Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dhc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLU 179.A O no hydrogen 2.790 N/A LYS 4.A N GLU 41.A O no hydrogen 2.796 N/A LYS 4.A NZ THR 42.A O no hydrogen 3.560 N/A LYS 5.A N GLU 41.A O no hydrogen 3.350 N/A LEU 6.A N ILE 250.A O no hydrogen 2.981 N/A TYR 7.A N LEU 39.A O no hydrogen 2.834 N/A ILE 9.A N CYS 37.A O no hydrogen 2.867 N/A ALA 11.A N VAL 35.A O no hydrogen 2.889 N/A ARG 13.A N LYS 76.A O no hydrogen 2.966 N/A ARG 13.A NH1 ASN 32.A O no hydrogen 2.924 N/A ARG 13.A NH1 GLU 240.A OE2 no hydrogen 2.918 N/A ARG 13.A NH2 GLU 240.A OE1 no hydrogen 2.729 N/A ARG 13.A NH2 GLU 240.A OE2 no hydrogen 3.504 N/A CYS 14.A N LEU 33.A O no hydrogen 2.888 N/A CYS 14.A SG MET 15.A O no hydrogen 3.685 N/A CYS 14.A SG LEU 74.A O no hydrogen 3.815 N/A MET 15.A N LEU 74.A O no hydrogen 2.765 N/A LEU 16.A N LEU 31.A O no hydrogen 2.944 N/A ASP 17.A N GLN 72.A O no hydrogen 3.218 N/A HIS 18.A N LYS 29.A O no hydrogen 2.822 N/A HIS 18.A NE2 THR 26.A O no hydrogen 2.527 N/A SER 19.A N ASP 17.A OD2 no hydrogen 2.783 N/A SER 19.A OG ASP 17.A OD2 no hydrogen 2.694 N/A SER 20.A N ASP 17.A O no hydrogen 2.826 N/A SER 20.A OG.B ASP 17.A O no hydrogen 2.723 N/A VAL 21.A N HIS 18.A O no hydrogen 3.078 N/A ASN 22.A N HIS 18.A O no hydrogen 3.151 N/A SER 23.A N PRO 204.A O no hydrogen 2.828 N/A ALA 24.A N ASN 22.A OD1 no hydrogen 2.944 N/A LEU 25.A N ASN 22.A O no hydrogen 2.939 N/A GLY 28.A N ASP 17.A OD1 no hydrogen 2.715 N/A LEU 31.A N LEU 16.A O no hydrogen 2.843 N/A LEU 33.A N CYS 14.A O no hydrogen 2.868 N/A VAL 35.A N GLY 12.A O no hydrogen 3.031 N/A CYS 37.A N ILE 9.A O no hydrogen 2.964 N/A CYS 37.A SG.A ILE 9.A O no hydrogen 3.796 N/A CYS 37.A SG.B ASP 50.A O no hydrogen 3.449 N/A TYR 38.A N VAL 49.A O no hydrogen 2.968 N/A LEU 39.A N TYR 7.A O no hydrogen 2.961 N/A LEU 40.A N ILE 47.A O no hydrogen 2.832 N/A GLU 41.A N LYS 5.A O no hydrogen 2.839 N/A THR 42.A N GLY 45.A O no hydrogen 3.292 N/A THR 42.A OG1 GLU 44.A OE2.B no hydrogen 3.275 N/A THR 42.A OG1 GLY 45.A O no hydrogen 2.683 N/A GLU 44.A N THR 42.A OG1 no hydrogen 3.146 N/A GLY 45.A N THR 42.A O no hydrogen 3.006 N/A ILE 47.A N LEU 40.A O no hydrogen 2.890 N/A LEU 48.A N TYR 99.A O no hydrogen 3.107 N/A VAL 49.A N TYR 38.A O no hydrogen 2.772 N/A ASP 50.A N ILE 101.A O no hydrogen 2.862 N/A THR 51.A N HIS 109.A O no hydrogen 2.946 N/A THR 51.A OG1 HIS 109.A O no hydrogen 3.505 N/A THR 51.A OG1 ASN 113.A OD1 no hydrogen 2.834 N/A SER 56.A OG GLU 140.A OE2 no hydrogen 3.002 N/A ALA 57.A N PRO 54.A O no hydrogen 2.944 N/A VAL 58.A N GLU 55.A O no hydrogen 2.944 N/A ASN 59.A N MET 77.A O no hydrogen 2.818 N/A ASN 60.A N ALA 57.A O no hydrogen 3.189 N/A LEU 63.A N ASN 60.A O no hydrogen 3.047 N/A ASN 65.A N GLY 62.A O no hydrogen 2.936 N/A GLY 66.A N GLU 70.A OE2 no hydrogen 2.812 N/A THR 67.A N PHE 64.A O no hydrogen 3.142 N/A THR 67.A OG1 PHE 64.A O no hydrogen 2.659 N/A VAL 69.A N THR 67.A OG1 no hydrogen 3.129 N/A GLU 70.A N THR 67.A O no hydrogen 3.068 N/A GLN 72.A N VAL 69.A O no hydrogen 2.852 N/A LEU 74.A N MET 15.A O no hydrogen 2.956 N/A LYS 76.A N ARG 13.A O no hydrogen 2.791 N/A LYS 76.A NZ GLU 61.A OE2 no hydrogen 2.681 N/A THR 78.A N ASP 81.A OD2 no hydrogen 2.947 N/A THR 78.A OG1 ASP 81.A OD2 no hydrogen 3.311 N/A GLU 80.A N THR 78.A OG1 no hydrogen 3.227 N/A ASP 81.A N THR 78.A O no hydrogen 2.913 N/A ARG 82.A N GLU 79.A O no hydrogen 3.314 N/A ARG 82.A NH1 GLU 79.A OE2 no hydrogen 2.996 N/A ILE 86.A N ARG 82.A O no hydrogen 2.936 N/A LEU 87.A N ILE 83.A O no hydrogen 2.811 N/A LYS 88.A N VAL 84.A O no hydrogen 2.942 N/A LYS 88.A NZ GLU 93.A OE2 no hydrogen 2.928 N/A ARG 89.A N ASN 85.A O no hydrogen 2.959 N/A ARG 89.A NH1 GLU 80.A O no hydrogen 2.871 N/A ARG 89.A NH2 GLU 80.A O no hydrogen 2.985 N/A VAL 90.A N ILE 86.A O no hydrogen 3.008 N/A GLY 91.A N LEU 87.A O no hydrogen 2.893 N/A TYR 92.A N LEU 87.A O no hydrogen 2.854 N/A TYR 92.A OH GLU 41.A OE1.A no hydrogen 2.214 N/A TYR 92.A OH GLU 41.A OE2.B no hydrogen 2.832 N/A GLU 93.A N ASP 96.A OD2 no hydrogen 2.835 N/A ASP 96.A N GLU 93.A O no hydrogen 2.849 N/A LEU 97.A N PRO 94.A O no hydrogen 3.141 N/A LEU 98.A N PRO 46.A O no hydrogen 2.772 N/A ILE 100.A N PRO 120.A O no hydrogen 2.926 N/A ILE 101.A N LEU 48.A O no hydrogen 2.803 N/A SER 102.A N ILE 122.A O no hydrogen 2.907 N/A SER 103.A N ASP 50.A OD1 no hydrogen 2.781 N/A SER 103.A OG ASP 50.A OD1 no hydrogen 3.222 N/A SER 103.A OG ASP 50.A OD2 no hydrogen 2.697 N/A SER 103.A OG HIS 104.A ND1 no hydrogen 2.847 N/A HIS 104.A ND1 SER 103.A OG no hydrogen 2.847 N/A LEU 105.A N GLU 127.A OE2 no hydrogen 2.837 N/A HIS 109.A N HIS 106.A O no hydrogen 2.891 N/A HIS 109.A ND1 ASP 50.A OD2 no hydrogen 2.718 N/A ALA 110.A N HIS 106.A O no hydrogen 3.048 N/A GLY 111.A N GLY 52.A O no hydrogen 2.869 N/A ASN 113.A N ALA 110.A O no hydrogen 3.031 N/A ASN 113.A ND2 SER 102.A OG no hydrogen 3.202 N/A ALA 115.A N GLY 112.A O no hydrogen 3.087 N/A PHE 116.A N ASN 113.A O no hydrogen 2.989 N/A ASN 118.A ND2 ASP 95.A OD1 no hydrogen 3.000 N/A ASN 118.A ND2 ASP 95.A OD2 no hydrogen 3.445 N/A THR 119.A OG1 PRO 94.A O no hydrogen 3.178 N/A ILE 121.A N ASN 147.A O no hydrogen 2.934 N/A ILE 122.A N ILE 100.A O no hydrogen 2.740 N/A VAL 123.A N LYS 149.A O no hydrogen 3.263 N/A ARG 125.A N ILE 151.A O no hydrogen 2.816 N/A ARG 125.A NE GLU 152.A OE1 no hydrogen 2.721 N/A ARG 125.A NH1 GLU 152.A OE1 no hydrogen 2.819 N/A THR 126.A OG1 TYR 165.A OH no hydrogen 2.797 N/A THR 126.A OG1 PRO 171.A O no hydrogen 3.251 N/A GLU 127.A N GLN 124.A O no hydrogen 2.951 N/A TYR 128.A N GLN 124.A O no hydrogen 2.905 N/A GLU 129.A N ARG 125.A O no hydrogen 2.879 N/A ALA 130.A N THR 126.A O no hydrogen 3.175 N/A ALA 131.A N GLU 127.A O no hydrogen 2.944 N/A LEU 132.A N TYR 128.A O no hydrogen 3.203 N/A LEU 132.A N GLU 129.A O no hydrogen 3.261 N/A HIS 133.A N ALA 130.A O no hydrogen 3.038 N/A ARG 134.A N ALA 130.A O no hydrogen 2.929 N/A ARG 134.A NE GLU 136.A OE1 no hydrogen 2.666 N/A ARG 134.A NE GLU 136.A OE2 no hydrogen 3.397 N/A ARG 134.A NH2 GLU 136.A OE1 no hydrogen 3.474 N/A GLU 136.A N GLU 136.A OE2 no hydrogen 2.784 N/A TYR 137.A N ARG 134.A O no hydrogen 3.264 N/A TYR 137.A OH GLU 127.A OE2 no hydrogen 2.676 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.793 N/A CYS 141.A N MET 138.A O no hydrogen 2.887 N/A ILE 142.A N LYS 139.A O no hydrogen 3.168 N/A TYR 148.A N LEU 146.A O no hydrogen 2.949 N/A TYR 148.A OH LEU 143.A O no hydrogen 2.639 N/A LYS 149.A N ILE 121.A O no hydrogen 2.776 N/A ILE 151.A N VAL 123.A O no hydrogen 3.004 N/A TYR 155.A N LEU 163.A O no hydrogen 3.100 N/A VAL 157.A N VAL 161.A O no hydrogen 2.870 N/A VAL 161.A N VAL 158.A O no hydrogen 2.922 N/A GLN 162.A N PHE 177.A O no hydrogen 2.908 N/A LEU 163.A N TYR 155.A O no hydrogen 2.766 N/A LEU 164.A N SER 175.A O no hydrogen 2.887 N/A TYR 165.A N ASP 154.A OD1 no hydrogen 2.832 N/A TYR 165.A OH THR 126.A OG1 no hydrogen 2.797 N/A TYR 165.A OH PRO 171.A O no hydrogen 3.309 N/A THR 166.A N HIS 173.A O no hydrogen 2.836 N/A THR 166.A OG1 HIS 173.A O no hydrogen 3.446 N/A THR 166.A OG1 SER 175.A OG no hydrogen 2.853 N/A GLY 168.A N SER 170.A O no hydrogen 2.871 N/A HIS 169.A ND1 ALA 206.A O no hydrogen 2.836 N/A SER 170.A OG GLU 127.A OE1 no hydrogen 2.727 N/A SER 170.A OG GLU 127.A OE2 no hydrogen 3.477 N/A GLY 172.A N GLU 127.A OE1 no hydrogen 2.812 N/A HIS 173.A N SER 170.A O no hydrogen 3.432 N/A HIS 173.A NE2 THR 189.A O no hydrogen 3.229 N/A GLN 174.A N SER 103.A O no hydrogen 2.941 N/A GLN 174.A NE2 SER 102.A O no hydrogen 2.886 N/A GLN 174.A NE2 ILE 122.A O no hydrogen 3.608 N/A SER 175.A N LEU 164.A O no hydrogen 2.876 N/A SER 175.A OG THR 166.A OG1 no hydrogen 2.853 N/A SER 175.A OG THR 189.A O no hydrogen 2.818 N/A LEU 176.A N LEU 188.A O no hydrogen 3.020 N/A PHE 177.A N GLN 162.A O no hydrogen 2.831 N/A ILE 178.A N VAL 186.A O no hydrogen 2.797 N/A GLU 179.A N GLY 160.A O no hydrogen 2.863 N/A THR 180.A N GLY 184.A O no hydrogen 2.860 N/A THR 180.A OG1 ILE 250.A OXT no hydrogen 2.632 N/A GLU 181.A N VAL 3.A O no hydrogen 2.832 N/A SER 183.A N THR 180.A OG1 no hydrogen 2.905 N/A SER 183.A OG ILE 250.A OXT no hydrogen 2.614 N/A GLY 184.A N THR 180.A O no hydrogen 2.873 N/A SER 185.A OG GLU 179.A OE1.A no hydrogen 3.134 N/A SER 185.A OG GLU 179.A OE2.A no hydrogen 2.440 N/A SER 185.A OG GLU 179.A OE2.B no hydrogen 2.815 N/A VAL 186.A N ILE 178.A O no hydrogen 2.723 N/A LEU 187.A N ILE 230.A O no hydrogen 2.912 N/A LEU 188.A N LEU 176.A O no hydrogen 2.854 N/A THR 189.A N PHE 232.A O no hydrogen 2.975 N/A THR 189.A OG1 ILE 190.A O no hydrogen 2.920 N/A THR 189.A OG1 SER 193.A O no hydrogen 3.296 N/A THR 189.A OG1 PHE 232.A O no hydrogen 3.335 N/A ALA 192.A N THR 189.A O no hydrogen 3.121 N/A SER 193.A N ILE 190.A O no hydrogen 3.503 N/A SER 193.A OG ALA 192.A O no hydrogen 2.798 N/A THR 195.A N ASN 198.A OD1 no hydrogen 2.849 N/A LYS 196.A N ASP 236.A OD2 no hydrogen 2.771 N/A ASN 198.A N THR 195.A OG1 no hydrogen 3.073 N/A ASN 198.A ND2 VAL 21.A O no hydrogen 2.922 N/A ASN 198.A ND2 VAL 203.A O no hydrogen 2.841 N/A PHE 199.A N THR 195.A O no hydrogen 3.298 N/A PHE 199.A N LYS 196.A O no hydrogen 3.068 N/A GLU 200.A N LYS 196.A O no hydrogen 2.769 N/A ASP 201.A N GLU 197.A O no hydrogen 3.066 N/A VAL 203.A N GLU 197.A O no hydrogen 3.236 N/A ALA 206.A N SER 20.A O no hydrogen 2.892 N/A PHE 208.A N HIS 169.A O no hydrogen 2.909 N/A ASP 209.A N GLY 168.A O no hydrogen 2.870 N/A LEU 212.A N ASP 209.A OD2 no hydrogen 3.059 N/A ALA 213.A N ASP 209.A O no hydrogen 2.916 N/A LEU 214.A N PRO 210.A O no hydrogen 2.892 N/A SER 215.A N GLU 211.A O no hydrogen 3.047 N/A SER 215.A OG LEU 212.A O no hydrogen 2.887 N/A SER 216.A N LEU 212.A O no hydrogen 2.920 N/A SER 216.A OG PRO 167.A O no hydrogen 2.716 N/A SER 216.A OG LEU 212.A O no hydrogen 3.430 N/A ILE 217.A N ALA 213.A O no hydrogen 2.949 N/A LYS 218.A N.A LEU 214.A O no hydrogen 2.825 N/A LYS 218.A N.B LEU 214.A O no hydrogen 2.802 N/A LYS 218.A NZ.B GLU 202.A OE1 no hydrogen 3.390 N/A LYS 218.A NZ.B GLU 202.A OE2 no hydrogen 2.637 N/A ARG 219.A N SER 215.A O no hydrogen 2.892 N/A ARG 219.A NH1 ASP 154.A OD1 no hydrogen 3.510 N/A ARG 219.A NH1 ASP 154.A OD2 no hydrogen 2.692 N/A ARG 219.A NH2 ASP 154.A OD1 no hydrogen 2.828 N/A ARG 219.A NH2 TYR 165.A O no hydrogen 3.057 N/A LEU 220.A N SER 216.A O no hydrogen 2.924 N/A LYS 221.A N ILE 217.A O no hydrogen 2.845 N/A LYS 221.A NZ PHE 199.A O no hydrogen 3.002 N/A LYS 221.A NZ GLU 200.A O no hydrogen 3.034 N/A LYS 221.A NZ GLU 202.A OE2 no hydrogen 2.798 N/A GLU 222.A N LYS 218.A O.A no hydrogen 3.008 N/A GLU 222.A N LYS 218.A O.B no hydrogen 3.204 N/A VAL 223.A N ARG 219.A O no hydrogen 3.089 N/A VAL 224.A N LEU 220.A O no hydrogen 2.814 N/A LYS 225.A N LYS 221.A O no hydrogen 2.936 N/A LYS 226.A N GLU 222.A O no hydrogen 3.190 N/A GLU 227.A N VAL 223.A O no hydrogen 2.847 N/A LYS 228.A N VAL 224.A O no hydrogen 2.726 N/A ILE 230.A N SER 185.A O no hydrogen 3.077 N/A PHE 232.A N LEU 187.A O no hydrogen 2.894 N/A PHE 233.A N GLN 239.A OE1 no hydrogen 2.929 N/A GLY 234.A N SER 193.A O no hydrogen 3.025 N/A HIS 235.A N TYR 194.A O no hydrogen 2.813 N/A HIS 235.A ND1 PRO 34.A O no hydrogen 2.788 N/A GLN 239.A N ASP 236.A OD1 no hydrogen 2.891 N/A GLN 239.A NE2 ILE 231.A O no hydrogen 2.957 N/A GLU 240.A N ASP 236.A O no hydrogen 2.869 N/A LYS 241.A N GLU 238.A O no hydrogen 3.024 N/A LYS 241.A NZ GLU 238.A OE2 no hydrogen 2.909 N/A SER 242.A N GLN 239.A O no hydrogen 2.979 N/A SER 242.A OG GLN 239.A O no hydrogen 3.465 N/A CYS 243.A N GLN 239.A O no hydrogen 3.190 N/A CYS 243.A N GLU 240.A O no hydrogen 3.398 N/A CYS 243.A SG.A ARG 244.A O no hydrogen 3.092 N/A CYS 243.A SG.B GLN 239.A O no hydrogen 3.410 N/A ARG 244.A NE TYR 249.A O no hydrogen 3.341 N/A ARG 244.A NH2 TYR 249.A O no hydrogen 2.561 N/A PHE 246.A N PHE 8.A O no hydrogen 2.889 N/A GLU 248.A N VAL 245.A O no hydrogen 2.849 N/A ILE 250.A N LEU 6.A O no hydrogen 2.951 N/A