Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3h8s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N LYS 129.A O no hydrogen 2.976 N/A CYS 6.A N LYS 55.A O no hydrogen 2.754 N/A CYS 6.A SG LEU 131.A O no hydrogen 3.587 N/A LEU 7.A N LEU 131.A O no hydrogen 2.729 N/A ILE 8.A N VAL 57.A O no hydrogen 3.016 N/A ASN 9.A N ILE 133.A O no hydrogen 3.188 N/A ASN 9.A ND2 SER 134.A OG no hydrogen 3.349 N/A PHE 10.A N ILE 8.A O no hydrogen 2.863 N/A PHE 10.A N CYS 59.A O no hydrogen 3.229 N/A GLN 12.A NE2 SER 134.A OG no hydrogen 3.392 N/A ILE 13.A N ASN 9.A O no hydrogen 3.264 N/A ALA 14.A N PHE 10.A O no hydrogen 2.725 N/A LEU 15.A N SER 11.A O no hydrogen 3.176 N/A SER 16.A N GLN 12.A O no hydrogen 2.818 N/A SER 16.A OG GLN 12.A O no hydrogen 2.714 N/A THR 17.A N ILE 13.A O no hydrogen 2.933 N/A THR 17.A OG1 ILE 13.A O no hydrogen 2.706 N/A ALA 18.A N ALA 14.A O no hydrogen 2.880 N/A LEU 19.A N LEU 15.A O no hydrogen 2.791 N/A VAL 20.A N SER 16.A O no hydrogen 3.186 N/A VAL 20.A N THR 17.A O no hydrogen 3.243 N/A ASN 21.A N THR 17.A O no hydrogen 2.914 N/A PHE 22.A N ALA 18.A O no hydrogen 2.825 N/A LYS 25.A N THR 79.A O no hydrogen 2.866 N/A ILE 28.A N ASP 81.A OD2 no hydrogen 2.744 N/A SER 31.A OG ASN 29.A OD1 no hydrogen 2.828 N/A MET 32.A N ASN 29.A OD1 no hydrogen 2.778 N/A VAL 33.A N ASN 29.A O no hydrogen 3.251 N/A ARG 34.A N LEU 30.A O no hydrogen 2.860 N/A ARG 34.A NE GLU 95.A OE1 no hydrogen 3.343 N/A ARG 34.A NH2 GLU 95.A OE1 no hydrogen 3.056 N/A ARG 34.A NH2 GLU 95.A OE2 no hydrogen 2.723 N/A HIS 35.A N SER 31.A O no hydrogen 2.870 N/A HIS 35.A ND1 SER 31.A O no hydrogen 3.207 N/A LEU 36.A N MET 32.A O no hydrogen 3.206 N/A ILE 37.A N VAL 33.A O no hydrogen 2.884 N/A LEU 38.A N ARG 34.A O no hydrogen 3.005 N/A ASN 39.A N HIS 35.A O no hydrogen 2.983 N/A SER 40.A N LEU 36.A O no hydrogen 2.875 N/A ILE 41.A N ILE 37.A O no hydrogen 2.852 N/A LYS 42.A N LEU 38.A O no hydrogen 2.885 N/A PHE 43.A N ASN 39.A O no hydrogen 3.044 N/A ASN 44.A N SER 40.A O no hydrogen 3.204 N/A VAL 45.A N ILE 41.A O no hydrogen 2.834 N/A LYS 46.A N LYS 42.A O no hydrogen 3.208 N/A ALA 48.A N ASN 44.A O no hydrogen 3.022 N/A LYS 49.A N VAL 45.A O no hydrogen 2.892 N/A THR 50.A N LYS 46.A O no hydrogen 3.264 N/A THR 50.A OG1 LYS 46.A O no hydrogen 2.612 N/A LEU 51.A N ALA 48.A O no hydrogen 2.973 N/A GLY 52.A N LYS 49.A O no hydrogen 3.061 N/A TYR 53.A N ALA 48.A O no hydrogen 3.037 N/A THR 54.A OG1 GLU 3.A OE2 no hydrogen 2.666 N/A LYS 55.A N GLY 4.A O no hydrogen 2.982 N/A VAL 57.A N CYS 6.A O no hydrogen 2.932 N/A LEU 58.A N ILE 103.A O no hydrogen 2.902 N/A CYS 59.A N ILE 8.A O no hydrogen 2.938 N/A CYS 59.A SG VAL 57.A O no hydrogen 3.946 N/A ILE 60.A N MET 105.A O no hydrogen 3.018 N/A ASP 61.A N SER 11.A OG no hydrogen 2.648 N/A ASN 62.A N TYR 110.A O no hydrogen 3.213 N/A ASN 62.A ND2 ASP 106.A OD1 no hydrogen 2.885 N/A LYS 64.A N ASN 62.A OD1 no hydrogen 3.319 N/A SER 65.A N ASP 108.A OD1 no hydrogen 2.930 N/A SER 65.A OG ASP 108.A OD2 no hydrogen 2.782 N/A GLY 66.A N ALA 63.A O no hydrogen 3.274 N/A TRP 68.A N LYS 109.A O no hydrogen 2.960 N/A TRP 68.A NE1 ASP 114.A OD2 no hydrogen 2.768 N/A ARG 69.A NE VAL 235.A O no hydrogen 3.168 N/A ARG 69.A NH1 GLU 111.A OE2 no hydrogen 3.048 N/A ARG 69.A NH1 ASP 114.A OD1 no hydrogen 2.834 N/A ARG 69.A NH2 ASP 114.A OD1 no hydrogen 3.430 N/A ARG 70.A N TYR 67.A O no hydrogen 2.976 N/A ARG 70.A NE TYR 76.A O no hydrogen 2.884 N/A ARG 70.A NH2 TYR 76.A O no hydrogen 3.270 N/A ARG 70.A NH2 LYS 77.A O no hydrogen 2.864 N/A ASP 71.A N TRP 68.A O no hydrogen 3.110 N/A PHE 72.A N ARG 69.A O no hydrogen 3.032 N/A ALA 73.A N ARG 69.A O no hydrogen 2.960 N/A TYR 74.A OH ASP 189.A OD2 no hydrogen 2.575 N/A TYR 76.A N ALA 73.A O no hydrogen 3.006 N/A TYR 76.A OH GLU 111.A OE1 no hydrogen 3.293 N/A TYR 76.A OH GLU 111.A OE2 no hydrogen 2.660 N/A LYS 77.A N ASP 179.A O no hydrogen 3.133 N/A LYS 77.A NZ ASP 179.A OD1 no hydrogen 2.824 N/A LYS 78.A N TYR 75.A O no hydrogen 3.176 N/A TRP 80.A NE1 PHE 22.A O no hydrogen 2.819 N/A TRP 82.A N TRP 80.A O no hydrogen 2.880 N/A GLY 84.A N ASP 81.A OD1 no hydrogen 2.828 N/A TYR 85.A N ASP 81.A O no hydrogen 3.226 N/A PHE 86.A N TRP 82.A O no hydrogen 2.991 N/A GLU 87.A N GLU 83.A O no hydrogen 2.972 N/A SER 88.A N GLY 84.A O no hydrogen 3.263 N/A SER 88.A OG GLY 84.A O no hydrogen 3.059 N/A SER 89.A N TYR 85.A O no hydrogen 2.648 N/A SER 89.A OG TYR 85.A O no hydrogen 3.039 N/A SER 89.A OG PHE 86.A O no hydrogen 2.903 N/A HIS 90.A N PHE 86.A O no hydrogen 3.074 N/A HIS 90.A ND1 PHE 86.A O no hydrogen 2.724 N/A VAL 92.A N SER 88.A O no hydrogen 2.917 N/A ILE 93.A N SER 89.A O no hydrogen 2.779 N/A ASP 94.A N HIS 90.A O no hydrogen 3.294 N/A GLU 95.A N LYS 91.A O no hydrogen 3.343 N/A LEU 96.A N VAL 92.A O no hydrogen 2.973 N/A LYS 97.A N ILE 93.A O no hydrogen 3.094 N/A LYS 97.A NZ ASP 106.A OD2 no hydrogen 2.877 N/A ALA 98.A N GLU 95.A O no hydrogen 2.963 N/A TYR 99.A N GLU 95.A O no hydrogen 3.023 N/A MET 100.A N LEU 96.A O no hydrogen 3.278 N/A MET 105.A N LEU 58.A O no hydrogen 2.819 N/A LYS 109.A N ASN 62.A O no hydrogen 2.734 N/A TYR 110.A N ILE 107.A O no hydrogen 3.015 N/A GLU 111.A N ASP 114.A OD2 no hydrogen 2.795 N/A ALA 112.A N ASP 61.A OD1 no hydrogen 2.666 N/A ASP 114.A N GLU 111.A O no hydrogen 2.962 N/A HIS 115.A N GLU 111.A O no hydrogen 3.307 N/A ILE 116.A N ALA 112.A O no hydrogen 3.050 N/A ALA 117.A N ASP 113.A O no hydrogen 2.889 N/A VAL 118.A N ASP 114.A O no hydrogen 2.925 N/A LEU 119.A N HIS 115.A O no hydrogen 2.855 N/A VAL 120.A N ILE 116.A O no hydrogen 2.760 N/A LYS 121.A N ALA 117.A O no hydrogen 3.293 N/A LYS 122.A N VAL 118.A O no hydrogen 2.901 N/A LYS 122.A NZ GLU 126.A OE2 no hydrogen 2.957 N/A PHE 123.A N LEU 119.A O no hydrogen 2.933 N/A SER 124.A N VAL 120.A O no hydrogen 2.952 N/A SER 124.A OG PRO 146.A O no hydrogen 2.952 N/A LEU 125.A N LYS 121.A O no hydrogen 3.291 N/A GLY 127.A N SER 124.A O no hydrogen 3.331 N/A HIS 128.A N PHE 123.A O no hydrogen 2.943 N/A HIS 128.A ND1 GLU 3.A O no hydrogen 2.872 N/A ILE 130.A N ASN 147.A O no hydrogen 2.681 N/A LEU 131.A N ILE 5.A O no hydrogen 2.899 N/A ILE 132.A N LYS 149.A O no hydrogen 2.752 N/A ILE 133.A N LEU 7.A O no hydrogen 2.945 N/A SER 134.A N TRP 151.A O no hydrogen 2.935 N/A SER 134.A OG GLN 12.A OE1 no hydrogen 3.511 N/A ASP 136.A N SER 134.A OG no hydrogen 3.173 N/A ASP 138.A N ASP 136.A OD2 no hydrogen 2.780 N/A THR 140.A N GLY 137.A O no hydrogen 3.050 N/A THR 140.A OG1 GLY 137.A O no hydrogen 2.605 N/A GLN 141.A N ASP 138.A O no hydrogen 3.172 N/A GLN 141.A NE2 ILE 237.A O no hydrogen 3.444 N/A LEU 142.A N PHE 139.A O no hydrogen 2.972 N/A HIS 143.A N THR 140.A O no hydrogen 3.318 N/A HIS 143.A ND1 PHE 139.A O no hydrogen 3.018 N/A HIS 143.A NE2 VAL 159.A O no hydrogen 2.811 N/A LYS 144.A NZ ASP 240.A OD2 no hydrogen 2.690 N/A TYR 145.A N LEU 142.A O no hydrogen 3.152 N/A TYR 145.A OH ASP 240.A OD1 no hydrogen 3.304 N/A LYS 149.A N ILE 130.A O no hydrogen 3.004 N/A GLN 150.A NE2 SER 134.A O no hydrogen 2.788 N/A GLN 150.A NE2 ASP 136.A O no hydrogen 2.954 N/A TRP 151.A N ILE 132.A O no hydrogen 2.768 N/A SER 152.A N LYS 157.A O no hydrogen 2.985 N/A VAL 159.A N GLN 150.A O no hydrogen 2.831 N/A LYS 160.A NZ TRP 158.A O no hydrogen 3.219 N/A ASP 167.A N SER 163.A O no hydrogen 3.030 N/A CYS 168.A N ALA 164.A O no hydrogen 2.942 N/A MET 169.A N GLU 165.A O no hydrogen 2.905 N/A THR 170.A N ILE 166.A O no hydrogen 2.863 N/A THR 170.A OG1 ILE 166.A O no hydrogen 2.678 N/A LYS 171.A NZ ASP 138.A OD1 no hydrogen 2.959 N/A LYS 171.A NZ ASP 138.A OD2 no hydrogen 3.455 N/A LYS 171.A NZ ASP 176.A OD2 no hydrogen 3.012 N/A ILE 172.A N CYS 168.A O no hydrogen 3.116 N/A LEU 173.A N MET 169.A O no hydrogen 2.879 N/A LYS 174.A N THR 170.A O no hydrogen 2.765 N/A ASP 176.A N VAL 181.A O no hydrogen 2.625 N/A ASP 179.A N ASP 176.A O no hydrogen 2.846 N/A ASN 180.A N LYS 177.A O no hydrogen 2.910 N/A ASN 180.A ND2 TYR 75.A O no hydrogen 3.146 N/A ASN 180.A ND2 LYS 78.A O no hydrogen 3.262 N/A VAL 181.A N ASP 176.A O no hydrogen 3.178 N/A SER 183.A OG LEU 173.A O no hydrogen 3.008 N/A VAL 184.A N LEU 173.A O no hydrogen 2.934 N/A LYS 185.A N SER 183.A OG no hydrogen 3.111 N/A LYS 185.A NZ GLU 226.A OE2 no hydrogen 3.392 N/A VAL 186.A N SER 183.A O no hydrogen 3.264 N/A ARG 187.A NE THR 193.A OG1 no hydrogen 2.897 N/A ARG 187.A NH1 GLU 198.A OE1 no hydrogen 3.453 N/A ARG 187.A NH1 GLU 198.A OE2 no hydrogen 3.228 N/A ARG 187.A NH2 THR 193.A O no hydrogen 2.766 N/A ARG 187.A NH2 THR 193.A OG1 no hydrogen 3.334 N/A ARG 187.A NH2 GLU 198.A OE1 no hydrogen 2.794 N/A ARG 187.A NH2 GLU 198.A OE2 no hydrogen 3.217 N/A SER 188.A OG GLU 232.A OE1 no hydrogen 2.664 N/A PHE 190.A N ARG 187.A O no hydrogen 3.019 N/A PHE 192.A N ASP 189.A O no hydrogen 2.999 N/A THR 193.A N ASP 189.A O no hydrogen 2.959 N/A THR 193.A N PHE 190.A O no hydrogen 3.163 N/A THR 193.A OG1 ASP 189.A O no hydrogen 3.010 N/A THR 193.A OG1 ASP 189.A OD1 no hydrogen 3.229 N/A ARG 194.A NH2 GLU 198.A O no hydrogen 3.110 N/A VAL 195.A N GLU 198.A OE1 no hydrogen 2.931 N/A ILE 207.A N LYS 204.A O no hydrogen 3.258 N/A VAL 208.A N LYS 204.A O no hydrogen 3.338 N/A GLU 209.A N THR 205.A O no hydrogen 2.957 N/A ALA 210.A N SER 206.A O no hydrogen 3.046 N/A ILE 211.A N ILE 207.A O no hydrogen 3.012 N/A ALA 212.A N VAL 208.A O no hydrogen 3.077 N/A ASN 213.A N GLU 209.A O no hydrogen 2.889 N/A ASP 214.A N ALA 210.A O no hydrogen 3.116 N/A ASP 214.A N ILE 211.A O no hydrogen 3.227 N/A ARG 215.A NH1 ASP 238.A OD2 no hydrogen 2.895 N/A ARG 215.A NH2 ASP 238.A OD2 no hydrogen 2.854 N/A GLU 216.A N ASP 214.A OD1 no hydrogen 3.359 N/A GLN 217.A N ASP 214.A O no hydrogen 2.906 N/A GLN 217.A NE2 ASP 214.A OD2 no hydrogen 3.113 N/A ALA 218.A N ARG 215.A O no hydrogen 3.012 N/A LYS 219.A N GLU 216.A O no hydrogen 3.426 N/A VAL 220.A N GLN 217.A O no hydrogen 3.042 N/A LEU 221.A N GLN 217.A O no hydrogen 2.840 N/A THR 223.A N GLU 226.A OE1 no hydrogen 3.057 N/A GLU 226.A N THR 223.A OG1 no hydrogen 3.242 N/A TYR 227.A N THR 223.A O no hydrogen 2.710 N/A ASN 228.A N GLU 224.A O no hydrogen 3.092 N/A ARG 229.A N SER 225.A O no hydrogen 3.190 N/A ARG 229.A NE VAL 186.A O no hydrogen 2.810 N/A ARG 229.A NH1 ASN 233.A OD1 no hydrogen 2.999 N/A ARG 229.A NH2 SER 183.A O no hydrogen 3.054 N/A TYR 230.A N GLU 226.A O no hydrogen 2.805 N/A LYS 231.A N TYR 227.A O no hydrogen 3.037 N/A GLU 232.A N ASN 228.A O no hydrogen 3.139 N/A ASN 233.A N ARG 229.A O no hydrogen 2.918 N/A ASN 233.A ND2 ILE 172.A O no hydrogen 2.836 N/A ASN 233.A ND2 ALA 182.A O no hydrogen 2.893 N/A LEU 234.A N TYR 230.A O no hydrogen 3.154 N/A VAL 235.A N GLU 232.A O no hydrogen 3.294 N/A LEU 236.A N ASN 233.A O no hydrogen 3.082 N/A ILE 237.A N ASN 233.A O no hydrogen 2.847 N/A ASP 238.A N LEU 234.A O no hydrogen 2.964 N/A PHE 239.A N GLN 141.A OE1 no hydrogen 3.059 N/A ASP 240.A N ASP 238.A OD1 no hydrogen 2.719 N/A TYR 241.A N ASP 238.A O no hydrogen 3.084 N/A ILE 242.A N PHE 239.A O no hydrogen 3.073 N/A ALA 247.A N PRO 243.A O no hydrogen 3.121 N/A SER 248.A N ASP 244.A O no hydrogen 2.772 N/A ASN 249.A N ASN 245.A O no hydrogen 3.050 N/A ASN 249.A ND2 TYR 110.A OH no hydrogen 2.853 N/A ILE 250.A N ILE 246.A O no hydrogen 2.996 N/A VAL 251.A N ALA 247.A O no hydrogen 2.902 N/A ASN 252.A N SER 248.A O no hydrogen 2.989 N/A TYR 253.A N ASN 249.A O no hydrogen 2.928 N/A TYR 253.A OH VAL 104.A O no hydrogen 2.760 N/A TYR 254.A N ILE 250.A O no hydrogen 3.122 N/A ASN 255.A N VAL 251.A O no hydrogen 2.904 N/A SER 256.A N ASN 252.A O no hydrogen 2.938 N/A SER 256.A N TYR 253.A O no hydrogen 3.161 N/A SER 256.A OG ASN 252.A O no hydrogen 2.802 N/A TYR 257.A N TYR 254.A O no hydrogen 3.197 N/A ARG 262.A NH1 ILE 281.A O no hydrogen 3.541 N/A ARG 262.A NH2 PHE 284.A O no hydrogen 2.774 N/A LYS 264.A N PRO 261.A O no hydrogen 3.004 N/A ILE 265.A N ARG 262.A O no hydrogen 3.099 N/A SER 267.A OG GLY 263.A O no hydrogen 3.564 N/A SER 267.A OG LYS 264.A O no hydrogen 2.943 N/A TYR 268.A N LYS 264.A O no hydrogen 3.014 N/A TYR 268.A OH GLU 95.A OE1 no hydrogen 2.784 N/A PHE 269.A N ILE 265.A O no hydrogen 2.788 N/A VAL 270.A N TYR 266.A O no hydrogen 3.048 N/A LYS 271.A N SER 267.A O no hydrogen 3.073 N/A LYS 271.A NZ TYR 99.A OH no hydrogen 3.212 N/A ALA 272.A N TYR 268.A O no hydrogen 2.901 N/A GLY 273.A N VAL 270.A O no hydrogen 2.920 N/A LEU 274.A N PHE 269.A O no hydrogen 2.695 N/A THR 278.A N SER 275.A O no hydrogen 3.305 N/A THR 278.A OG1 SER 275.A O no hydrogen 2.801 N/A SER 280.A N LEU 277.A O no hydrogen 2.820 N/A ASN 282.A ND2 ASN 279.A O no hydrogen 3.611 N/A GLU 283.A N SER 280.A O no hydrogen 2.799 N/A PHE 284.A N ILE 281.A O no hydrogen 2.930 N/A