Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bdi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N LYS 19.A O no hydrogen 2.875 N/A GLU 6.A N GLN 17.A O no hydrogen 2.984 N/A ILE 8.A N.A VAL 15.A O no hydrogen 2.800 N/A ILE 8.A N.B VAL 15.A O no hydrogen 2.817 N/A VAL 10.A N THR 13.A O no hydrogen 2.924 N/A ASN 11.A ND2 TYR 73.A OH no hydrogen 3.053 N/A GLY 12.A N ASP 9.A OD2 no hydrogen 3.122 N/A THR 13.A N VAL 10.A O no hydrogen 3.009 N/A THR 13.A OG1 SER 70.A OG no hydrogen 2.911 N/A VAL 15.A N ILE 8.A O.A no hydrogen 2.845 N/A VAL 15.A N ILE 8.A O.B no hydrogen 3.070 N/A PHE 16.A N SER 67.A OG no hydrogen 2.957 N/A GLN 17.A N GLU 6.A O no hydrogen 2.835 N/A GLN 17.A NE2 GLU 6.A OE2 no hydrogen 2.823 N/A GLN 17.A NE2 ASN 94.A OD1 no hydrogen 2.949 N/A ARG 18.A N ALA 58.A O no hydrogen 2.881 N/A ARG 18.A NE GLU 5.A OE2 no hydrogen 2.848 N/A ARG 18.A NH1 SER 38.A O no hydrogen 3.005 N/A ARG 18.A NH1 ASP 41.A OD1 no hydrogen 2.865 N/A ARG 18.A NH2 GLU 5.A OE2 no hydrogen 3.093 N/A ARG 18.A NH2 ASP 41.A OD1 no hydrogen 2.954 N/A LYS 19.A N GLN 4.A O no hydrogen 2.825 N/A LYS 19.A NZ GLU 6.A OE2 no hydrogen 2.815 N/A THR 21.A N.A ASN 55.A OD1 no hydrogen 2.846 N/A THR 21.A N.B ASN 55.A OD1 no hydrogen 2.798 N/A THR 21.A OG1.B ASN 24.A OD1.B no hydrogen 2.848 N/A ASN 24.A N.A THR 21.A O.A no hydrogen 3.177 N/A ASN 24.A N.A THR 21.A OG1.B no hydrogen 2.937 N/A ASN 24.A N.B THR 21.A O.A no hydrogen 3.195 N/A ASN 24.A N.B THR 21.A OG1.B no hydrogen 2.921 N/A ASN 24.A ND2.A ASN 55.A OD1 no hydrogen 2.883 N/A ILE 28.A N ASN 55.A O no hydrogen 2.756 N/A ALA 29.A N VAL 100.A O no hydrogen 2.992 N/A LEU 30.A N TYR 57.A O no hydrogen 2.883 N/A HIS 32.A ND1 GLY 33.A O no hydrogen 2.774 N/A PHE 36.A N GLY 33.A O no hydrogen 3.228 N/A THR 37.A N ASP 39.A OD2 no hydrogen 2.900 N/A SER 38.A N ASP 60.A OD1 no hydrogen 2.841 N/A SER 38.A OG ASP 60.A OD1 no hydrogen 2.724 N/A LYS 42.A N ASP 39.A O no hydrogen 3.269 N/A LYS 42.A NZ ILE 182.A O no hydrogen 2.744 N/A ASP 44.A N ASP 41.A O no hydrogen 2.999 N/A LEU 45.A N TRP 40.A O no hydrogen 3.330 N/A ASN 47.A ND2 ASP 44.A OD1 no hydrogen 2.944 N/A ASN 48.A N ASP 44.A O no hydrogen 3.029 N/A ASN 48.A ND2 ALA 43.A O no hydrogen 3.139 N/A ASN 48.A ND2 ASP 44.A O no hydrogen 3.057 N/A TYR 49.A N LEU 45.A O no hydrogen 2.950 N/A TYR 49.A OH THR 192.A OG1 no hydrogen 2.751 N/A SER 50.A N PHE 46.A O no hydrogen 2.919 N/A LYS 51.A N ASN 47.A O no hydrogen 3.084 N/A ILE 52.A N TYR 49.A O no hydrogen 3.309 N/A GLY 53.A N SER 50.A O no hydrogen 3.021 N/A TYR 54.A N TYR 49.A O no hydrogen 3.251 N/A TYR 54.A OH LEU 196.A O no hydrogen 3.204 N/A ASN 55.A N ARG 26.A O no hydrogen 2.672 N/A ASN 55.A ND2 THR 21.A O.A no hydrogen 3.172 N/A ASN 55.A ND2 THR 21.A O.B no hydrogen 2.932 N/A TYR 57.A N ILE 28.A O no hydrogen 2.929 N/A ALA 58.A N ARG 18.A O no hydrogen 2.811 N/A ASP 60.A N PHE 16.A O no hydrogen 2.920 N/A TYR 61.A N HIS 32.A NE2 no hydrogen 2.941 N/A TYR 61.A OH TYR 73.A O no hydrogen 2.671 N/A GLY 63.A N ALA 68.A O no hydrogen 3.011 N/A PHE 64.A N TYR 61.A O no hydrogen 2.877 N/A ARG 66.A N ASP 60.A OD2 no hydrogen 2.770 N/A SER 67.A N PHE 64.A O no hydrogen 3.047 N/A SER 67.A OG ASP 60.A O no hydrogen 2.651 N/A ALA 68.A N ARG 14.A O no hydrogen 2.970 N/A SER 70.A OG THR 13.A OG1 no hydrogen 2.911 N/A LYS 72.A NZ GLU 85.A OE1.B no hydrogen 3.168 N/A TYR 73.A N SER 70.A OG no hydrogen 3.046 N/A TYR 73.A OH ASP 89.A OD2 no hydrogen 2.600 N/A GLY 78.A N ILE 75.A O no hydrogen 2.967 N/A LYS 81.A N ASP 79.A OD1 no hydrogen 3.143 N/A HIS 82.A N ASP 79.A O no hydrogen 2.916 N/A HIS 82.A ND1 GLY 74.A O no hydrogen 2.898 N/A ALA 83.A N LEU 80.A O no hydrogen 3.001 N/A ALA 84.A N LEU 80.A O no hydrogen 3.177 N/A GLU 85.A N.A LYS 81.A O no hydrogen 3.169 N/A GLU 85.A N.B LYS 81.A O no hydrogen 3.175 N/A PHE 86.A N HIS 82.A O no hydrogen 2.947 N/A ILE 87.A N ALA 83.A O no hydrogen 2.939 N/A ARG 88.A N.A ALA 84.A O no hydrogen 3.037 N/A ARG 88.A N.B ALA 84.A O no hydrogen 3.049 N/A ARG 88.A NH1.A GLU 85.A OE1.A no hydrogen 2.304 N/A ARG 88.A NH2.A GLU 85.A OE1.A no hydrogen 2.642 N/A ARG 88.A NH2.B TYR 114.A OH no hydrogen 3.384 N/A ASP 89.A N GLU 85.A O.A no hydrogen 2.853 N/A ASP 89.A N GLU 85.A O.B no hydrogen 2.973 N/A TYR 90.A N PHE 86.A O no hydrogen 2.757 N/A TYR 90.A OH GLN 17.A OE1 no hydrogen 2.633 N/A LEU 91.A N ILE 87.A O no hydrogen 2.963 N/A LYS 92.A N ARG 88.A O.A no hydrogen 3.050 N/A LYS 92.A N ARG 88.A O.B no hydrogen 3.044 N/A ALA 93.A N ASP 89.A O no hydrogen 2.855 N/A ASN 94.A N TYR 90.A O no hydrogen 3.253 N/A ASN 94.A N LEU 91.A O no hydrogen 3.075 N/A ASN 94.A ND2 GLN 17.A OE1 no hydrogen 3.040 N/A ASN 94.A ND2 TYR 90.A O no hydrogen 3.143 N/A GLY 95.A N LYS 92.A O no hydrogen 2.931 N/A VAL 96.A N LEU 91.A O no hydrogen 2.944 N/A SER 99.A N ILE 117.A O no hydrogen 2.910 N/A SER 99.A OG VAL 100.A O no hydrogen 2.801 N/A VAL 100.A N SER 27.A O no hydrogen 2.886 N/A ILE 101.A N GLY 120.A O no hydrogen 3.025 N/A ALA 103.A N PHE 31.A O no hydrogen 3.012 N/A SER 104.A N VAL 124.A O no hydrogen 2.903 N/A SER 104.A OG HIS 178.A NE2 no hydrogen 2.680 N/A GLY 107.A N SER 104.A O no hydrogen 3.102 N/A ILE 109.A N GLY 106.A O no hydrogen 3.093 N/A THR 111.A N VAL 108.A O no hydrogen 3.095 N/A THR 111.A OG1 VAL 108.A O no hydrogen 2.910 N/A LEU 112.A N ILE 109.A O no hydrogen 2.967 N/A TYR 114.A N THR 110.A O no hydrogen 2.807 N/A TYR 114.A OH GLU 85.A OE2.A no hydrogen 2.185 N/A ILE 117.A N TYR 114.A O no hydrogen 3.112 N/A VAL 118.A N PRO 115.A O no hydrogen 3.213 N/A ASP 119.A N SER 99.A O no hydrogen 2.829 N/A ILE 121.A N LYS 141.A O no hydrogen 2.995 N/A ILE 122.A N ILE 101.A O no hydrogen 2.985 N/A ALA 123.A N LEU 143.A O no hydrogen 2.848 N/A VAL 124.A N GLY 102.A O no hydrogen 2.856 N/A ALA 125.A N VAL 145.A O no hydrogen 2.880 N/A ALA 127.A N SER 104.A O no hydrogen 3.010 N/A LEU 132.A N VAL 129.A O no hydrogen 2.928 N/A LYS 133.A NZ GLU 160.A OE1 no hydrogen 3.401 N/A LYS 133.A NZ GLU 160.A OE2 no hydrogen 2.914 N/A ASP 135.A N LEU 132.A O no hydrogen 2.977 N/A LYS 137.A N ASP 135.A O no hydrogen 2.938 N/A GLN 140.A N GLN 140.A OE1 no hydrogen 2.792 N/A GLN 140.A NE2 VAL 118.A O no hydrogen 2.905 N/A LYS 141.A NZ ASN 198.A O.A no hydrogen 3.075 N/A LYS 141.A NZ ASN 198.A O.B no hydrogen 3.111 N/A LYS 141.A NZ LEU 199.A OXT no hydrogen 2.861 N/A THR 142.A OG1 GLN 140.A O no hydrogen 3.075 N/A LEU 143.A N ILE 121.A O no hydrogen 2.864 N/A LEU 144.A N ARG 169.A O no hydrogen 2.821 N/A VAL 145.A N ALA 123.A O no hydrogen 2.976 N/A TRP 146.A N GLU 171.A O.A no hydrogen 3.133 N/A TRP 146.A N GLU 171.A O.B no hydrogen 3.121 N/A TRP 146.A NE1 VAL 153.A O no hydrogen 2.899 N/A SER 148.A N VAL 173.A O no hydrogen 2.951 N/A SER 148.A OG GLU 174.A OE1.B no hydrogen 3.458 N/A LYS 149.A N SER 176.A O no hydrogen 2.871 N/A ASP 150.A N GLY 147.A O no hydrogen 3.127 N/A VAL 152.A N ASP 150.A OD1 no hydrogen 2.752 N/A VAL 153.A N ASP 150.A OD1 no hydrogen 3.055 N/A LEU 157.A N PRO 154.A O no hydrogen 3.014 N/A SER 158.A N ILE 155.A O.A no hydrogen 3.011 N/A SER 158.A N ILE 155.A O.B no hydrogen 2.845 N/A SER 158.A OG ILE 155.A O.A no hydrogen 2.519 N/A SER 158.A OG ILE 155.A O.B no hydrogen 2.526 N/A GLU 160.A N ALA 156.A O no hydrogen 3.369 N/A TYR 161.A N LEU 157.A O no hydrogen 2.739 N/A ALA 162.A N SER 158.A O no hydrogen 2.992 N/A SER 163.A N LYS 159.A O no hydrogen 3.122 N/A SER 163.A OG LYS 159.A O no hydrogen 2.907 N/A ILE 164.A N GLU 160.A O no hydrogen 3.033 N/A ILE 165.A N TYR 161.A O no hydrogen 3.010 N/A SER 168.A N ILE 165.A O no hydrogen 3.159 N/A SER 168.A OG ALA 162.A O no hydrogen 2.929 N/A SER 168.A OG ILE 165.A O no hydrogen 2.784 N/A ARG 169.A N THR 142.A O no hydrogen 2.807 N/A ARG 169.A NE GLU 171.A OE2.A no hydrogen 2.887 N/A ARG 169.A NH1 ASP 194.A OD2 no hydrogen 2.681 N/A ARG 169.A NH2 GLU 171.A OE2.A no hydrogen 3.034 N/A ARG 169.A NH2 ASP 194.A OD2 no hydrogen 3.212 N/A GLU 171.A N.A LEU 144.A O no hydrogen 2.864 N/A GLU 171.A N.B LEU 144.A O no hydrogen 2.841 N/A VAL 173.A N TRP 146.A O no hydrogen 2.779 N/A GLY 175.A N SER 148.A OG no hydrogen 3.085 N/A SER 176.A OG GLY 177.A O no hydrogen 2.827 N/A GLY 177.A N GLU 183.A OE1 no hydrogen 2.805 N/A HIS 178.A ND1 ASP 150.A OD2 no hydrogen 2.740 N/A HIS 178.A NE2 SER 104.A OG no hydrogen 2.680 N/A ILE 182.A N PRO 179.A O no hydrogen 2.934 N/A GLU 183.A N PRO 179.A O no hydrogen 2.985 N/A LYS 184.A N VAL 180.A O no hydrogen 2.877 N/A PHE 188.A N LYS 184.A O no hydrogen 2.939 N/A VAL 189.A N PRO 185.A O no hydrogen 2.947 N/A ARG 190.A N GLU 186.A O.A no hydrogen 2.916 N/A ARG 190.A N GLU 186.A O.B no hydrogen 2.944 N/A ARG 190.A NE GLU 187.A OE1 no hydrogen 2.852 N/A ARG 190.A NH2 GLU 187.A OE2 no hydrogen 2.586 N/A ILE 191.A N GLU 187.A O no hydrogen 3.002 N/A THR 192.A N PHE 188.A O no hydrogen 2.981 N/A THR 192.A OG1 TYR 49.A OH no hydrogen 2.751 N/A THR 192.A OG1 PHE 188.A O no hydrogen 2.832 N/A THR 192.A OG1 VAL 189.A O no hydrogen 3.488 N/A VAL 193.A N VAL 189.A O no hydrogen 2.856 N/A ASP 194.A N ARG 190.A O no hydrogen 3.079 N/A PHE 195.A N ILE 191.A O no hydrogen 3.032 N/A LEU 196.A N THR 192.A O no hydrogen 2.970 N/A ARG 197.A N.A VAL 193.A O no hydrogen 2.865 N/A ARG 197.A N.B VAL 193.A O no hydrogen 2.844 N/A ASN 198.A N.A PHE 195.A O no hydrogen 3.151 N/A ASN 198.A N.B ASP 194.A O no hydrogen 3.026 N/A ASN 198.A N.B PHE 195.A O no hydrogen 3.154 N/A ASN 198.A ND2.A ASP 194.A O no hydrogen 2.934 N/A LEU 199.A N LEU 196.A O no hydrogen 3.374 N/A