Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fcg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 8.A NH1.A ASP 80.A OD2 no hydrogen 3.459 N/A HIS 11.A ND1.B GLU 58.A OE1 no hydrogen 3.223 N/A VAL 13.A N PRO 9.A O no hydrogen 3.058 N/A LEU 14.A N TYR 10.A O no hydrogen 2.775 N/A SER 15.A N HIS 11.A O.A no hydrogen 2.966 N/A SER 15.A N HIS 11.A O.B no hydrogen 2.906 N/A SER 15.A OG ASP 12.A O no hydrogen 3.274 N/A GLN 16.A N.A ASP 12.A O no hydrogen 3.001 N/A GLN 16.A N.B ASP 12.A O no hydrogen 2.999 N/A TRP 17.A N VAL 13.A O no hydrogen 2.864 N/A TRP 17.A NE1 GLN 77.A O no hydrogen 2.888 N/A GLN 18.A N LEU 14.A O no hydrogen 2.992 N/A GLN 18.A NE2 LEU 14.A O no hydrogen 3.182 N/A ARG 19.A N.A SER 15.A O no hydrogen 3.129 N/A ARG 19.A N.B SER 15.A O no hydrogen 3.131 N/A ARG 19.A NH1.B GLN 16.A OE1.A no hydrogen 2.927 N/A ARG 19.A NH2.A GLN 16.A OE1.A no hydrogen 3.101 N/A HIS 20.A N GLN 16.A O.A no hydrogen 2.903 N/A HIS 20.A N GLN 16.A O.B no hydrogen 2.897 N/A TYR 21.A N TRP 17.A O no hydrogen 3.085 N/A ASN 22.A N GLN 18.A O no hydrogen 2.890 N/A ALA 23.A N ARG 19.A O.A no hydrogen 3.146 N/A ALA 23.A N ARG 19.A O.B no hydrogen 3.083 N/A ASP 24.A N HIS 20.A O no hydrogen 2.810 N/A ARG 25.A NE ASN 22.A O no hydrogen 2.804 N/A ARG 25.A NH2 ASN 22.A O no hydrogen 3.506 N/A ARG 25.A NH2 ASN 22.A OD1 no hydrogen 2.900 N/A TRP 28.A N ASN 26.A O no hydrogen 2.751 N/A TRP 28.A NE1 ASP 24.A O no hydrogen 2.890 N/A HIS 29.A N ARG 25.A O no hydrogen 3.256 N/A HIS 29.A NE2 THR 46.A OG1 no hydrogen 2.901 N/A SER 30.A OG ARG 27.A O no hydrogen 3.491 N/A ALA 31.A N ARG 27.A O no hydrogen 3.271 N/A TRP 32.A N TRP 28.A O no hydrogen 2.813 N/A TRP 32.A NE1 SER 72.A O no hydrogen 3.072 N/A ARG 33.A N HIS 29.A O no hydrogen 3.004 N/A GLN 34.A N SER 30.A O no hydrogen 2.811 N/A ALA 35.A N ALA 31.A O no hydrogen 2.984 N/A ASN 36.A N ARG 33.A O no hydrogen 3.150 N/A ASN 36.A ND2 TRP 32.A O no hydrogen 2.874 N/A ASN 36.A ND2 ALA 94.A O no hydrogen 2.968 N/A SER 37.A N GLN 34.A O no hydrogen 3.141 N/A SER 37.A OG GLN 34.A O no hydrogen 3.418 N/A SER 37.A OG ASN 38.A OD1 no hydrogen 3.536 N/A ASN 39.A N.A ASN 36.A O no hydrogen 2.984 N/A ASN 39.A N.B ASN 36.A O no hydrogen 3.019 N/A ASN 39.A ND2.A ASN 36.A OD1 no hydrogen 3.182 N/A GLN 41.A N ASN 39.A OD1.B no hydrogen 2.958 N/A ILE 42.A N ASN 39.A O.A no hydrogen 3.434 N/A ARG 45.A N GLU 43.A OE2 no hydrogen 2.979 N/A ARG 45.A NE GLU 43.A OE2 no hydrogen 2.802 N/A ARG 45.A NH1 GLU 43.A OE1 no hydrogen 2.799 N/A ARG 45.A NH1 GLU 43.A OE2 no hydrogen 3.509 N/A THR 46.A OG1 HIS 29.A NE2 no hydrogen 2.901 N/A ALA 49.A N ARG 45.A O no hydrogen 2.906 N/A LEU 50.A N THR 46.A O no hydrogen 2.986 N/A LYS 51.A N GLY 47.A O no hydrogen 2.967 N/A LYS 51.A NZ ASP 55.A OD1 no hydrogen 3.058 N/A ALA 52.A N ARG 48.A O no hydrogen 3.001 N/A THR 53.A N ALA 49.A O no hydrogen 3.133 N/A THR 53.A OG1 ALA 49.A O no hydrogen 3.336 N/A THR 53.A OG1 PRO 74.A O no hydrogen 2.710 N/A ALA 54.A N LEU 50.A O no hydrogen 2.918 N/A ASP 55.A N LYS 51.A O no hydrogen 2.914 N/A LEU 56.A N ALA 52.A O no hydrogen 3.132 N/A LEU 57.A N THR 53.A O no hydrogen 2.894 N/A GLU 58.A N ALA 54.A O no hydrogen 2.923 N/A ASP 59.A N.A ASP 55.A O no hydrogen 3.028 N/A ASP 59.A N.B ASP 55.A O no hydrogen 3.026 N/A ALA 60.A N LEU 56.A O no hydrogen 3.005 N/A THR 61.A N GLU 58.A O no hydrogen 3.296 N/A THR 61.A OG1 GLU 58.A O no hydrogen 2.706 N/A GLN 62.A N ASP 59.A O.A no hydrogen 3.110 N/A GLN 62.A N ASP 59.A O.B no hydrogen 3.105 N/A ARG 65.A NE ASP 59.A O.A no hydrogen 3.021 N/A ARG 65.A NE ASP 59.A O.B no hydrogen 3.024 N/A LEU 68.A N HIS 90.A O no hydrogen 3.084 N/A LEU 70.A N THR 91.A O no hydrogen 2.784 N/A SER 72.A N ASP 93.A O no hydrogen 2.791 N/A SER 72.A OG ASN 36.A OD1 no hydrogen 2.620 N/A LEU 75.A N ALA 95.A O no hydrogen 2.746 N/A GLN 81.A NE2 ARG 8.A O.A no hydrogen 2.819 N/A GLN 81.A NE2 ARG 8.A O.B no hydrogen 2.745 N/A ARG 84.A N GLN 81.A O no hydrogen 3.138 N/A ARG 84.A NE GLN 81.A OE1 no hydrogen 2.806 N/A ARG 84.A NH2 GLN 81.A OE1 no hydrogen 2.933 N/A LEU 85.A N ALA 82.A O no hydrogen 2.874 N/A SER 86.A N PHE 83.A O no hydrogen 3.128 N/A SER 86.A OG PHE 83.A O no hydrogen 3.136 N/A LEU 88.A N LEU 85.A O no hydrogen 3.128 N/A GLN 89.A N VAL 66.A O no hydrogen 2.787 N/A HIS 90.A N VAL 66.A O no hydrogen 3.155 N/A HIS 90.A ND1 THR 110.A OG1 no hydrogen 2.655 N/A THR 91.A OG1 GLU 69.A OE1 no hydrogen 3.199 N/A ILE 92.A N THR 112.A O no hydrogen 2.885 N/A ASP 93.A N LEU 70.A O no hydrogen 2.872 N/A ALA 94.A N ALA 114.A O no hydrogen 2.807 N/A ALA 95.A N ASN 116.A OD1 no hydrogen 2.982 N/A LEU 97.A N ASN 116.A OD1 no hydrogen 3.272 N/A GLN 104.A N THR 102.A O no hydrogen 3.139 N/A GLN 104.A NE2 THR 102.A O no hydrogen 3.075 N/A LEU 108.A N PHE 105.A O no hydrogen 3.154 N/A GLU 109.A N GLN 89.A O no hydrogen 2.667 N/A THR 110.A N GLN 89.A O no hydrogen 3.140 N/A THR 110.A OG1 HIS 90.A ND1 no hydrogen 2.655 N/A LEU 111.A N GLU 133.A O no hydrogen 3.041 N/A LEU 113.A N SER 135.A O.A no hydrogen 2.855 N/A LEU 113.A N SER 135.A O.B no hydrogen 2.831 N/A ALA 114.A N ILE 92.A O no hydrogen 2.952 N/A ARG 115.A N ARG 137.A O no hydrogen 2.929 N/A ARG 115.A NE ASP 93.A OD1 no hydrogen 2.959 N/A ARG 115.A NH2 ASP 93.A OD1 no hydrogen 3.171 N/A ASN 116.A ND2 ILE 92.A O no hydrogen 2.983 N/A SER 124.A OG ASP 101.A O no hydrogen 2.688 N/A ILE 125.A N PRO 122.A O no hydrogen 3.061 N/A ALA 126.A N ALA 123.A O no hydrogen 3.172 N/A SER 127.A N SER 124.A O no hydrogen 2.894 N/A SER 127.A OG SER 124.A O no hydrogen 2.780 N/A LEU 128.A N ILE 125.A O no hydrogen 3.221 N/A ASN 129.A N SER 127.A O no hydrogen 2.920 N/A ASN 129.A ND2 SER 127.A O no hydrogen 3.328 N/A LEU 131.A N LEU 128.A O no hydrogen 3.050 N/A ARG 132.A N.A GLU 109.A O no hydrogen 2.670 N/A ARG 132.A N.B GLU 109.A O no hydrogen 2.661 N/A ARG 132.A NE.A GLN 164.A OE1 no hydrogen 2.671 N/A ARG 132.A NH1.A GLN 164.A OE1 no hydrogen 2.912 N/A ARG 132.A NH1.B GLU 109.A OE1 no hydrogen 3.179 N/A ARG 132.A NH2.B GLU 133.A OE2 no hydrogen 2.909 N/A GLU 133.A N GLU 109.A O no hydrogen 3.210 N/A LEU 134.A N SER 165.A O no hydrogen 3.012 N/A SER 135.A N.A LEU 111.A O no hydrogen 2.949 N/A SER 135.A N.B LEU 111.A O no hydrogen 2.952 N/A ILE 136.A N ARG 167.A O no hydrogen 2.787 N/A ARG 137.A N LEU 113.A O no hydrogen 2.960 N/A ALA 138.A N GLU 169.A O no hydrogen 2.815 N/A CYS 139.A SG LEU 113.A O no hydrogen 4.032 N/A CYS 139.A SG ASN 116.A O no hydrogen 3.799 N/A CYS 139.A SG ARG 137.A O no hydrogen 3.700 N/A LEU 142.A N CYS 139.A O no hydrogen 3.229 N/A LEU 149.A N SER 179.A OG no hydrogen 3.045 N/A SER 151.A N GLN 158.A O no hydrogen 2.925 N/A THR 152.A OG1 HIS 157.A ND1 no hydrogen 3.186 N/A ASP 153.A N GLU 156.A O no hydrogen 2.872 N/A SER 154.A OG ASP 153.A OD2 no hydrogen 3.295 N/A GLY 155.A N ASP 153.A O no hydrogen 3.152 N/A HIS 157.A ND1 THR 152.A OG1 no hydrogen 3.186 N/A GLN 158.A N SER 151.A O no hydrogen 2.997 N/A LEU 160.A N LEU 149.A O no hydrogen 3.005 N/A VAL 161.A N GLY 159.A O no hydrogen 2.808 N/A ASN 162.A ND2 ASN 129.A O no hydrogen 2.639 N/A LEU 163.A N LEU 160.A O no hydrogen 3.304 N/A GLN 164.A N ARG 132.A O.A no hydrogen 2.742 N/A GLN 164.A N ARG 132.A O.B no hydrogen 2.698 N/A SER 165.A N ARG 132.A O.A no hydrogen 3.136 N/A SER 165.A N ARG 132.A O.B no hydrogen 3.133 N/A LEU 166.A N SER 188.A O no hydrogen 3.010 N/A ARG 167.A N LEU 134.A O no hydrogen 2.865 N/A LEU 168.A N LYS 190.A O no hydrogen 2.772 N/A GLU 169.A N ILE 136.A O no hydrogen 2.794 N/A TRP 170.A N ARG 192.A O no hydrogen 2.887 N/A THR 171.A N SER 194.A OG no hydrogen 3.103 N/A THR 171.A OG1 SER 194.A OG no hydrogen 2.907 N/A GLY 172.A N LEU 142.A O no hydrogen 2.781 N/A ILE 173.A N THR 171.A OG1 no hydrogen 3.346 N/A ILE 180.A N PRO 177.A O no hydrogen 3.079 N/A ALA 181.A N ALA 178.A O no hydrogen 3.213 N/A ASN 182.A N SER 179.A O no hydrogen 2.813 N/A ASN 182.A ND2 ALA 150.A O no hydrogen 2.977 N/A LEU 183.A N ILE 180.A O no hydrogen 3.262 N/A GLN 184.A NE2 ASN 182.A O no hydrogen 3.325 N/A ASN 185.A ND2 VAL 161.A O no hydrogen 2.583 N/A LEU 186.A N LEU 183.A O no hydrogen 3.384 N/A LYS 187.A N GLN 164.A O no hydrogen 2.800 N/A SER 188.A N GLN 164.A O no hydrogen 3.104 N/A SER 188.A OG GLU 211.A OE1 no hydrogen 2.726 N/A LEU 189.A N GLU 211.A O no hydrogen 2.912 N/A LYS 190.A N LEU 166.A O no hydrogen 2.917 N/A ILE 191.A N ASP 213.A O no hydrogen 2.867 N/A ARG 192.A N LEU 168.A O no hydrogen 2.892 N/A ARG 192.A NE ASP 213.A OD1 no hydrogen 3.333 N/A ARG 192.A NE ASP 213.A OD2 no hydrogen 3.253 N/A ARG 192.A NH2 ASP 213.A OD2 no hydrogen 2.712 N/A ASN 193.A N ARG 215.A O no hydrogen 2.967 N/A SER 194.A OG THR 171.A OG1 no hydrogen 2.907 N/A SER 194.A OG ARG 192.A O no hydrogen 2.995 N/A SER 197.A N ARG 174.A O no hydrogen 2.711 N/A SER 197.A OG ARG 174.A O no hydrogen 3.204 N/A ILE 203.A N GLY 200.A O no hydrogen 3.277 N/A HIS 204.A N PRO 201.A O no hydrogen 3.063 N/A HIS 204.A ND1 PRO 225.A O no hydrogen 3.069 N/A HIS 204.A NE2 TYR 223.A OH no hydrogen 2.844 N/A HIS 205.A N ALA 202.A O no hydrogen 2.670 N/A LEU 206.A N.A ILE 203.A O no hydrogen 3.513 N/A LEU 206.A N.B ILE 203.A O no hydrogen 3.513 N/A LYS 208.A NZ ASN 185.A OD1 no hydrogen 2.738 N/A GLU 210.A N LYS 187.A O no hydrogen 2.852 N/A GLU 211.A N LYS 187.A O no hydrogen 3.064 N/A LEU 212.A N ARG 235.A O no hydrogen 2.926 N/A ASP 213.A N LEU 189.A O no hydrogen 2.865 N/A LEU 214.A N ILE 237.A O no hydrogen 2.773 N/A ARG 215.A N ASP 213.A OD1 no hydrogen 3.234 N/A ARG 215.A NE ASP 213.A OD1 no hydrogen 3.258 N/A ARG 215.A NH2 ASP 213.A OD2 no hydrogen 2.874 N/A GLY 216.A N LYS 239.A O no hydrogen 2.952 N/A CYS 217.A N LEU 214.A O no hydrogen 3.241 N/A CYS 217.A SG ILE 191.A O no hydrogen 3.058 N/A CYS 217.A SG SER 194.A O no hydrogen 3.738 N/A CYS 217.A SG LEU 214.A O no hydrogen 3.311 N/A LEU 220.A N CYS 217.A O no hydrogen 3.337 N/A ARG 221.A NH2 ALA 219.A O no hydrogen 3.131 N/A TYR 223.A N THR 246.A O no hydrogen 3.355 N/A TYR 223.A OH HIS 204.A NE2 no hydrogen 2.844 N/A ILE 226.A N ASP 250.A OD1 no hydrogen 3.088 N/A PHE 227.A N ASP 250.A OD2 no hydrogen 2.971 N/A GLY 229.A N ILE 226.A O no hydrogen 2.911 N/A ALA 231.A N HIS 204.A O no hydrogen 2.905 N/A LEU 233.A N ALA 231.A O no hydrogen 2.697 N/A LYS 234.A N GLU 210.A O no hydrogen 2.747 N/A LYS 234.A NZ GLU 258.A OE2 no hydrogen 2.919 N/A ARG 235.A N GLU 210.A O no hydrogen 3.017 N/A ARG 235.A NE GLU 211.A OE2 no hydrogen 3.071 N/A ARG 235.A NH2 GLU 211.A OE2 no hydrogen 2.837 N/A LEU 236.A N LYS 259.A O no hydrogen 2.853 N/A ILE 237.A N LEU 212.A O no hydrogen 2.974 N/A LEU 238.A N ASP 261.A O no hydrogen 2.875 N/A ASP 240.A N ARG 263.A O no hydrogen 2.690 N/A CYS 241.A N LEU 238.A O no hydrogen 3.197 N/A CYS 241.A SG LEU 214.A O no hydrogen 3.121 N/A CYS 241.A SG CYS 217.A O no hydrogen 3.633 N/A CYS 241.A SG LEU 238.A O no hydrogen 3.482 N/A SER 242.A OG.A ASP 240.A O no hydrogen 3.403 N/A ASN 243.A ND2 THR 218.A O no hydrogen 2.612 N/A LEU 244.A N CYS 241.A O no hydrogen 3.129 N/A LEU 245.A N ARG 221.A O no hydrogen 2.773 N/A THR 246.A OG1 ASN 222.A OD1 no hydrogen 2.676 N/A ARG 253.A N ASP 250.A O no hydrogen 2.940 N/A ARG 253.A NH1 PHE 227.A O no hydrogen 2.506 N/A LEU 254.A N ILE 251.A O no hydrogen 3.102 N/A LEU 257.A N LEU 254.A O no hydrogen 3.112 N/A GLU 258.A N LYS 234.A O no hydrogen 2.671 N/A LYS 259.A N LYS 234.A O no hydrogen 2.987 N/A LEU 260.A N ILE 283.A O no hydrogen 2.910 N/A ASP 261.A N LEU 236.A O no hydrogen 3.040 N/A LEU 262.A N LEU 285.A O no hydrogen 2.621 N/A ARG 263.A N ASP 261.A OD1 no hydrogen 3.209 N/A ARG 263.A NE ASP 261.A OD1 no hydrogen 3.045 N/A ARG 263.A NH1 ASP 261.A OD2 no hydrogen 2.740 N/A CYS 265.A N LEU 262.A O no hydrogen 3.102 N/A CYS 265.A SG LEU 238.A O no hydrogen 3.061 N/A CYS 265.A SG CYS 241.A O no hydrogen 3.661 N/A ASN 267.A ND2 SER 242.A O.A no hydrogen 2.646 N/A ASN 267.A ND2 SER 242.A O.B no hydrogen 2.540 N/A ASN 267.A ND2 ASN 243.A OD1 no hydrogen 3.360 N/A LEU 268.A N CYS 265.A O no hydrogen 3.348 N/A LEU 271.A N GLN 293.A OE1 no hydrogen 3.090 N/A ILE 275.A N PRO 272.A O no hydrogen 3.189 N/A GLN 277.A N LEU 274.A O no hydrogen 3.009 N/A LEU 278.A N ILE 275.A O no hydrogen 3.434 N/A CYS 282.A N PRO 279.A O no hydrogen 3.026 N/A CYS 282.A SG ILE 283.A O no hydrogen 4.046 N/A ILE 283.A N GLU 258.A O no hydrogen 2.892 N/A LEU 285.A N LEU 260.A O no hydrogen 2.864 N/A HIS 289.A NE2 LEU 268.A O no hydrogen 2.911 N/A LEU 290.A N PRO 287.A O no hydrogen 3.072 N/A GLN 291.A N PRO 288.A O no hydrogen 3.132 N/A GLN 291.A NE2 GLN 291.A O no hydrogen 3.548 N/A GLN 293.A NE2 LEU 271.A O no hydrogen 2.952 N/A