Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s98_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N ARG 15.A O no hydrogen 3.068 N/A ASP 6.A N ILE 13.A O no hydrogen 2.983 N/A ILE 8.A N ASN 11.A O no hydrogen 3.197 N/A ASP 9.A N GLN 82.A O no hydrogen 3.036 N/A ASN 11.A N ILE 8.A O no hydrogen 2.951 N/A PHE 12.A N CYS 45.A O no hydrogen 2.881 N/A ILE 13.A N ASP 6.A O no hydrogen 2.822 N/A LEU 14.A N THR 43.A O no hydrogen 3.074 N/A ARG 15.A N GLU 4.A O no hydrogen 2.933 N/A ARG 15.A NE ASP 6.A OD2 no hydrogen 3.026 N/A ARG 15.A NH2 ASP 6.A OD1 no hydrogen 2.876 N/A ARG 15.A NH2 ASP 6.A OD2 no hydrogen 3.451 N/A THR 19.A N GLU 62.A O no hydrogen 2.939 N/A PHE 20.A N ILE 40.A O no hydrogen 2.645 N/A SER 21.A N ARG 60.A O no hydrogen 3.062 N/A PHE 22.A N CYS 37.A O no hydrogen 2.994 N/A ASP 23.A N ARG 58.A O no hydrogen 2.915 N/A TYR 24.A N ILE 32.A O no hydrogen 2.789 N/A GLN 25.A N LYS 56.A O no hydrogen 3.223 N/A GLN 25.A NE2 ASP 29.A O no hydrogen 3.482 N/A GLN 25.A NE2 ASN 30.A O no hydrogen 2.897 N/A THR 27.A N GLU 54.A O no hydrogen 3.419 N/A THR 27.A OG1 SER 74.A OG.A no hydrogen 2.939 N/A THR 27.A OG1 SER 74.A OG.B no hydrogen 3.124 N/A ILE 32.A N TYR 24.A O no hydrogen 2.830 N/A LEU 34.A N PHE 22.A O no hydrogen 2.991 N/A CYS 37.A N LEU 34.A O no hydrogen 3.122 N/A GLN 38.A NE2 PHE 22.A O no hydrogen 2.768 N/A GLN 38.A NE2 LEU 34.A O no hydrogen 3.173 N/A ASN 39.A N SER 21.A OG no hydrogen 2.925 N/A ILE 40.A N PHE 20.A O no hydrogen 2.971 N/A LYS 44.A N SER 42.A OG no hydrogen 3.052 N/A CYS 45.A N PHE 12.A O no hydrogen 2.930 N/A PHE 47.A N ASP 10.A O no hydrogen 2.988 N/A SER 48.A N ASN 46.A OD1 no hydrogen 2.912 N/A SER 48.A OG ASN 46.A OD1 no hydrogen 2.470 N/A SER 49.A OG SER 48.A O no hydrogen 2.295 N/A GLU 53.A N ASN 50.A O no hydrogen 3.010 N/A ILE 55.A N PHE 75.A O no hydrogen 2.921 N/A LYS 56.A N GLN 25.A O no hydrogen 3.048 N/A LYS 56.A NZ VAL 72.A O no hydrogen 3.002 N/A ARG 58.A N ASP 23.A O no hydrogen 2.951 N/A ARG 58.A NE ASP 23.A OD2 no hydrogen 2.755 N/A ARG 58.A NH2 ASP 23.A OD2 no hydrogen 2.880 N/A ILE 59.A N TYR 70.A O no hydrogen 2.659 N/A ARG 60.A N SER 21.A O no hydrogen 2.867 N/A ARG 60.A NE ASP 23.A OD2 no hydrogen 2.713 N/A ARG 60.A NH2 ASP 23.A OD1 no hydrogen 2.733 N/A ARG 60.A NH2 ASP 23.A OD2 no hydrogen 3.533 N/A ARG 60.A NH2 GLN 38.A OE1 no hydrogen 2.938 N/A ALA 61.A N SER 68.A O no hydrogen 2.954 N/A GLU 62.A N THR 19.A O no hydrogen 3.000 N/A LYS 63.A N THR 66.A O no hydrogen 2.915 N/A SER 68.A N ALA 61.A O no hydrogen 3.075 N/A TYR 70.A N ILE 59.A O no hydrogen 2.876 N/A VAL 72.A N LEU 57.A O no hydrogen 2.880 N/A SER 74.A OG.A THR 27.A OG1 no hydrogen 2.939 N/A SER 74.A OG.B THR 27.A OG1 no hydrogen 3.124 N/A PHE 75.A N ILE 55.A O no hydrogen 2.934 N/A PHE 78.A N VAL 51.A O no hydrogen 2.842 N/A LYS 80.A N THR 76.A O no hydrogen 3.131 N/A LYS 80.A NZ VAL 5.A O no hydrogen 2.757 N/A ALA 81.A N PRO 77.A O no hydrogen 2.864 N/A ALA 81.A N PHE 78.A O no hydrogen 3.216 N/A GLN 82.A N ILE 7.A O no hydrogen 2.795 N/A GLN 82.A NE2 ILE 7.A O no hydrogen 3.624 N/A GLY 84.A N ASP 9.A OD2 no hydrogen 2.794 N/A GLU 87.A N SER 102.A O no hydrogen 2.776 N/A HIS 89.A N HIS 100.A O no hydrogen 2.888 N/A GLU 91.A N VAL 98.A O no hydrogen 3.069 N/A GLU 93.A N ALA 96.A O no hydrogen 2.947 N/A LYS 95.A NZ GLU 172.A OE2 no hydrogen 2.830 N/A ILE 97.A N ILE 135.A O no hydrogen 2.956 N/A VAL 98.A N GLU 91.A O no hydrogen 2.969 N/A ILE 99.A N HIS 133.A O no hydrogen 2.813 N/A HIS 100.A N HIS 89.A O no hydrogen 2.876 N/A HIS 100.A NE2 GLU 91.A OE1 no hydrogen 2.702 N/A ILE 101.A N SER 131.A O no hydrogen 3.154 N/A SER 102.A N GLU 87.A O no hydrogen 3.001 N/A SER 105.A OG ASP 10.A OD2 no hydrogen 3.359 N/A VAL 106.A N ASP 10.A OD1 no hydrogen 3.244 N/A VAL 106.A N ASP 10.A OD2 no hydrogen 3.122 N/A TRP 107.A NE1 ASP 9.A OD2 no hydrogen 2.951 N/A THR 110.A N ALA 151.A O no hydrogen 2.957 N/A SER 112.A N LYS 149.A O no hydrogen 3.044 N/A LEU 113.A N ILE 126.A O no hydrogen 3.034 N/A VAL 114.A N LYS 147.A O no hydrogen 2.879 N/A ILE 115.A N GLU 124.A O no hydrogen 3.076 N/A TRP 116.A N CYS 145.A O.A no hydrogen 2.983 N/A TRP 116.A N CYS 145.A O.B no hydrogen 2.985 N/A ASN 118.A N THR 143.A O no hydrogen 3.094 N/A GLY 121.A N LYS 117.A O no hydrogen 2.948 N/A GLU 124.A N ILE 115.A O no hydrogen 2.813 N/A ILE 126.A N LEU 113.A O no hydrogen 3.118 N/A ILE 129.A N TYR 111.A O no hydrogen 2.750 N/A SER 131.A OG ASN 214.A OD1 no hydrogen 3.219 N/A LYS 134.A NZ GLU 93.A OE2 no hydrogen 2.848 N/A ILE 135.A N ILE 97.A O no hydrogen 2.891 N/A LYS 137.A NZ GLU 261.A OE2 no hydrogen 3.278 N/A LEU 138.A N LYS 95.A O no hydrogen 2.971 N/A SER 139.A N TYR 144.A OH no hydrogen 2.768 N/A GLU 141.A N THR 170.A O no hydrogen 3.092 N/A THR 142.A N THR 169.A OG1 no hydrogen 2.845 N/A THR 142.A OG1 SER 139.A O no hydrogen 3.449 N/A THR 142.A OG1 PRO 140.A O no hydrogen 2.815 N/A TYR 144.A N ILE 167.A O no hydrogen 2.781 N/A CYS 145.A N.A TRP 116.A O no hydrogen 2.994 N/A CYS 145.A N.B TRP 116.A O no hydrogen 2.989 N/A LEU 146.A N HIS 165.A O no hydrogen 2.882 N/A LYS 147.A N VAL 114.A O no hydrogen 3.061 N/A VAL 148.A N SER 162.A OG no hydrogen 3.022 N/A LYS 149.A N SER 112.A O no hydrogen 2.896 N/A LYS 149.A NZ SER 112.A OG no hydrogen 2.575 N/A LYS 149.A NZ TYR 161.A OH no hydrogen 3.090 N/A LEU 152.A N LYS 157.A O no hydrogen 2.977 N/A SER 155.A N LEU 152.A O no hydrogen 2.893 N/A TRP 156.A N LEU 153.A O no hydrogen 3.325 N/A LYS 157.A N LEU 152.A O no hydrogen 3.149 N/A LYS 157.A NZ PHE 78.A O no hydrogen 3.138 N/A LYS 157.A NZ ARG 79.A O no hydrogen 3.441 N/A LYS 157.A NZ ALA 81.A O no hydrogen 2.993 N/A GLY 159.A N ALA 150.A O no hydrogen 2.941 N/A VAL 160.A N ILE 83.A O no hydrogen 2.979 N/A SER 162.A N VAL 148.A O no hydrogen 2.802 N/A SER 162.A OG VAL 148.A O no hydrogen 3.459 N/A SER 162.A OG PRO 163.A O no hydrogen 2.953 N/A HIS 165.A N LEU 146.A O no hydrogen 3.021 N/A ILE 167.A N TYR 144.A O no hydrogen 2.827 N/A THR 169.A N THR 142.A O no hydrogen 2.974 N/A THR 169.A OG1 SER 139.A O no hydrogen 2.566 N/A THR 169.A OG1 THR 142.A O no hydrogen 3.052 N/A THR 170.A N GLU 93.A O no hydrogen 3.046 N/A THR 170.A OG1 VAL 171.A O no hydrogen 3.258 N/A ASN 173.A N ASP 94.A OD2 no hydrogen 2.808 N/A ASN 173.A ND2 THR 256.A O no hydrogen 3.100 N/A LEU 175.A N ASN 173.A OD1 no hydrogen 2.987 N/A GLU 179.A N ASP 195.A O no hydrogen 3.216 N/A ASN 180.A ND2 ASP 195.A OD2 no hydrogen 2.927 N/A GLU 182.A N LYS 193.A O no hydrogen 2.787 N/A SER 184.A N VAL 191.A O no hydrogen 3.034 N/A SER 184.A OG VAL 191.A O no hydrogen 3.511 N/A GLN 186.A N ASN 189.A O no hydrogen 3.109 N/A ASN 189.A N GLN 186.A O no hydrogen 2.916 N/A TYR 190.A N PHE 234.A O no hydrogen 2.642 N/A VAL 191.A N SER 184.A O no hydrogen 2.738 N/A LEU 192.A N CYS 232.A O no hydrogen 2.859 N/A LYS 193.A N GLU 182.A O no hydrogen 2.849 N/A TRP 194.A N THR 230.A O no hydrogen 3.138 N/A ASP 195.A N GLU 179.A O no hydrogen 2.802 N/A TYR 196.A OH PRO 176.A O no hydrogen 2.622 N/A THR 201.A N SER 251.A O no hydrogen 2.847 N/A THR 201.A OG1 ASN 226.A OD1 no hydrogen 2.725 N/A PHE 202.A N VAL 227.A O no hydrogen 3.030 N/A GLN 203.A N GLN 249.A O no hydrogen 3.217 N/A GLN 203.A NE2 GLN 249.A OE1 no hydrogen 2.877 N/A GLN 205.A N ARG 247.A O no hydrogen 2.915 N/A GLN 205.A NE2 GLN 220.A OE1 no hydrogen 2.855 N/A TRP 206.A N LYS 219.A O no hydrogen 2.856 N/A LEU 207.A N LEU 245.A O no hydrogen 2.923 N/A ALA 209.A N ILE 243.A O no hydrogen 3.145 N/A LEU 211.A N HIS 208.A O no hydrogen 3.250 N/A LYS 212.A N ALA 209.A O no hydrogen 3.196 N/A LYS 212.A NZ GLU 262.A OE1 no hydrogen 2.604 N/A LYS 212.A NZ GLU 262.A OE2 no hydrogen 3.322 N/A ARG 213.A N PHE 210.A O no hydrogen 3.170 N/A LYS 219.A N TRP 206.A O no hydrogen 3.036 N/A GLN 220.A NE2 GLN 203.A OE1 no hydrogen 2.688 N/A GLN 220.A NE2 GLU 225.A OE2 no hydrogen 3.361 N/A ILE 221.A N VAL 204.A O no hydrogen 3.028 N/A CYS 224.A N ILE 221.A O no hydrogen 2.793 N/A GLU 225.A N PRO 222.A O no hydrogen 3.003 N/A LYS 228.A NZ ASN 226.A O no hydrogen 2.853 N/A CYS 232.A N LEU 192.A O no hydrogen 2.909 N/A PHE 234.A N TYR 190.A O no hydrogen 3.080 N/A GLN 236.A N GLN 188.A O no hydrogen 2.940 N/A GLN 236.A NE2 ASN 189.A O no hydrogen 3.379 N/A VAL 238.A N PRO 235.A O no hydrogen 3.143 N/A PHE 239.A N GLN 236.A O no hydrogen 3.477 N/A GLY 242.A N THR 267.A OG1 no hydrogen 2.796 N/A TYR 244.A N PHE 265.A O no hydrogen 2.737 N/A TYR 244.A OH GLN 240.A O no hydrogen 2.736 N/A LEU 245.A N LEU 207.A O no hydrogen 2.817 N/A LEU 246.A N ILE 263.A O.A no hydrogen 2.905 N/A LEU 246.A N ILE 263.A O.B no hydrogen 2.899 N/A ARG 247.A N GLN 205.A O no hydrogen 2.956 N/A ARG 247.A NE GLN 205.A OE1 no hydrogen 2.955 N/A ARG 247.A NH2 GLN 205.A OE1 no hydrogen 2.663 N/A VAL 248.A N SER 260.A OG no hydrogen 2.991 N/A GLN 249.A N GLN 203.A O no hydrogen 3.183 N/A GLN 249.A NE2 SER 257.A O no hydrogen 3.081 N/A ALA 250.A N SER 257.A OG no hydrogen 2.931 N/A SER 251.A N THR 201.A O no hydrogen 2.784 N/A SER 251.A OG ASN 255.A O no hydrogen 2.962 N/A ASP 252.A N ASN 255.A O no hydrogen 3.354 N/A GLY 253.A N SER 251.A OG no hydrogen 2.875 N/A ASN 254.A N ASP 252.A OD1 no hydrogen 2.666 N/A ASN 255.A N ASP 252.A OD1 no hydrogen 2.906 N/A SER 257.A N ALA 250.A O no hydrogen 2.917 N/A SER 257.A OG PHE 258.A O no hydrogen 2.713 N/A SER 260.A N VAL 248.A O no hydrogen 2.929 N/A SER 260.A OG VAL 248.A O no hydrogen 3.435 N/A SER 260.A OG GLU 261.A O no hydrogen 2.917 N/A ILE 263.A N.A LEU 246.A O no hydrogen 2.918 N/A ILE 263.A N.B LEU 246.A O no hydrogen 2.896 N/A PHE 265.A N TYR 244.A O no hydrogen 2.730 N/A THR 267.A N GLY 242.A O no hydrogen 3.042 N/A THR 267.A OG1 GLN 240.A O no hydrogen 3.188 N/A THR 267.A OG1 GLY 242.A O no hydrogen 3.197 N/A