN 336.A O no hydrogen 2.848 N/A ARG 372.A NH1 GLN 336.A OE1 no hydrogen 2.750 N/A VAL 373.A N SER 390.A OG no hydrogen 3.411 N/A ARG 374.A N GLU 334.A O no hydrogen 3.025 N/A VAL 375.A N SER 387.A OG no hydrogen 3.120 N/A ARG 376.A N THR 332.A O no hydrogen 3.172 N/A SER 378.A N ASP 330.A O no hydrogen 2.974 N/A SER 378.A OG ASP 330.A O no hydrogen 2.872 N/A TYR 382.A N ARG 379.A O no hydrogen 2.796 N/A ASN 383.A N SER 307.A O no hydrogen 3.414 N/A ILE 385.A N ILE 310.A O no hydrogen 3.097 N/A SER 387.A N VAL 375.A O no hydrogen 2.866 N/A SER 387.A OG GLU 388.A O no hydrogen 2.555 N/A SER 390.A N VAL 373.A O no hydrogen 2.878 N/A SER 390.A OG GLU 391.A O no hydrogen 3.029 N/A ARG 393.A N ALA 371.A O no hydrogen 3.143 N/A THR 397.A N THR 367.A O no hydrogen 2.694 N/A