Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dva_U.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 141.A O no hydrogen 3.116 N/A ILE 1.A N LYS 142.A O no hydrogen 2.895 N/A ILE 1.A N ASP 197.A OD1 no hydrogen 3.560 N/A ILE 1.A N ASP 197.A OD2 no hydrogen 2.782 N/A ILE 2.A N ASP 192.A O no hydrogen 2.763 N/A GLU 5.A N MET 156.A O no hydrogen 2.830 N/A THR 7.A N LEU 154.A O no hydrogen 2.869 N/A THR 7.A OG1 THR 8.A O no hydrogen 3.260 N/A THR 8.A OG1 GLU 10.A OE1 no hydrogen 2.779 N/A ILE 9.A N SER 64.A OG no hydrogen 2.710 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.823 N/A ASN 11.A N THR 8.A O no hydrogen 3.133 N/A ASN 11.A ND2 THR 7.A OG1 no hydrogen 3.166 N/A GLN 12.A N ILE 9.A O no hydrogen 2.966 N/A GLN 12.A NE2 ASN 11.A O no hydrogen 2.980 N/A GLN 12.A NE2 GLU 136.A OE2 no hydrogen 2.905 N/A TRP 14.A NE1 GLN 12.A OE1 no hydrogen 2.788 N/A PHE 15.A N GLN 12.A O no hydrogen 2.859 N/A ALA 16.A N GLY 33.A O no hydrogen 2.801 N/A ALA 17.A N TYR 60.A O no hydrogen 2.948 N/A ILE 18.A N CYS 31.A O no hydrogen 2.956 N/A TYR 19.A N ILE 58.A O no hydrogen 2.781 N/A TYR 19.A OH LEU 66.A O no hydrogen 2.652 N/A ARG 20.A N THR 28.A O no hydrogen 2.971 N/A ARG 21.A N ASP 56.A O no hydrogen 2.715 N/A ARG 21.A NH1 GLU 55A.A O no hydrogen 2.865 N/A HIS 22.A N SER 26D.A O no hydrogen 2.728 N/A HIS 22.A ND1 SER 26D.A O no hydrogen 3.208 N/A THR 28.A N ARG 20.A O no hydrogen 3.144 N/A VAL 30.A N ILE 18.A O no hydrogen 2.850 N/A CYS 31.A N ILE 18.A O no hydrogen 3.286 N/A CYS 31.A SG VAL 30.A O no hydrogen 3.081 N/A GLY 32.A N SER 198.A O no hydrogen 2.914 N/A SER 34.A N ILE 42.A O no hydrogen 2.889 N/A LEU 35.A N TRP 14.A O no hydrogen 2.770 N/A ILE 36.A N TRP 40.A O no hydrogen 3.014 N/A SER 37.A N TRP 40.A O no hydrogen 3.500 N/A TRP 40.A N SER 37.A O no hydrogen 2.986 N/A VAL 41.A N LEU 101.A O no hydrogen 2.887 N/A ILE 42.A N SER 34.A O no hydrogen 2.783 N/A SER 43.A N ALA 99.A O no hydrogen 2.791 N/A SER 43.A OG GLY 32.A O no hydrogen 2.813 N/A THR 45.A OG1 ILE 98.A O no hydrogen 2.568 N/A HIS 46.A N ASP 97.A OD1 no hydrogen 2.850 N/A HIS 46.A ND1 ASP 97.A OD2 no hydrogen 2.626 N/A CYS 47.A N ALA 44.A O no hydrogen 3.191 N/A PHE 48.A N THR 45.A O no hydrogen 2.810 N/A ILE 49.A N THR 45.A O no hydrogen 3.047 N/A LYS 53.A N TYR 51B.A O no hydrogen 2.892 N/A ASP 56.A N LYS 53.A O no hydrogen 3.119 N/A TYR 57.A N LYS 54.A O no hydrogen 3.240 N/A TYR 57.A OH TYR 51B.A O no hydrogen 2.700 N/A ILE 58.A N TYR 19.A O no hydrogen 2.904 N/A VAL 59.A N PHE 76.A O no hydrogen 2.912 N/A TYR 60.A N ALA 17.A O no hydrogen 2.843 N/A LEU 61.A N MET 74.A O no hydrogen 2.960 N/A ARG 63.A NE ARG 65.A O no hydrogen 3.022 N/A ARG 63.A NH1 ASN 69.A OD1 no hydrogen 3.039 N/A ARG 63.A NH1 GLU 73.A OE1 no hydrogen 3.075 N/A ARG 63.A NH2 LEU 66.A O no hydrogen 3.192 N/A SER 64.A N THR 70.A OG1 no hydrogen 2.723 N/A ARG 65.A NE SER 68.A OG no hydrogen 3.268 N/A ARG 65.A NH1 GLN 153.A OE1 no hydrogen 2.812 N/A LEU 66.A N GLU 152.A O no hydrogen 2.961 N/A ASN 67.A N GLU 152.A OE2 no hydrogen 2.478 N/A ASN 67.A ND2 GLU 152.A OE1 no hydrogen 3.246 N/A THR 70.A N GLU 73.A OE1 no hydrogen 2.955 N/A GLU 73.A N THR 70.A O no hydrogen 3.120 N/A MET 74.A N LEU 61.A O no hydrogen 3.020 N/A PHE 76.A N VAL 59.A O no hydrogen 2.697 N/A GLU 77.A N ARG 104.A O no hydrogen 3.032 N/A GLU 79.A N LYS 102.A O no hydrogen 2.719 N/A ILE 82.A N LEU 100.A O no hydrogen 2.747 N/A HIS 84.A N THR 45.A OG1 no hydrogen 3.144 N/A ASP 86.A N HIS 84.A ND1 no hydrogen 3.057 N/A TYR 87.A N HIS 84.A O no hydrogen 2.994 N/A SER 88.A N HIS 95.A O no hydrogen 3.355 N/A HIS 94.A N LEU 92B.A O no hydrogen 2.908 N/A HIS 95.A N SER 88.A O no hydrogen 2.884 N/A ASN 96.A ND2 ASP 86.A O no hydrogen 2.924 N/A ILE 98.A N ASN 96.A O no hydrogen 2.942 N/A ALA 99.A N SER 43.A O no hydrogen 2.878 N/A LEU 100.A N ILE 82.A O no hydrogen 2.779 N/A LEU 101.A N VAL 41.A O no hydrogen 2.834 N/A LYS 102.A N ASN 80.A O no hydrogen 2.904 N/A ILE 103.A N CYS 39.A O no hydrogen 2.816 N/A ARG 104.A N GLU 77.A O no hydrogen 3.175 N/A SER 105.A N ARG 109D.A O no hydrogen 2.834 N/A SER 105.A OG GLU 107B.A OE1 no hydrogen 3.483 N/A SER 105.A OG ARG 109D.A O no hydrogen 3.396 N/A CYS 110.A SG ILE 103.A O no hydrogen 3.698 N/A ALA 111.A N PRO 38.A O no hydrogen 2.783 N/A SER 114.A N ILE 117.A O no hydrogen 2.782 N/A SER 114.A OG THR 116.A OG1 no hydrogen 3.231 N/A THR 116.A N SER 114.A OG no hydrogen 3.171 N/A THR 116.A OG1 SER 114.A OG no hydrogen 3.231 N/A ILE 117.A N SER 114.A O no hydrogen 3.339 N/A GLN 118.A N PRO 13.A O no hydrogen 3.027 N/A GLN 118.A NE2 SER 114.A O no hydrogen 3.398 N/A GLN 118.A NE2 ARG 115.A O no hydrogen 3.487 N/A ILE 120.A N LEU 35.A O no hydrogen 2.925 N/A TYR 126.A N SER 235.A O no hydrogen 3.050 N/A ASN 127.A N SER 124.A O no hydrogen 3.216 N/A ASN 127.A ND2 SER 124.A OG no hydrogen 2.980 N/A GLY 132.A N LEU 161.A O no hydrogen 2.738 N/A THR 133.A N GLN 130.A O no hydrogen 3.138 N/A THR 133.A OG1 GLN 130.A O no hydrogen 2.683 N/A CYS 135.A N VAL 159.A O no hydrogen 2.854 N/A GLU 136.A N VAL 203.A O no hydrogen 2.827 N/A ILE 137.A N THR 157.A O no hydrogen 2.917 N/A GLY 139.A N LYS 155.A O no hydrogen 3.036 N/A GLY 141.A N ASP 197.A OD1 no hydrogen 2.791 N/A LYS 142.A N GLN 195.A O no hydrogen 2.808 N/A LYS 142.A NZ ASP 147.A O no hydrogen 2.968 N/A LYS 142.A NZ GLN 195.A OE1 no hydrogen 2.966 N/A ASP 147.A N GLN 144.A O no hydrogen 2.886 N/A GLN 153.A NE2 THR 7.A O no hydrogen 2.876 N/A LEU 154.A N SER 64.A O no hydrogen 3.061 N/A LYS 155.A N GLY 139.A O no hydrogen 3.136 N/A LYS 155.A NZ ILE 1.A O no hydrogen 2.847 N/A LYS 155.A NZ GLY 3.A O no hydrogen 2.800 N/A LYS 155.A NZ GLU 143.A OE2 no hydrogen 2.887 N/A MET 156.A N GLU 5.A O no hydrogen 2.870 N/A THR 157.A N ILE 137.A O no hydrogen 3.028 N/A THR 157.A OG1 THR 191.A OG1 no hydrogen 2.616 N/A VAL 158.A N THR 157.A OG1 no hydrogen 2.813 N/A VAL 159.A N CYS 135.A O no hydrogen 2.985 N/A LYS 160.A N ALA 185.A O no hydrogen 2.945 N/A LEU 161.A N THR 133.A O no hydrogen 3.001 N/A ILE 162.A N CYS 183.A O no hydrogen 2.807 N/A GLU 166.A N SER 163.A OG no hydrogen 2.959 N/A CYS 167.A N SER 163.A O no hydrogen 2.873 N/A GLN 168.A N HIS 164.A O no hydrogen 2.766 N/A GLN 169.A N GLU 166.A O no hydrogen 3.198 N/A TYR 172.A N GLN 169.A O no hydrogen 3.009 N/A TYR 173.A N CYS 167.A O no hydrogen 3.089 N/A TYR 173.A OH PRO 228.A O no hydrogen 2.717 N/A GLY 174.A N GLN 169.A O no hydrogen 2.978 N/A GLU 176.A N TYR 173.A O no hydrogen 3.121 N/A LYS 180.A N THR 178.A OG1 no hydrogen 3.250 N/A LYS 180.A NZ ASN 96.A OD1 no hydrogen 2.498 N/A MET 181.A N THR 178.A O no hydrogen 3.051 N/A LEU 182.A N TYR 231.A O no hydrogen 2.669 N/A ALA 184.A N GLY 229.A O no hydrogen 3.011 N/A ALA 185.A N LYS 160.A O no hydrogen 3.019 N/A TRP 189.A N ASP 186.A O no hydrogen 2.787 N/A LYS 190.A N ASP 186.A OD2 no hydrogen 3.409 N/A THR 191.A OG1 ILE 2.A O no hydrogen 2.505 N/A THR 191.A OG1 THR 157.A OG1 no hydrogen 2.616 N/A ASP 192.A N ILE 2.A O no hydrogen 3.204 N/A SER 193.A OG ASP 192.A OD1 no hydrogen 3.393 N/A CYS 194.A N ASP 197.A OD2 no hydrogen 2.738 N/A ASP 197.A N CYS 194.A O no hydrogen 2.903 N/A SER 198.A OG HIS 46.A NE2 no hydrogen 3.003 N/A GLY 199.A N VAL 216.A O no hydrogen 2.856 N/A GLY 200.A N ASP 197.A O no hydrogen 3.201 N/A LEU 202.A N GLY 214.A O no hydrogen 2.910 N/A VAL 203.A N GLU 136.A O no hydrogen 2.774 N/A CYS 204.A N THR 211.A O no hydrogen 3.076 N/A CYS 204.A SG THR 213.A OG1 no hydrogen 3.379 N/A LEU 206.A N ARG 209.A O no hydrogen 2.801 N/A ARG 209.A N LEU 206.A O no hydrogen 3.332 N/A THR 211.A N CYS 204.A O no hydrogen 2.875 N/A THR 211.A OG1 ARG 209.A O no hydrogen 2.908 N/A LEU 212.A N ALA 121.A O no hydrogen 2.859 N/A GLY 214.A N LEU 202.A O no hydrogen 3.093 N/A ILE 215.A N THR 232.A O no hydrogen 3.167 N/A VAL 216.A N GLY 200.A O no hydrogen 2.885 N/A SER 217.A N VAL 230.A O no hydrogen 2.998 N/A SER 217.A OG ASP 97.A OD2 no hydrogen 2.798 N/A TRP 218.A N VAL 230.A O no hydrogen 3.188 N/A ARG 220.A N TYR 173.A OH no hydrogen 2.955 N/A ALA 223.A N ASP 192.A OD2 no hydrogen 2.847 N/A LYS 227.A N LEU 224.A O no hydrogen 3.077 N/A LYS 227.A NZ TYR 172.A O no hydrogen 2.715 N/A LYS 227.A NZ HIS 171B.A O no hydrogen 3.313 N/A GLY 229.A N ALA 184.A O no hydrogen 2.871 N/A VAL 230.A N TRP 218.A O no hydrogen 2.767 N/A TYR 231.A N LEU 182.A O no hydrogen 2.716 N/A THR 232.A N ILE 215.A O no hydrogen 2.852 N/A THR 232.A OG1 ASP 97.A O no hydrogen 2.639 N/A ARG 233.A N LYS 180.A O no hydrogen 2.962 N/A ARG 233.A NE ASP 128.A OD2 no hydrogen 2.778 N/A ARG 233.A NH1 THR 179.A O no hydrogen 2.748 N/A ARG 233.A NH2 ASP 128.A OD2 no hydrogen 3.164 N/A VAL 234.A N THR 213.A O no hydrogen 3.164 N/A SER 235.A OG ASP 128.A OD1 no hydrogen 2.896 N/A SER 235.A OG ASP 128.A OD2 no hydrogen 3.133 N/A SER 235.A OG HIS 236.A ND1 no hydrogen 3.313 N/A HIS 236.A N ARG 233.A O no hydrogen 3.037 N/A PHE 237.A N VAL 234.A O no hydrogen 2.908 N/A ILE 241.A N PHE 237.A O no hydrogen 2.908 N/A ARG 242.A N LEU 238.A O no hydrogen 2.851 N/A SER 243.A N PRO 239.A O no hydrogen 2.918 N/A SER 243.A OG PRO 239.A O no hydrogen 3.200 N/A SER 243.A OG TRP 240.A O no hydrogen 3.216 N/A SER 243.A OG HIS 244.A ND1 no hydrogen 3.151 N/A HIS 244.A N TRP 240.A O no hydrogen 3.151 N/A HIS 244.A ND1 TRP 240.A O no hydrogen 2.778 N/A THR 245.A N ILE 241.A O no hydrogen 3.144 N/A THR 245.A OG1 ILE 241.A O no hydrogen 2.682 N/A THR 245.A OG1 ARG 242.A O no hydrogen 3.353 N/A LYS 246.A N SER 243.A O no hydrogen 3.339 N/A TYR 51B.A N PHE 48.A O no hydrogen 2.951 N/A GLU 107B.A N SER 105.A OG no hydrogen 3.193 N/A GLN 188B.A N ASP 186.A OD2 no hydrogen 2.800 N/A GLY 25C.A N HIS 22.A O no hydrogen 2.896 N/A GLY 108C.A N SER 105.A O no hydrogen 2.683 N/A ARG 109D.A N SER 105.A OG no hydrogen 3.015 N/A