Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ay6_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG HIS 51.A NE2 no hydrogen 3.598 N/A GLY 6.A N VAL 305.A O no hydrogen 2.900 N/A THR 7.A N GLN 282.A OE1 no hydrogen 2.898 N/A VAL 8.A N ILE 303.A O no hydrogen 2.995 N/A SER 9.A OG SER 302.A OG no hydrogen 2.616 N/A ILE 10.A N ILE 301.A O no hydrogen 2.746 N/A GLN 11.A NE2 ARG 14.A O no hydrogen 2.997 N/A ARG 14.A NE LYS 298.A O no hydrogen 3.020 N/A GLU 18.A N ASN 300.A OD1 no hydrogen 2.894 N/A ALA 20.A N TYR 56.A O no hydrogen 2.742 N/A ALA 22.A N GLY 54.A O no hydrogen 2.865 N/A SER 24.A N PHE 52.A O no hydrogen 2.819 N/A HIS 26.A N HIS 51.A ND1 no hydrogen 2.833 N/A LEU 28.A N GLY 50.A O no hydrogen 3.159 N/A LYS 29.A NZ HIS 26.A O no hydrogen 3.361 N/A LEU 30.A N LEU 48.A O no hydrogen 2.849 N/A ILE 32.A N THR 46.A O no hydrogen 3.410 N/A MET 34.A N PRO 31.A O no hydrogen 2.808 N/A LEU 35.A N ILE 32.A O no hydrogen 3.184 N/A MET 36.A N ILE 32.A O no hydrogen 2.942 N/A LEU 45.A N SER 42.A O no hydrogen 3.071 N/A LEU 48.A N LEU 30.A O no hydrogen 3.006 N/A GLY 50.A N LEU 28.A O no hydrogen 2.731 N/A HIS 51.A N VAL 141.A O no hydrogen 2.884 N/A HIS 51.A NE2 CYS 1.A O no hydrogen 3.071 N/A PHE 52.A N SER 24.A O no hydrogen 2.964 N/A PHE 53.A N ALA 139.A O no hydrogen 2.951 N/A GLY 54.A N ALA 22.A O no hydrogen 2.831 N/A VAL 55.A N VAL 137.A O no hydrogen 2.955 N/A TYR 56.A N ALA 20.A O no hydrogen 2.772 N/A ASP 57.A N THR 135.A OG1 no hydrogen 2.904 N/A GLY 58.A N GLU 18.A O no hydrogen 2.731 N/A HIS 59.A N GLY 133.A O no hydrogen 2.957 N/A HIS 59.A NE2 ASP 209.A OD1 no hydrogen 3.169 N/A HIS 59.A NE2 ASP 209.A OD2 no hydrogen 2.677 N/A HIS 62.A ND1 ASP 66.A OD2 no hydrogen 3.027 N/A ASP 66.A N HIS 62.A O no hydrogen 3.006 N/A TYR 67.A N LYS 63.A O no hydrogen 2.949 N/A TYR 67.A OH GLU 110.A OE1 no hydrogen 2.578 N/A CYS 68.A N VAL 64.A O no hydrogen 2.902 N/A CYS 68.A SG VAL 64.A O no hydrogen 3.464 N/A ARG 69.A N ALA 65.A O no hydrogen 2.968 N/A ARG 69.A NE ASP 70.A OD1 no hydrogen 3.335 N/A ASP 70.A N ASP 66.A O no hydrogen 3.007 N/A ARG 71.A NE GLU 110.A OE1 no hydrogen 3.024 N/A ARG 71.A NE GLU 110.A OE2 no hydrogen 3.325 N/A ARG 71.A NH1 GLU 78.A OE1 no hydrogen 3.443 N/A ARG 71.A NH1 GLU 78.A OE2 no hydrogen 2.874 N/A ARG 71.A NH2 GLU 78.A OE1 no hydrogen 2.968 N/A ARG 71.A NH2 GLU 110.A OE2 no hydrogen 2.819 N/A LEU 72.A N CYS 68.A O no hydrogen 2.974 N/A ALA 75.A N ARG 71.A O no hydrogen 2.966 N/A LEU 76.A N LEU 72.A O no hydrogen 2.953 N/A ALA 77.A N HIS 73.A O no hydrogen 2.995 N/A GLU 78.A N PHE 74.A O no hydrogen 2.987 N/A GLU 79.A N ALA 75.A O no hydrogen 3.093 N/A ILE 80.A N LEU 76.A O no hydrogen 2.994 N/A GLU 81.A N ALA 77.A O no hydrogen 2.854 N/A ARG 82.A N GLU 78.A O no hydrogen 3.060 N/A ILE 83.A N GLU 79.A O no hydrogen 3.325 N/A ILE 83.A N ILE 80.A O no hydrogen 2.972 N/A LYS 84.A N ILE 80.A O no hydrogen 2.997 N/A LYS 84.A NZ LYS 29.A O no hydrogen 2.688 N/A ASP 85.A N GLU 81.A O no hydrogen 3.000 N/A GLU 86.A N ILE 83.A O no hydrogen 3.256 N/A ARG 92.A N THR 88.A O no hydrogen 3.137 N/A ARG 92.A N GLY 89.A O no hydrogen 3.224 N/A GLN 93.A NE2 GLN 93.A O no hydrogen 3.274 N/A GLN 93.A NE2 VAL 222.A O no hydrogen 3.682 N/A VAL 94.A N GLU 90.A O no hydrogen 3.268 N/A GLN 95.A N GLY 91.A O no hydrogen 2.700 N/A TRP 96.A N ARG 92.A O no hydrogen 2.941 N/A TRP 96.A NE1 MET 34.A O no hydrogen 2.867 N/A ASP 97.A N GLN 93.A O no hydrogen 3.044 N/A LYS 98.A N VAL 94.A O no hydrogen 2.905 N/A VAL 99.A N GLN 95.A O no hydrogen 2.867 N/A PHE 100.A N TRP 96.A O no hydrogen 2.972 N/A THR 101.A N ASP 97.A O no hydrogen 2.872 N/A THR 101.A OG1 ASP 97.A O no hydrogen 2.560 N/A SER 102.A N LYS 98.A O no hydrogen 2.907 N/A SER 102.A OG GLU 79.A OE2 no hydrogen 2.514 N/A CYS 103.A N VAL 99.A O no hydrogen 2.991 N/A CYS 103.A SG LEU 72.A O no hydrogen 3.703 N/A PHE 104.A N PHE 100.A O no hydrogen 2.852 N/A LEU 105.A N THR 101.A O no hydrogen 2.882 N/A THR 106.A N SER 102.A O no hydrogen 2.856 N/A THR 106.A OG1 SER 102.A O no hydrogen 2.787 N/A VAL 107.A N CYS 103.A O no hydrogen 3.039 N/A ASP 108.A N PHE 104.A O no hydrogen 2.979 N/A GLY 109.A N LEU 105.A O no hydrogen 2.971 N/A GLU 110.A N THR 106.A O no hydrogen 2.943 N/A ILE 111.A N VAL 107.A O no hydrogen 2.905 N/A GLU 112.A N ASP 108.A O no hydrogen 3.010 N/A GLY 113.A N GLU 110.A O no hydrogen 3.088 N/A LYS 114.A N GLY 109.A O no hydrogen 2.834 N/A LYS 114.A NZ GLU 112.A OE1 no hydrogen 2.546 N/A ILE 115.A N GLY 109.A O no hydrogen 3.081 N/A ARG 117.A N VAL 123.A O no hydrogen 2.814 N/A ARG 117.A NH2 GLU 125.A O no hydrogen 2.661 N/A VAL 123.A N ARG 117.A O no hydrogen 2.855 N/A VAL 127.A N ILE 111.A O no hydrogen 3.019 N/A VAL 132.A N SER 129.A O no hydrogen 3.130 N/A GLY 133.A N HIS 59.A O no hydrogen 2.988 N/A SER 134.A N ILE 207.A O no hydrogen 2.794 N/A SER 134.A OG THR 135.A O no hydrogen 2.739 N/A THR 135.A N ASP 57.A O no hydrogen 2.899 N/A THR 135.A OG1 SER 154.A OG no hydrogen 2.709 N/A ALA 136.A N CYS 151.A O no hydrogen 2.906 N/A VAL 137.A N VAL 55.A O no hydrogen 3.020 N/A VAL 138.A N SER 149.A O no hydrogen 2.903 N/A ALA 139.A N PHE 53.A O no hydrogen 2.817 N/A LEU 140.A N VAL 147.A O no hydrogen 2.680 N/A VAL 141.A N HIS 51.A O no hydrogen 2.981 N/A CYS 142.A N HIS 145.A O no hydrogen 3.020 N/A CYS 142.A SG SER 144.A OG no hydrogen 3.535 N/A CYS 142.A SG HIS 145.A O no hydrogen 3.524 N/A SER 144.A OG HIS 145.A ND1 no hydrogen 2.756 N/A HIS 145.A ND1 SER 144.A OG no hydrogen 2.756 N/A ILE 146.A N MET 225.A O no hydrogen 2.836 N/A VAL 147.A N LEU 140.A O no hydrogen 2.815 N/A VAL 148.A N THR 223.A O no hydrogen 2.951 N/A SER 149.A N VAL 138.A O no hydrogen 2.878 N/A ASN 150.A N GLU 221.A O no hydrogen 2.853 N/A ASN 150.A ND2 GLY 152.A O no hydrogen 3.118 N/A CYS 151.A N ALA 136.A O no hydrogen 2.784 N/A CYS 151.A SG ILE 217.A O no hydrogen 3.996 N/A CYS 151.A SG PRO 218.A O no hydrogen 3.659 N/A GLY 152.A N HIS 171.A ND1 no hydrogen 2.921 N/A SER 154.A OG THR 135.A OG1 no hydrogen 2.709 N/A ARG 155.A N ALA 237.A O no hydrogen 3.037 N/A ARG 155.A NE ASP 170.A OD1 no hydrogen 3.186 N/A ARG 155.A NH1 ASN 247.A OD1 no hydrogen 2.747 N/A ARG 155.A NH2 ASP 170.A OD2 no hydrogen 2.801 N/A ALA 156.A N SER 168.A OG no hydrogen 3.103 N/A VAL 157.A N ILE 235.A O no hydrogen 2.831 N/A LEU 158.A N MET 165.A O no hydrogen 2.836 N/A PHE 159.A N CYS 233.A O no hydrogen 2.883 N/A ARG 160.A N GLU 163.A O no hydrogen 2.965 N/A ARG 160.A NE ASP 231.A OD1 no hydrogen 2.663 N/A ARG 160.A NH2 PRO 226.A O no hydrogen 2.887 N/A ARG 160.A NH2 ASP 231.A OD1 no hydrogen 3.055 N/A ARG 160.A NH2 ASP 231.A OD2 no hydrogen 3.379 N/A GLY 161.A N GLU 230.A O no hydrogen 2.901 N/A GLU 163.A N ARG 160.A O no hydrogen 3.007 N/A ALA 164.A N GLN 248.A OE1 no hydrogen 3.109 N/A MET 165.A N LEU 158.A O no hydrogen 2.614 N/A LEU 167.A N ALA 156.A O no hydrogen 2.838 N/A VAL 169.A N GLU 221.A OE1 no hydrogen 3.203 N/A HIS 171.A N GLY 152.A O no hydrogen 2.905 N/A LYS 172.A NZ ASP 153.A OD2 no hydrogen 3.112 N/A LYS 172.A NZ ALA 202.A O no hydrogen 2.795 N/A ARG 175.A N LYS 172.A O no hydrogen 3.012 N/A ARG 175.A NE ASP 177.A OD1 no hydrogen 2.756 N/A ARG 175.A NE ASP 177.A OD2 no hydrogen 3.383 N/A ARG 175.A NH1 ASP 170.A O no hydrogen 3.164 N/A ARG 175.A NH2 ASP 177.A OD2 no hydrogen 2.845 N/A TYR 179.A N ARG 175.A O no hydrogen 2.733 N/A ALA 180.A N GLU 176.A O no hydrogen 3.119 N/A ARG 181.A N ASP 177.A O no hydrogen 2.898 N/A ARG 181.A NE GLU 178.A OE1 no hydrogen 3.373 N/A ARG 181.A NE GLU 178.A OE2 no hydrogen 2.890 N/A ARG 181.A NH1 TYR 215.A O no hydrogen 2.974 N/A ARG 181.A NH2 GLU 178.A OE1 no hydrogen 2.865 N/A ARG 181.A NH2 SER 204.A O no hydrogen 2.874 N/A ARG 181.A NH2 TYR 215.A O no hydrogen 3.186 N/A ILE 182.A N GLU 178.A O no hydrogen 2.915 N/A GLU 183.A N TYR 179.A O no hydrogen 3.090 N/A ASN 184.A N ALA 180.A O no hydrogen 2.786 N/A ALA 185.A N ARG 181.A O no hydrogen 2.996 N/A GLY 186.A N GLU 183.A O no hydrogen 2.912 N/A GLY 187.A N ILE 182.A O no hydrogen 2.920 N/A ILE 190.A N ARG 196.A O no hydrogen 2.903 N/A TRP 192.A N GLY 194.A O no hydrogen 2.982 N/A ARG 196.A N ILE 190.A O no hydrogen 2.910 N/A ARG 196.A NE TRP 192.A O no hydrogen 3.034 N/A ARG 196.A NE GLN 193.A O no hydrogen 3.066 N/A ARG 196.A NH1 VAL 200.A O no hydrogen 2.926 N/A ARG 196.A NH2 GLN 193.A O no hydrogen 3.232 N/A VAL 197.A N LEU 201.A O no hydrogen 2.782 N/A PHE 198.A N LYS 188.A O no hydrogen 2.781 N/A GLY 199.A N ARG 196.A O no hydrogen 3.115 N/A VAL 200.A N VAL 197.A O no hydrogen 2.878 N/A LEU 201.A N VAL 197.A O no hydrogen 3.415 N/A SER 204.A N HIS 171.A O no hydrogen 2.942 N/A SER 204.A OG GLU 178.A OE1 no hydrogen 2.642 N/A ARG 205.A NE GLU 178.A OE1 no hydrogen 3.030 N/A ARG 205.A NH1 GLU 219.A O no hydrogen 2.804 N/A ARG 205.A NH2 GLU 178.A OE2 no hydrogen 3.052 N/A SER 206.A N ILE 217.A O no hydrogen 3.104 N/A SER 206.A OG ASP 209.A OD2 no hydrogen 2.384 N/A ILE 207.A N SER 134.A O no hydrogen 2.804 N/A GLY 208.A N ASP 108.A OD1 no hydrogen 2.635 N/A ASP 209.A N VAL 132.A O no hydrogen 2.888 N/A ARG 210.A NH1 GLU 112.A O no hydrogen 3.515 N/A TYR 211.A N GLU 130.A O no hydrogen 3.133 N/A LEU 212.A N ASP 209.A O no hydrogen 2.924 N/A LYS 213.A N ARG 210.A O no hydrogen 3.128 N/A TYR 215.A N LEU 212.A O no hydrogen 2.811 N/A VAL 216.A N LEU 212.A O no hydrogen 2.904 N/A GLU 219.A N GLU 219.A OE1 no hydrogen 2.848 N/A GLU 221.A N ASN 150.A O no hydrogen 2.863 N/A THR 223.A N VAL 148.A O no hydrogen 2.761 N/A THR 223.A OG1 LEU 167.A O no hydrogen 3.077 N/A MET 225.A N ILE 146.A O no hydrogen 2.814 N/A ARG 227.A N SER 144.A O no hydrogen 2.886 N/A ARG 227.A NH1 CYS 142.A O no hydrogen 2.726 N/A ARG 227.A NH2 LEU 308.A O no hydrogen 3.043 N/A SER 228.A N ASP 231.A OD2 no hydrogen 2.856 N/A GLU 230.A N SER 228.A OG no hydrogen 2.853 N/A ASP 231.A N SER 228.A O no hydrogen 2.877 N/A GLU 232.A N PHE 159.A O no hydrogen 2.828 N/A CYS 233.A SG CYS 251.A O no hydrogen 4.006 N/A LEU 234.A N ILE 306.A O no hydrogen 2.847 N/A ILE 235.A N VAL 157.A O no hydrogen 2.906 N/A LEU 236.A N ILE 304.A O no hydrogen 3.012 N/A ALA 237.A N ARG 155.A O no hydrogen 3.025 N/A SER 238.A N SER 302.A O no hydrogen 3.013 N/A SER 238.A OG ASP 19.A OD2 no hydrogen 2.799 N/A LEU 241.A N SER 238.A O no hydrogen 3.008 N/A TRP 242.A NE1 ALA 237.A O no hydrogen 2.856 N/A ASP 243.A N ASP 239.A O no hydrogen 2.888 N/A VAL 244.A N LEU 241.A O no hydrogen 3.069 N/A MET 245.A N LEU 241.A O no hydrogen 3.175 N/A GLN 248.A NE2 LYS 162.A O no hydrogen 2.902 N/A GLN 248.A NE2 GLU 252.A OE2 no hydrogen 2.710 N/A GLU 249.A N ASN 246.A OD1 no hydrogen 2.856 N/A VAL 250.A N ASN 246.A O no hydrogen 2.908 N/A CYS 251.A N ASN 247.A O no hydrogen 3.190 N/A CYS 251.A SG ASN 247.A O no hydrogen 3.549 N/A GLU 252.A N GLN 248.A O no hydrogen 2.991 N/A ILE 253.A N GLU 249.A O no hydrogen 2.865 N/A ALA 254.A N VAL 250.A O no hydrogen 2.992 N/A ARG 255.A N CYS 251.A O no hydrogen 2.973 N/A ARG 255.A NE GLU 232.A OE1 no hydrogen 3.247 N/A ARG 256.A N GLU 252.A O no hydrogen 2.853 N/A ARG 257.A N ILE 253.A O no hydrogen 2.860 N/A ILE 258.A N ALA 254.A O no hydrogen 2.895 N/A LEU 259.A N ARG 255.A O no hydrogen 2.898 N/A MET 260.A N ARG 256.A O no hydrogen 2.832 N/A TRP 261.A N ARG 257.A O no hydrogen 3.042 N/A HIS 262.A N ILE 258.A O no hydrogen 3.119 N/A LYS 263.A N LEU 259.A O no hydrogen 2.841 N/A LYS 264.A N MET 260.A O no hydrogen 3.057 N/A LYS 264.A NZ MET 260.A O no hydrogen 3.191 N/A ASN 265.A N TRP 261.A O no hydrogen 2.809 N/A ASN 265.A ND2 TRP 261.A O no hydrogen 3.027 N/A GLY 266.A N HIS 262.A O no hydrogen 2.907 N/A GLU 272.A N PRO 269.A O no hydrogen 2.658 N/A ARG 273.A N LEU 270.A O no hydrogen 3.359 N/A ARG 273.A NH2 ASP 278.A OD1 no hydrogen 3.021 N/A ASP 278.A N TRP 5.A O no hydrogen 2.726 N/A CYS 281.A N ASP 278.A OD2 no hydrogen 3.067 N/A CYS 281.A SG ASP 278.A OD2 no hydrogen 3.369 N/A CYS 281.A SG VAL 305.A O no hydrogen 3.767 N/A GLN 282.A N ASP 278.A O no hydrogen 2.844 N/A GLN 282.A NE2 THR 7.A O no hydrogen 2.888 N/A ALA 283.A N PRO 279.A O no hydrogen 2.945 N/A ALA 284.A N ALA 280.A O no hydrogen 3.109 N/A ALA 285.A N CYS 281.A O no hydrogen 2.885 N/A ASP 286.A N GLN 282.A O no hydrogen 2.810 N/A TYR 287.A N ALA 283.A O no hydrogen 2.929 N/A LEU 288.A N ALA 284.A O no hydrogen 2.901 N/A SER 289.A N ALA 285.A O no hydrogen 3.002 N/A SER 289.A OG ALA 285.A O no hydrogen 3.435 N/A SER 289.A OG ASP 286.A O no hydrogen 2.838 N/A MET 290.A N ASP 286.A O no hydrogen 3.008 N/A LEU 291.A N TYR 287.A O no hydrogen 2.891 N/A ALA 292.A N LEU 288.A O no hydrogen 2.955 N/A LEU 293.A N SER 289.A O no hydrogen 3.116 N/A GLN 294.A N MET 290.A O no hydrogen 2.930 N/A LYS 295.A N LEU 291.A O no hydrogen 2.801 N/A GLY 296.A N LEU 293.A O no hydrogen 2.888 N/A SER 297.A N ALA 292.A O no hydrogen 2.987 N/A SER 297.A OG GLY 240.A O no hydrogen 2.825 N/A LYS 298.A NZ GLY 296.A O no hydrogen 2.541 N/A ASN 300.A ND2 GLN 11.A O no hydrogen 2.777 N/A ASN 300.A ND2 GLU 16.A O no hydrogen 3.120 N/A ILE 301.A N ILE 10.A O no hydrogen 2.837 N/A SER 302.A N SER 238.A OG no hydrogen 3.154 N/A SER 302.A OG SER 9.A OG no hydrogen 2.616 N/A SER 302.A OG ASP 19.A OD2 no hydrogen 2.758 N/A ILE 303.A N VAL 8.A O no hydrogen 2.812 N/A ILE 304.A N LEU 236.A O no hydrogen 2.780 N/A VAL 305.A N GLY 6.A O no hydrogen 2.944 N/A ILE 306.A N LEU 234.A O no hydrogen 2.854 N/A ASP 307.A N LEU 4.A O no hydrogen 2.937 N/A LEU 308.A N GLU 232.A O no hydrogen 3.018 N/A LYS 309.A N ASP 307.A OD1 no hydrogen 3.126 N/A LYS 309.A NZ ARG 229.A O no hydrogen 2.784 N/A ARG 312.A NE ASP 307.A OD1 no hydrogen 3.132 N/A ARG 312.A NE ASP 307.A OD2 no hydrogen 2.999 N/A ARG 312.A NH1 GLU 232.A OE2 no hydrogen 2.932 N/A ARG 312.A NH2 GLU 232.A OE2 no hydrogen 3.060 N/A ARG 312.A NH2 ASP 307.A OD1 no hydrogen 2.768 N/A