Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ay9_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG HIS 51.A NE2 no hydrogen 3.678 N/A GLY 6.A N VAL 306.A O no hydrogen 2.766 N/A VAL 7.A N GLN 283.A OE1 no hydrogen 2.900 N/A VAL 8.A N ILE 304.A O no hydrogen 2.999 N/A SER 9.A OG SER 303.A OG no hydrogen 2.460 N/A ILE 10.A N ILE 302.A O no hydrogen 2.774 N/A GLN 11.A NE2 ARG 14.A O no hydrogen 2.800 N/A ARG 14.A N GLN 11.A O no hydrogen 3.406 N/A ARG 14.A NE LYS 299.A O no hydrogen 3.207 N/A GLU 18.A N ASN 301.A OD1 no hydrogen 2.779 N/A ASP 19.A N ASN 301.A OD1 no hydrogen 3.296 N/A ALA 20.A N TYR 56.A O no hydrogen 2.776 N/A ALA 22.A N GLY 54.A O no hydrogen 2.887 N/A SER 24.A N PHE 52.A O no hydrogen 2.840 N/A HIS 26.A N HIS 51.A ND1 no hydrogen 2.856 N/A LEU 28.A N GLY 50.A O no hydrogen 3.228 N/A LYS 29.A NZ PHE 27.A O no hydrogen 3.429 N/A LEU 30.A N LEU 48.A O no hydrogen 2.908 N/A ILE 32.A N THR 46.A O no hydrogen 3.172 N/A MET 34.A N PRO 31.A O no hydrogen 2.731 N/A LEU 35.A N ILE 32.A O no hydrogen 2.958 N/A SER 42.A OG MET 41.A O no hydrogen 2.828 N/A LEU 45.A N SER 42.A O no hydrogen 3.263 N/A HIS 47.A ND1 LYS 29.A O no hydrogen 2.575 N/A LEU 48.A N LEU 30.A O no hydrogen 2.715 N/A GLY 50.A N LEU 28.A O no hydrogen 2.882 N/A HIS 51.A N VAL 142.A O no hydrogen 2.816 N/A PHE 52.A N SER 24.A O no hydrogen 3.022 N/A PHE 53.A N ALA 140.A O no hydrogen 2.899 N/A GLY 54.A N ALA 22.A O no hydrogen 2.918 N/A VAL 55.A N VAL 138.A O no hydrogen 2.898 N/A TYR 56.A N ALA 20.A O no hydrogen 2.680 N/A ASP 57.A N THR 136.A OG1 no hydrogen 2.838 N/A GLY 58.A N GLU 18.A O no hydrogen 2.919 N/A HIS 59.A N GLY 134.A O no hydrogen 2.930 N/A HIS 59.A NE2 ASP 210.A OD1 no hydrogen 2.877 N/A HIS 59.A NE2 ASP 210.A OD2 no hydrogen 2.509 N/A ASP 66.A N HIS 62.A O no hydrogen 2.901 N/A TYR 67.A N LYS 63.A O no hydrogen 2.990 N/A TYR 67.A OH GLU 108.A OE1 no hydrogen 2.409 N/A CYS 68.A N VAL 64.A O no hydrogen 2.961 N/A CYS 68.A SG VAL 64.A O no hydrogen 3.507 N/A ARG 69.A N ALA 65.A O no hydrogen 2.901 N/A ARG 69.A NE ASP 70.A OD1 no hydrogen 3.049 N/A ASP 70.A N ASP 66.A O no hydrogen 2.983 N/A ARG 71.A N TYR 67.A O no hydrogen 2.739 N/A ARG 71.A NE GLU 108.A OE1 no hydrogen 3.328 N/A ARG 71.A NE GLU 108.A OE2 no hydrogen 3.477 N/A ARG 71.A NH1 GLU 78.A OE2 no hydrogen 2.906 N/A ARG 71.A NH2 GLU 78.A OE1 no hydrogen 2.991 N/A ARG 71.A NH2 GLU 108.A OE2 no hydrogen 3.070 N/A LEU 72.A N CYS 68.A O no hydrogen 2.917 N/A ALA 75.A N ARG 71.A O no hydrogen 2.980 N/A LEU 76.A N LEU 72.A O no hydrogen 2.949 N/A ALA 77.A N HIS 73.A O no hydrogen 2.938 N/A GLU 78.A N PHE 74.A O no hydrogen 2.944 N/A GLU 79.A N ALA 75.A O no hydrogen 3.045 N/A ILE 80.A N LEU 76.A O no hydrogen 3.024 N/A GLU 81.A N ALA 77.A O no hydrogen 2.963 N/A ARG 82.A N GLU 78.A O no hydrogen 3.058 N/A LYS 84.A N ILE 80.A O no hydrogen 3.207 N/A LYS 84.A N GLU 81.A O no hydrogen 3.260 N/A LYS 84.A NZ LYS 29.A O no hydrogen 3.248 N/A ASP 85.A N ARG 82.A O no hydrogen 3.461 N/A GLU 86.A N ILE 83.A O no hydrogen 3.170 N/A GLN 91.A NE2 VAL 223.A O no hydrogen 3.499 N/A GLN 93.A N GLY 89.A O no hydrogen 2.652 N/A TRP 94.A N ARG 90.A O no hydrogen 2.783 N/A TRP 94.A NE1 MET 34.A O no hydrogen 3.103 N/A ASP 95.A N GLN 91.A O no hydrogen 2.845 N/A LYS 96.A N VAL 92.A O no hydrogen 2.872 N/A VAL 97.A N GLN 93.A O no hydrogen 3.063 N/A PHE 98.A N TRP 94.A O no hydrogen 2.986 N/A THR 99.A N ASP 95.A O no hydrogen 2.902 N/A THR 99.A OG1 ASP 95.A O no hydrogen 2.756 N/A SER 100.A N LYS 96.A O no hydrogen 2.711 N/A SER 100.A OG GLU 79.A OE1 no hydrogen 2.576 N/A CYS 101.A N VAL 97.A O no hydrogen 2.888 N/A CYS 101.A SG LEU 72.A O no hydrogen 4.006 N/A PHE 102.A N PHE 98.A O no hydrogen 3.003 N/A LEU 103.A N THR 99.A O no hydrogen 3.000 N/A THR 104.A N SER 100.A O no hydrogen 2.694 N/A THR 104.A OG1 SER 100.A O no hydrogen 2.854 N/A VAL 105.A N CYS 101.A O no hydrogen 3.011 N/A ASP 106.A N PHE 102.A O no hydrogen 2.778 N/A GLY 107.A N LEU 103.A O no hydrogen 3.015 N/A GLU 108.A N THR 104.A O no hydrogen 3.090 N/A ILE 109.A N VAL 105.A O no hydrogen 2.916 N/A GLU 110.A N ASP 106.A O no hydrogen 2.964 N/A GLY 111.A N GLU 108.A O no hydrogen 3.144 N/A LYS 112.A N GLY 107.A O no hydrogen 2.912 N/A LYS 112.A NZ GLU 110.A OE1 no hydrogen 2.844 N/A ILE 113.A N GLY 107.A O no hydrogen 3.297 N/A ARG 115.A N VAL 124.A O no hydrogen 2.448 N/A VAL 128.A N ILE 109.A O no hydrogen 2.825 N/A SER 130.A OG THR 132.A OG1 no hydrogen 3.096 N/A THR 132.A N SER 130.A OG no hydrogen 3.318 N/A THR 132.A OG1 SER 130.A OG no hydrogen 3.096 N/A GLY 134.A N HIS 59.A O no hydrogen 2.941 N/A SER 135.A OG THR 136.A O no hydrogen 2.724 N/A THR 136.A N ASP 57.A O no hydrogen 3.122 N/A THR 136.A OG1 SER 155.A OG no hydrogen 2.838 N/A ALA 137.A N CYS 152.A O no hydrogen 2.933 N/A VAL 138.A N VAL 55.A O no hydrogen 3.027 N/A VAL 139.A N SER 150.A O no hydrogen 3.087 N/A ALA 140.A N PHE 53.A O no hydrogen 2.579 N/A LEU 141.A N VAL 148.A O no hydrogen 2.833 N/A VAL 142.A N HIS 51.A O no hydrogen 3.037 N/A CYS 143.A N HIS 146.A O no hydrogen 3.097 N/A CYS 143.A SG HIS 146.A O no hydrogen 3.513 N/A SER 145.A OG HIS 146.A ND1 no hydrogen 2.541 N/A HIS 146.A ND1 SER 145.A OG no hydrogen 2.541 N/A ILE 147.A N MET 226.A O no hydrogen 2.798 N/A VAL 148.A N LEU 141.A O no hydrogen 2.854 N/A VAL 149.A N THR 224.A O no hydrogen 2.837 N/A SER 150.A N VAL 139.A O no hydrogen 3.005 N/A ASN 151.A N GLU 222.A O no hydrogen 2.716 N/A ASN 151.A ND2 GLY 153.A O no hydrogen 3.201 N/A CYS 152.A N ALA 137.A O no hydrogen 2.911 N/A GLY 153.A N HIS 172.A ND1 no hydrogen 3.027 N/A SER 155.A OG THR 136.A OG1 no hydrogen 2.838 N/A ARG 156.A N ALA 238.A O no hydrogen 3.056 N/A ARG 156.A NE ASP 171.A OD1 no hydrogen 3.145 N/A ARG 156.A NH1 ASN 248.A OD1 no hydrogen 2.659 N/A ARG 156.A NH2 ASP 171.A OD2 no hydrogen 2.716 N/A ALA 157.A N SER 169.A OG no hydrogen 3.291 N/A VAL 158.A N ILE 236.A O no hydrogen 2.970 N/A LEU 159.A N MET 166.A O no hydrogen 2.780 N/A PHE 160.A N CYS 234.A O no hydrogen 2.774 N/A ARG 161.A N GLU 164.A O no hydrogen 3.167 N/A ARG 161.A NE ASP 232.A OD1 no hydrogen 2.530 N/A ARG 161.A NH2 PRO 227.A O no hydrogen 2.751 N/A ARG 161.A NH2 ASP 232.A OD2 no hydrogen 3.254 N/A GLY 162.A N GLU 231.A O no hydrogen 2.808 N/A GLU 164.A N ARG 161.A O no hydrogen 2.878 N/A ALA 165.A N GLN 249.A OE1 no hydrogen 3.389 N/A MET 166.A N LEU 159.A O no hydrogen 2.690 N/A LEU 168.A N ALA 157.A O no hydrogen 2.566 N/A HIS 172.A N GLY 153.A O no hydrogen 2.906 N/A LYS 173.A NZ ASP 154.A OD2 no hydrogen 3.555 N/A LYS 173.A NZ ALA 203.A O no hydrogen 3.516 N/A ARG 176.A N LYS 173.A O no hydrogen 3.305 N/A ARG 176.A NE ASP 178.A OD1 no hydrogen 2.794 N/A ARG 176.A NH1 VAL 170.A O no hydrogen 3.489 N/A ARG 176.A NH1 ASP 171.A O no hydrogen 2.692 N/A ARG 176.A NH2 ASP 178.A OD2 no hydrogen 2.890 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.826 N/A TYR 180.A N ARG 176.A O no hydrogen 2.755 N/A ALA 181.A N GLU 177.A O no hydrogen 3.069 N/A ARG 182.A N ASP 178.A O no hydrogen 3.040 N/A ARG 182.A NE GLU 179.A OE2 no hydrogen 2.874 N/A ARG 182.A NH1 TYR 216.A O no hydrogen 3.102 N/A ARG 182.A NH2 GLU 179.A OE1 no hydrogen 3.191 N/A ARG 182.A NH2 TYR 216.A O no hydrogen 3.197 N/A ILE 183.A N GLU 179.A O no hydrogen 2.906 N/A GLU 184.A N TYR 180.A O no hydrogen 3.136 N/A ASN 185.A N ALA 181.A O no hydrogen 2.780 N/A ASN 185.A ND2 ALA 181.A O no hydrogen 3.424 N/A GLY 187.A N GLU 184.A O no hydrogen 2.844 N/A GLY 188.A N ILE 183.A O no hydrogen 2.730 N/A ILE 191.A N ARG 197.A O no hydrogen 3.001 N/A TRP 193.A N GLY 195.A O no hydrogen 3.040 N/A ARG 197.A N ILE 191.A O no hydrogen 2.847 N/A ARG 197.A NE TRP 193.A O no hydrogen 3.143 N/A ARG 197.A NE GLN 194.A O no hydrogen 3.245 N/A ARG 197.A NH1 VAL 201.A O no hydrogen 2.818 N/A ARG 197.A NH2 GLN 194.A O no hydrogen 3.365 N/A VAL 198.A N LEU 202.A O no hydrogen 2.843 N/A PHE 199.A N LYS 189.A O no hydrogen 2.726 N/A GLY 200.A N ARG 197.A O no hydrogen 3.044 N/A VAL 201.A N VAL 198.A O no hydrogen 2.808 N/A SER 205.A N HIS 172.A O no hydrogen 2.779 N/A SER 205.A OG GLU 179.A OE1 no hydrogen 2.182 N/A ARG 206.A NE GLU 179.A OE1 no hydrogen 3.078 N/A ARG 206.A NE GLU 179.A OE2 no hydrogen 3.402 N/A ARG 206.A NH1 GLU 220.A O no hydrogen 2.812 N/A ARG 206.A NH2 GLU 179.A OE2 no hydrogen 2.910 N/A SER 207.A N ILE 218.A O no hydrogen 3.044 N/A SER 207.A OG ASP 210.A OD2 no hydrogen 2.598 N/A ILE 208.A N SER 135.A O no hydrogen 2.796 N/A GLY 209.A N ASP 106.A OD1 no hydrogen 2.748 N/A ASP 210.A N VAL 133.A O no hydrogen 2.778 N/A ARG 211.A NH2 GLU 131.A OE2 no hydrogen 2.812 N/A TYR 212.A N GLU 131.A O no hydrogen 3.341 N/A LEU 213.A N ASP 210.A O no hydrogen 3.272 N/A LYS 214.A N ARG 211.A O no hydrogen 3.040 N/A LYS 214.A NZ GLU 110.A OE1 no hydrogen 2.922 N/A TYR 216.A N LEU 213.A O no hydrogen 2.913 N/A VAL 217.A N LEU 213.A O no hydrogen 2.860 N/A GLU 222.A N ASN 151.A O no hydrogen 2.820 N/A THR 224.A N VAL 149.A O no hydrogen 2.765 N/A THR 224.A OG1 LEU 168.A O no hydrogen 3.159 N/A MET 226.A N ILE 147.A O no hydrogen 2.767 N/A ARG 228.A N SER 145.A O no hydrogen 3.220 N/A ARG 228.A NH1 CYS 143.A O no hydrogen 3.374 N/A ARG 228.A NH2 LEU 309.A O no hydrogen 2.978 N/A SER 229.A N ASP 232.A OD2 no hydrogen 2.902 N/A GLU 231.A N SER 229.A OG no hydrogen 2.994 N/A ASP 232.A N SER 229.A O no hydrogen 2.861 N/A GLU 233.A N PHE 160.A O no hydrogen 2.702 N/A CYS 234.A N PHE 160.A O no hydrogen 3.374 N/A LEU 235.A N ILE 307.A O no hydrogen 2.952 N/A ILE 236.A N VAL 158.A O no hydrogen 2.953 N/A LEU 237.A N ILE 305.A O no hydrogen 3.023 N/A ALA 238.A N ARG 156.A O no hydrogen 3.089 N/A SER 239.A N SER 303.A O no hydrogen 3.210 N/A SER 239.A OG ASP 19.A OD2 no hydrogen 2.770 N/A LEU 242.A N SER 239.A O no hydrogen 3.188 N/A TRP 243.A NE1 ALA 238.A O no hydrogen 3.180 N/A ASP 244.A N ASP 240.A O no hydrogen 2.893 N/A VAL 245.A N LEU 242.A O no hydrogen 2.892 N/A GLN 249.A NE2 LYS 163.A O no hydrogen 2.904 N/A GLN 249.A NE2 GLU 253.A OE2 no hydrogen 2.789 N/A GLU 250.A N ASN 247.A OD1 no hydrogen 2.912 N/A VAL 251.A N ASN 247.A O no hydrogen 2.866 N/A CYS 252.A N ASN 248.A O no hydrogen 3.142 N/A CYS 252.A SG ASN 248.A O no hydrogen 3.759 N/A GLU 253.A N GLN 249.A O no hydrogen 3.053 N/A ILE 254.A N GLU 250.A O no hydrogen 2.903 N/A ALA 255.A N VAL 251.A O no hydrogen 2.966 N/A ARG 256.A N CYS 252.A O no hydrogen 3.136 N/A ARG 256.A NE GLU 233.A OE2 no hydrogen 2.886 N/A ARG 257.A N GLU 253.A O no hydrogen 2.718 N/A ARG 258.A N ILE 254.A O no hydrogen 2.881 N/A ARG 258.A N ALA 255.A O no hydrogen 3.072 N/A ILE 259.A N ALA 255.A O no hydrogen 2.972 N/A LEU 260.A N ARG 256.A O no hydrogen 2.853 N/A MET 261.A N ARG 257.A O no hydrogen 2.854 N/A TRP 262.A N ARG 258.A O no hydrogen 2.985 N/A HIS 263.A N ILE 259.A O no hydrogen 3.066 N/A LYS 264.A N LEU 260.A O no hydrogen 2.953 N/A LYS 265.A N MET 261.A O no hydrogen 3.236 N/A ASN 266.A N TRP 262.A O no hydrogen 3.045 N/A ASN 266.A ND2 TRP 262.A O no hydrogen 2.913 N/A GLY 267.A N HIS 263.A O no hydrogen 2.703 N/A GLU 273.A N PRO 270.A O no hydrogen 2.865 N/A ARG 274.A N PRO 270.A O no hydrogen 3.162 N/A ARG 274.A NH2 ASP 279.A OD1 no hydrogen 3.334 N/A ASP 279.A N TRP 5.A O no hydrogen 2.980 N/A CYS 282.A N ASP 279.A OD2 no hydrogen 3.128 N/A CYS 282.A SG ASP 279.A OD2 no hydrogen 3.616 N/A CYS 282.A SG VAL 306.A O no hydrogen 3.896 N/A GLN 283.A N ASP 279.A O no hydrogen 2.722 N/A GLN 283.A NE2 VAL 7.A O no hydrogen 2.989 N/A ALA 284.A N PRO 280.A O no hydrogen 2.813 N/A ALA 285.A N ALA 281.A O no hydrogen 3.150 N/A ALA 286.A N CYS 282.A O no hydrogen 2.983 N/A ASP 287.A N GLN 283.A O no hydrogen 2.797 N/A TYR 288.A N ALA 284.A O no hydrogen 2.924 N/A LEU 289.A N ALA 285.A O no hydrogen 2.719 N/A SER 290.A N ALA 286.A O no hydrogen 2.947 N/A SER 290.A OG ALA 286.A O no hydrogen 2.904 N/A SER 290.A OG ASP 287.A O no hydrogen 2.936 N/A MET 291.A N ASP 287.A O no hydrogen 3.252 N/A LEU 292.A N TYR 288.A O no hydrogen 3.141 N/A ALA 293.A N LEU 289.A O no hydrogen 3.148 N/A LEU 294.A N SER 290.A O no hydrogen 3.151 N/A GLN 295.A N MET 291.A O no hydrogen 3.029 N/A LYS 296.A N LEU 292.A O no hydrogen 2.740 N/A LYS 296.A NZ VAL 245.A O no hydrogen 3.116 N/A GLY 297.A N LEU 294.A O no hydrogen 2.820 N/A SER 298.A N ALA 293.A O no hydrogen 2.901 N/A SER 298.A OG GLY 241.A O no hydrogen 2.698 N/A ASN 301.A N ASP 300.A OD1 no hydrogen 2.639 N/A ASN 301.A ND2 GLN 11.A O no hydrogen 2.796 N/A ASN 301.A ND2 GLU 16.A O no hydrogen 3.310 N/A ILE 302.A N ILE 10.A O no hydrogen 2.979 N/A SER 303.A N SER 239.A OG no hydrogen 3.212 N/A SER 303.A OG SER 9.A OG no hydrogen 2.460 N/A SER 303.A OG ASP 19.A OD2 no hydrogen 2.755 N/A ILE 304.A N VAL 8.A O no hydrogen 2.772 N/A ILE 305.A N LEU 237.A O no hydrogen 2.881 N/A VAL 306.A N GLY 6.A O no hydrogen 2.824 N/A ILE 307.A N LEU 235.A O no hydrogen 2.921 N/A ASP 308.A N LEU 4.A O no hydrogen 2.903 N/A LEU 309.A N GLU 233.A O no hydrogen 2.809 N/A LYS 310.A N ASP 308.A OD1 no hydrogen 2.742 N/A LYS 310.A NZ ARG 230.A O no hydrogen 2.779 N/A LYS 310.A NZ GLU 231.A OE1 no hydrogen 3.139 N/A ARG 313.A NE ASP 308.A OD1 no hydrogen 3.164 N/A ARG 313.A NE ASP 308.A OD2 no hydrogen 2.856 N/A ARG 313.A NH1 GLU 233.A OE2 no hydrogen 2.841 N/A ARG 313.A NH2 GLU 233.A OE2 no hydrogen 3.309 N/A ARG 313.A NH2 ASP 308.A OD1 no hydrogen 2.908 N/A