Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zs8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A ND2 GLU 3.A OE1 no hydrogen 2.943 N/A LEU 6.A N LEU 263.A O no hydrogen 2.810 N/A HIS 7.A N ASN 5.A OD1 no hydrogen 3.050 N/A ILE 10.A N LEU 6.A O no hydrogen 2.621 N/A THR 11.A N HIS 7.A O no hydrogen 2.778 N/A THR 11.A OG1 HIS 7.A O no hydrogen 2.852 N/A SER 12.A N LEU 9.A O no hydrogen 2.875 N/A SER 12.A OG HIS 15.A ND1 no hydrogen 2.517 N/A THR 14.A OG1 SER 12.A OG no hydrogen 3.382 N/A THR 14.A OG1 ASP 168.A O no hydrogen 2.598 N/A HIS 15.A ND1 SER 12.A OG no hydrogen 2.517 N/A TRP 17.A N LEU 169.A O no hydrogen 2.862 N/A TRP 17.A NE1 GLN 163.A OE1 no hydrogen 2.955 N/A ILE 18.A N VAL 119.A O no hydrogen 2.981 N/A PHE 19.A N THR 171.A O no hydrogen 2.922 N/A VAL 20.A N PHE 121.A O no hydrogen 2.985 N/A GLY 21.A N VAL 173.A O no hydrogen 3.107 N/A LYS 23.A NZ GLU 185.A OE2 no hydrogen 3.222 N/A LYS 28.A NZ ASP 54.A OD2 no hydrogen 2.513 N/A LYS 28.A NZ ASP 122.A OD2 no hydrogen 3.306 N/A LYS 28.A NZ THR 123.A O no hydrogen 2.856 N/A THR 29.A OG1 ASP 122.A OD2 no hydrogen 2.850 N/A SER 31.A N GLY 27.A O no hydrogen 3.220 N/A SER 31.A OG GLY 27.A O no hydrogen 3.469 N/A SER 32.A N LYS 28.A O no hydrogen 3.006 N/A SER 32.A OG ASP 122.A OD1 no hydrogen 2.894 N/A CYS 33.A N THR 29.A O no hydrogen 3.157 N/A CYS 33.A SG THR 29.A O no hydrogen 3.223 N/A SER 34.A N THR 30.A O no hydrogen 2.956 N/A SER 34.A OG THR 30.A O no hydrogen 3.122 N/A ILE 35.A N SER 31.A O no hydrogen 2.928 N/A ALA 36.A N SER 32.A O no hydrogen 3.119 N/A ILE 37.A N CYS 33.A O no hydrogen 2.868 N/A GLN 38.A N SER 34.A O no hydrogen 2.835 N/A GLN 38.A NE2 SER 260.A OG no hydrogen 2.626 N/A MET 39.A N ILE 35.A O no hydrogen 3.146 N/A ALA 40.A N ALA 36.A O no hydrogen 3.127 N/A LEU 41.A N ILE 37.A O no hydrogen 2.939 N/A SER 42.A N GLN 38.A O no hydrogen 2.907 N/A SER 42.A OG GLN 38.A O no hydrogen 2.896 N/A GLN 43.A N ALA 40.A O no hydrogen 3.420 N/A GLN 43.A NE2 SER 12.A O no hydrogen 2.864 N/A ASN 45.A N ASN 45.A OD1 no hydrogen 2.491 N/A LYS 46.A N GLN 43.A O no hydrogen 2.948 N/A LYS 46.A NZ GLN 43.A OE1 no hydrogen 3.306 N/A GLN 47.A N ASP 117.A OD2 no hydrogen 2.632 N/A GLN 47.A NE2 ASN 78.A O no hydrogen 3.125 N/A PHE 48.A N ASN 79.A O no hydrogen 2.794 N/A LEU 49.A N THR 118.A O no hydrogen 3.152 N/A LEU 50.A N SER 81.A O no hydrogen 2.894 N/A ILE 51.A N ILE 120.A O no hydrogen 2.966 N/A SER 52.A N MET 83.A O no hydrogen 2.884 N/A SER 52.A OG ASP 122.A OD2 no hydrogen 3.092 N/A THR 53.A N ASP 122.A O no hydrogen 3.404 N/A ASP 54.A N SER 52.A OG no hydrogen 3.305 N/A ALA 56.A N ASP 54.A OD1 no hydrogen 3.294 N/A HIS 57.A N ASP 54.A O no hydrogen 3.413 N/A HIS 57.A ND1 PRO 55.A O no hydrogen 2.865 N/A SER 60.A N GLU 84.A OE2 no hydrogen 3.044 N/A SER 60.A OG GLU 65.A O no hydrogen 3.171 N/A SER 60.A OG GLU 84.A OE1 no hydrogen 3.069 N/A ALA 62.A N ASN 58.A O no hydrogen 2.843 N/A ALA 62.A N LEU 59.A O no hydrogen 2.947 N/A PHE 63.A N LEU 59.A O no hydrogen 2.969 N/A GLY 64.A N SER 60.A O no hydrogen 3.009 N/A GLU 65.A N SER 60.A O no hydrogen 3.235 N/A PHE 67.A N SER 60.A OG no hydrogen 2.568 N/A ALA 71.A N GLN 111.A OE1 no hydrogen 2.748 N/A ARG 72.A N CYS 82.A O no hydrogen 3.308 N/A LYS 73.A NZ GLU 114.A OE2 no hydrogen 2.602 N/A VAL 74.A N LEU 80.A O no hydrogen 2.986 N/A THR 75.A N GLU 65.A OE2 no hydrogen 2.821 N/A THR 75.A OG1 GLU 65.A OE1 no hydrogen 2.970 N/A MET 77.A N VAL 74.A O no hydrogen 2.917 N/A ASN 79.A ND2 ALA 40.A O no hydrogen 2.247 N/A ASN 79.A ND2 GLN 43.A O no hydrogen 3.605 N/A SER 81.A N PHE 48.A O no hydrogen 3.112 N/A CYS 82.A N ARG 72.A O no hydrogen 2.847 N/A CYS 82.A SG LEU 50.A O no hydrogen 4.004 N/A MET 83.A N LEU 50.A O no hydrogen 2.896 N/A GLU 84.A N GLY 68.A O no hydrogen 3.203 N/A ILE 85.A N SER 52.A O no hydrogen 3.361 N/A SER 88.A N ASP 86.A OD1 no hydrogen 3.218 N/A SER 88.A OG ASP 86.A OD1 no hydrogen 3.563 N/A ALA 90.A N ASP 86.A O no hydrogen 3.064 N/A LEU 91.A N PRO 87.A O no hydrogen 2.868 N/A LYS 92.A N SER 88.A O no hydrogen 2.928 N/A ASP 93.A N ALA 89.A O no hydrogen 2.939 N/A GLU 97.A N GLU 97.A OE1 no hydrogen 2.644 N/A ALA 98.A N GLY 94.A O no hydrogen 3.224 N/A LEU 99.A N ILE 95.A O no hydrogen 3.154 N/A SER 100.A N ASP 96.A O no hydrogen 3.285 N/A PHE 101.A N GLU 97.A O no hydrogen 2.893 N/A MET 102.A N ALA 98.A O no hydrogen 2.903 N/A VAL 104.A N PHE 101.A O no hydrogen 2.918 N/A MET 105.A N PHE 101.A O no hydrogen 3.188 N/A LYS 106.A N MET 102.A O no hydrogen 3.249 N/A HIS 107.A N GLU 103.A O no hydrogen 3.181 N/A HIS 107.A ND1 GLU 103.A O no hydrogen 2.790 N/A ILE 108.A N VAL 104.A O no hydrogen 3.127 N/A LYS 109.A N MET 105.A O no hydrogen 3.201 N/A LYS 109.A NZ GLU 112.A OE1 no hydrogen 3.333 N/A ARG 110.A N LYS 106.A O no hydrogen 3.014 N/A GLN 111.A N HIS 107.A O no hydrogen 3.041 N/A GLN 111.A N ILE 108.A O no hydrogen 3.052 N/A GLN 111.A NE2 ASP 70.A OD1 no hydrogen 3.450 N/A GLU 112.A N ILE 108.A O no hydrogen 3.065 N/A GLN 113.A N LYS 109.A O no hydrogen 3.011 N/A PHE 116.A N GLU 112.A OE2 no hydrogen 3.077 N/A ASP 117.A N GLN 47.A O no hydrogen 2.853 N/A THR 118.A OG1 HIS 15.A O no hydrogen 2.186 N/A THR 118.A OG1 ASP 117.A O no hydrogen 3.096 N/A VAL 119.A N LYS 16.A O no hydrogen 2.986 N/A ILE 120.A N LEU 49.A O no hydrogen 2.761 N/A PHE 121.A N ILE 18.A O no hydrogen 2.897 N/A ASP 122.A N ILE 51.A O no hydrogen 2.851 N/A THR 123.A N VAL 20.A O no hydrogen 3.118 N/A THR 123.A OG1 VAL 20.A O no hydrogen 3.041 N/A GLN 134.A N LEU 130.A O no hydrogen 2.942 N/A LEU 135.A N PHE 132.A O no hydrogen 2.272 N/A ASN 137.A ND2 GLN 134.A O no hydrogen 2.961 N/A ASN 137.A ND2 GLN 134.A OE1 no hydrogen 3.297 N/A THR 138.A N GLN 134.A O no hydrogen 3.139 N/A THR 138.A OG1 LEU 135.A O no hydrogen 2.907 N/A LEU 139.A N LEU 135.A O no hydrogen 2.173 N/A SER 140.A N PRO 136.A O no hydrogen 3.271 N/A SER 140.A OG PRO 136.A O no hydrogen 2.739 N/A SER 140.A OG ASN 137.A O no hydrogen 2.963 N/A LYS 141.A N ASN 137.A O no hydrogen 3.202 N/A LYS 141.A NZ SER 140.A OG no hydrogen 3.013 N/A LYS 141.A NZ GLU 144.A OE2 no hydrogen 2.936 N/A LEU 142.A N THR 138.A O no hydrogen 3.048 N/A LEU 143.A N LEU 139.A O no hydrogen 3.053 N/A GLU 144.A N SER 140.A O no hydrogen 2.793 N/A LYS 145.A N LYS 141.A O no hydrogen 3.129 N/A PHE 146.A N LEU 142.A O no hydrogen 2.846 N/A GLY 147.A N LEU 143.A O no hydrogen 3.047 N/A ILE 149.A N PHE 146.A O no hydrogen 2.829 N/A ASN 151.A ND2 GLU 148.A O no hydrogen 3.050 N/A LYS 152.A N ILE 149.A O no hydrogen 2.820 N/A LYS 152.A NZ GLU 148.A OE2 no hydrogen 3.360 N/A LYS 154.A N ASN 156.A OD1 no hydrogen 3.187 N/A VAL 157.A N LYS 154.A O no hydrogen 2.879 N/A GLU 158.A N LYS 154.A O no hydrogen 2.935 N/A THR 159.A N ALA 155.A O no hydrogen 2.924 N/A THR 159.A OG1 ALA 155.A O no hydrogen 2.904 N/A ARG 161.A N VAL 157.A O no hydrogen 2.932 N/A GLN 162.A N GLU 158.A O no hydrogen 2.913 N/A GLN 162.A NE2 GLU 158.A OE2 no hydrogen 2.901 N/A GLN 163.A N THR 159.A O no hydrogen 2.917 N/A PHE 164.A N ILE 160.A O no hydrogen 2.896 N/A THR 165.A N ARG 161.A O no hydrogen 2.955 N/A THR 165.A OG1 ARG 161.A O no hydrogen 2.985 N/A THR 165.A OG1 GLN 162.A O no hydrogen 3.467 N/A ASP 168.A N ASP 166.A OD1 no hydrogen 3.061 N/A LEU 169.A N ASP 166.A O no hydrogen 2.855 N/A THR 170.A N ASP 166.A O no hydrogen 2.801 N/A THR 170.A OG1 GLN 163.A O no hydrogen 2.730 N/A THR 171.A N TRP 17.A O no hydrogen 3.072 N/A THR 171.A OG1 ASP 199.A O no hydrogen 3.203 N/A THR 171.A OG1 ASP 199.A OD2 no hydrogen 2.775 N/A THR 171.A OG1 ASN 201.A OD1 no hydrogen 3.499 N/A PHE 172.A N ASP 199.A O no hydrogen 2.819 N/A VAL 173.A N PHE 19.A O no hydrogen 2.533 N/A CYS 174.A N SER 202.A O no hydrogen 2.919 N/A VAL 175.A N GLY 21.A O no hydrogen 2.930 N/A CYS 176.A N ILE 204.A O no hydrogen 2.929 N/A CYS 176.A SG ILE 204.A O no hydrogen 3.987 N/A ILE 177.A N SER 182.A OG no hydrogen 3.028 N/A SER 178.A OG GLN 224.A O no hydrogen 2.738 N/A SER 182.A OG ILE 177.A O no hydrogen 3.384 N/A LEU 183.A N GLU 179.A O no hydrogen 3.087 N/A TYR 184.A N PHE 180.A O no hydrogen 2.831 N/A GLU 185.A N LEU 181.A O no hydrogen 2.865 N/A THR 186.A N SER 182.A O no hydrogen 2.816 N/A THR 186.A OG1 SER 182.A O no hydrogen 2.900 N/A GLU 187.A N LEU 183.A O no hydrogen 2.994 N/A ARG 188.A N TYR 184.A O no hydrogen 3.049 N/A LEU 189.A N GLU 185.A O no hydrogen 3.075 N/A ILE 190.A N THR 186.A O no hydrogen 3.014 N/A GLN 191.A N GLU 187.A O no hydrogen 2.965 N/A GLU 192.A N ARG 188.A O no hydrogen 2.913 N/A LEU 193.A N LEU 189.A O no hydrogen 2.892 N/A ILE 194.A N ILE 190.A O no hydrogen 2.846 N/A SER 195.A N GLN 191.A O no hydrogen 2.966 N/A SER 195.A OG GLU 192.A O no hydrogen 2.527 N/A TYR 196.A N LEU 193.A O no hydrogen 2.975 N/A TYR 196.A OH GLU 192.A OE2 no hydrogen 3.045 N/A ASP 197.A N ILE 194.A O no hydrogen 2.954 N/A MET 198.A N LEU 193.A O no hydrogen 3.108 N/A SER 202.A OG ASN 201.A OD1 no hydrogen 2.989 N/A ILE 203.A N HIS 239.A O no hydrogen 2.853 N/A ILE 204.A N CYS 174.A O no hydrogen 2.755 N/A VAL 205.A N VAL 241.A O no hydrogen 2.870 N/A ASN 206.A N CYS 176.A O no hydrogen 2.905 N/A ASN 206.A ND2 VAL 26.A O no hydrogen 3.247 N/A ASN 206.A ND2 SER 31.A OG no hydrogen 3.060 N/A GLN 207.A NE2 GLY 25.A O no hydrogen 2.922 N/A LEU 208.A N MET 243.A O no hydrogen 3.139 N/A LEU 209.A N GLN 224.A OE1 no hydrogen 2.927 N/A ASN 213.A N PHE 210.A O no hydrogen 3.286 N/A ASN 213.A ND2 PHE 210.A O no hydrogen 3.332 N/A GLN 218.A N CYS 214.A O no hydrogen 2.982 N/A GLN 218.A NE2 ALA 211.A O no hydrogen 3.247 N/A ALA 219.A N LYS 215.A O no hydrogen 3.227 N/A ARG 220.A N ARG 216.A O no hydrogen 3.065 N/A TRP 221.A N CYS 217.A O no hydrogen 2.859 N/A TRP 221.A NE1 GLU 212.A OE2 no hydrogen 3.128 N/A LYS 222.A N GLN 218.A O no hydrogen 3.159 N/A MET 223.A N ALA 219.A O no hydrogen 3.222 N/A GLN 224.A N ARG 220.A O no hydrogen 2.997 N/A GLN 224.A NE2 GLN 207.A O no hydrogen 3.026 N/A LYS 225.A N TRP 221.A O no hydrogen 3.018 N/A LYS 226.A N LYS 222.A O no hydrogen 3.200 N/A TYR 227.A N MET 223.A O no hydrogen 3.194 N/A LEU 228.A N GLN 224.A O no hydrogen 2.939 N/A ASP 229.A N LYS 225.A O no hydrogen 3.011 N/A ILE 231.A N TYR 227.A O no hydrogen 2.791 N/A ASP 232.A N LEU 228.A O no hydrogen 3.175 N/A LEU 234.A N GLN 230.A O no hydrogen 2.860 N/A TYR 235.A N ILE 231.A O no hydrogen 3.022 N/A TYR 235.A OH GLU 187.A OE1 no hydrogen 3.064 N/A ASP 237.A N ASP 237.A OD1 no hydrogen 2.467 N/A HIS 239.A N ASN 201.A O no hydrogen 2.671 N/A HIS 239.A ND1 GLU 3.A O no hydrogen 2.765 N/A VAL 241.A N ILE 203.A O no hydrogen 2.844 N/A LYS 242.A NZ ASP 232.A OD1 no hydrogen 3.261 N/A LYS 242.A NZ VAL 240.A O no hydrogen 3.273 N/A MET 243.A N VAL 205.A O no hydrogen 2.831 N/A LEU 245.A N LEU 208.A O no hydrogen 2.582 N/A CYS 246.A SG ILE 276.A O no hydrogen 3.961 N/A ALA 247.A N GLU 280.A OE2 no hydrogen 2.726 N/A GLY 252.A N ALA 62.A O no hydrogen 2.675 N/A ASN 255.A ND2 ARG 251.A O no hydrogen 3.020 N/A LEU 256.A N GLY 252.A O no hydrogen 3.098 N/A THR 257.A N LEU 253.A O no hydrogen 2.722 N/A THR 257.A OG1 ASN 254.A O no hydrogen 2.887 N/A LYS 258.A N ASN 254.A O no hydrogen 3.026 N/A LYS 258.A NZ GLU 278.A OE1 no hydrogen 2.368 N/A PHE 259.A N ASN 255.A O no hydrogen 2.946 N/A SER 260.A N LEU 256.A O no hydrogen 2.699 N/A SER 260.A OG LEU 256.A O no hydrogen 3.104 N/A SER 260.A OG THR 257.A O no hydrogen 2.839 N/A GLN 261.A NE2 LYS 258.A O no hydrogen 3.334 N/A PHE 262.A N PHE 259.A O no hydrogen 3.266 N/A LEU 263.A N SER 260.A O no hydrogen 3.234 N/A LYS 265.A N GLN 261.A O no hydrogen 2.913 N/A ASN 268.A N ASP 272.A OD2 no hydrogen 2.844 N/A ILE 270.A N ASN 268.A OD1 no hydrogen 3.019 N/A ASP 272.A N ASN 268.A O no hydrogen 2.700 N/A VAL 275.A N ASP 272.A O no hydrogen 2.832 N/A TYR 277.A N GLY 273.A O no hydrogen 3.107 N/A GLU 278.A N LYS 274.A O no hydrogen 3.096 N/A LEU 279.A N ILE 276.A O no hydrogen 3.115 N/A GLU 280.A N TYR 277.A O no hydrogen 2.864 N/A