Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8bbw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N TYR 87.A OH no hydrogen 3.504 N/A THR 2.A OG1 SER 4.A OG.C no hydrogen 3.096 N/A SER 4.A OG.C THR 2.A OG1 no hydrogen 3.096 N/A CYS 5.A N THR 2.A OG1 no hydrogen 3.081 N/A CYS 5.A SG CYS 84.A O no hydrogen 3.907 N/A LEU 6.A N THR 2.A O no hydrogen 2.962 N/A ARG 7.A N.A ASP 3.A O no hydrogen 2.808 N/A ARG 7.A N.B ASP 3.A O no hydrogen 2.800 N/A CYS 8.A N SER 4.A O.A no hydrogen 3.111 N/A CYS 8.A N SER 4.A O.B no hydrogen 3.167 N/A CYS 8.A N SER 4.A O.C no hydrogen 3.186 N/A CYS 8.A SG SER 4.A O.B no hydrogen 3.934 N/A CYS 8.A SG SER 4.A O.C no hydrogen 3.904 N/A ILE 9.A N CYS 5.A O no hydrogen 3.001 N/A CYS 10.A N LEU 6.A O no hydrogen 2.903 N/A CYS 10.A SG PRO 33.A O no hydrogen 3.936 N/A LYS 11.A N ARG 7.A O.A no hydrogen 2.890 N/A LYS 11.A N ARG 7.A O.B no hydrogen 3.031 N/A VAL 12.A N CYS 8.A O no hydrogen 3.127 N/A GLU 13.A N ILE 9.A O no hydrogen 3.028 N/A GLY 14.A N LYS 11.A O no hydrogen 3.370 N/A CYS 15.A N PRO 33.A O no hydrogen 3.270 N/A SER 17.A N.A GLY 14.A O no hydrogen 3.244 N/A SER 17.A N.B GLY 14.A O no hydrogen 3.260 N/A SER 17.A OG.A GLY 14.A O no hydrogen 2.737 N/A GLN 18.A N.A CYS 15.A O no hydrogen 2.963 N/A GLN 18.A N.B CYS 15.A O no hydrogen 2.935 N/A GLN 18.A NE2.A SER 17.A OG.A no hydrogen 3.200 N/A ILE 19.A N ASP 16.A O no hydrogen 3.173 N/A GLY 20.A N LYS 56.A O no hydrogen 2.827 N/A LYS 21.A N GLN 18.A O.A no hydrogen 3.150 N/A LYS 21.A N GLN 18.A O.B no hydrogen 2.999 N/A LYS 21.A NZ SER 17.A O.A no hydrogen 2.856 N/A LYS 21.A NZ SER 17.A O.B no hydrogen 2.874 N/A GLY 23.A N SER 30.A O no hydrogen 2.921 N/A GLY 27.A N MET 24.A O.A no hydrogen 2.960 N/A GLY 27.A N MET 24.A O.B no hydrogen 2.935 N/A SER 30.A N GLY 23.A O no hydrogen 2.868 N/A SER 30.A OG SER 28.A O no hydrogen 3.386 N/A CYS 31.A N ILE 36.A O no hydrogen 3.051 N/A CYS 31.A SG TYR 51.A OH no hydrogen 3.482 N/A GLY 32.A N LYS 21.A O no hydrogen 2.782 N/A TYR 34.A OH GLU 62.A OE2 no hydrogen 2.629 N/A GLN 35.A N GLY 32.A O no hydrogen 2.923 N/A ILE 36.A N CYS 31.A O no hydrogen 3.047 N/A TYR 40.A OH HIS 91.A ND1 no hydrogen 2.787 N/A TRP 41.A N LYS 37.A O no hydrogen 3.083 N/A TRP 41.A NE1 PRO 47.A O no hydrogen 2.883 N/A ILE 42.A N LYS 38.A O no hydrogen 2.921 N/A ASP 43.A N PRO 39.A O no hydrogen 2.902 N/A CYS 44.A N TYR 40.A O no hydrogen 2.796 N/A CYS 44.A SG TYR 40.A O no hydrogen 3.690 N/A CYS 44.A SG TRP 41.A O no hydrogen 3.297 N/A GLY 45.A N ILE 42.A O no hydrogen 3.022 N/A LYS 46.A N TRP 41.A O no hydrogen 2.914 N/A TYR 51.A OH LEU 29.A O no hydrogen 3.312 N/A TYR 51.A OH ILE 36.A O no hydrogen 2.662 N/A GLU 52.A N.A GLU 52.A OE1.A no hydrogen 2.939 N/A CYS 54.A N GLY 50.A O no hydrogen 2.920 N/A THR 55.A N TYR 51.A O no hydrogen 2.922 N/A THR 55.A OG1 TYR 51.A O no hydrogen 2.775 N/A LYS 56.A N GLU 52.A O.A no hydrogen 3.037 N/A LYS 56.A N GLU 52.A O.B no hydrogen 2.988 N/A LYS 56.A NZ GLU 52.A OE1.B no hydrogen 3.566 N/A ASN 57.A N CYS 54.A O no hydrogen 3.048 N/A LYS 58.A NZ ASP 16.A OD1 no hydrogen 2.897 N/A CYS 60.A N ASN 57.A OD1 no hydrogen 2.816 N/A SER 61.A N ASN 57.A O no hydrogen 2.977 N/A SER 61.A OG CYS 54.A O no hydrogen 3.515 N/A SER 61.A OG ASN 57.A O no hydrogen 2.823 N/A GLU 62.A N LYS 58.A O no hydrogen 2.928 N/A THR 63.A N ALA 59.A O no hydrogen 3.039 N/A THR 63.A OG1 ALA 59.A O no hydrogen 3.392 N/A CYS 64.A N CYS 60.A O no hydrogen 2.985 N/A VAL 65.A N SER 61.A O no hydrogen 2.845 N/A ARG 66.A N.A GLU 62.A O no hydrogen 2.915 N/A ARG 66.A N.B GLU 62.A O no hydrogen 2.913 N/A ARG 66.A NH2.A ASP 3.A OD1 no hydrogen 2.305 N/A ARG 66.A NH2.B ASP 3.A OD1 no hydrogen 3.269 N/A ALA 67.A N THR 63.A O no hydrogen 3.074 N/A TYR 68.A N CYS 64.A O no hydrogen 2.862 N/A MET 69.A N VAL 65.A O no hydrogen 2.905 N/A LYS 70.A N ARG 66.A O.A no hydrogen 2.997 N/A LYS 70.A N ARG 66.A O.B no hydrogen 3.023 N/A ARG 71.A N.A ALA 67.A O no hydrogen 2.895 N/A ARG 71.A N.B ALA 67.A O no hydrogen 2.893 N/A ARG 71.A NE.A TYR 72.A OH no hydrogen 2.771 N/A TYR 72.A N TYR 68.A O no hydrogen 2.874 N/A GLY 73.A N MET 69.A O no hydrogen 2.972 N/A CYS 76.A N TYR 72.A O no hydrogen 2.898 N/A THR 77.A N GLY 73.A O no hydrogen 3.173 N/A THR 77.A OG1 GLY 73.A O no hydrogen 3.537 N/A THR 77.A OG1 THR 74.A O no hydrogen 3.365 N/A THR 77.A OG1 ARG 80.A O.A no hydrogen 2.703 N/A THR 77.A OG1 ARG 80.A O.B no hydrogen 2.680 N/A GLY 78.A N PHE 75.A O no hydrogen 3.185 N/A GLY 79.A N THR 74.A O no hydrogen 2.958 N/A GLY 79.A N THR 77.A OG1 no hydrogen 3.417 N/A ARG 80.A NH1.B THR 81.A O no hydrogen 3.301 N/A ARG 80.A NH1.B ASP 86.A OD2 no hydrogen 2.725 N/A ARG 80.A NH2.B ASP 86.A OD1 no hydrogen 2.959 N/A ARG 80.A NH2.B ASP 86.A OD2 no hydrogen 3.461 N/A THR 83.A N ASP 86.A OD2 no hydrogen 2.866 N/A THR 83.A OG1 ASP 86.A OD2 no hydrogen 3.453 N/A TYR 87.A N THR 83.A O no hydrogen 2.950 N/A ALA 88.A N CYS 84.A O no hydrogen 2.805 N/A ARG 89.A N GLN 85.A O no hydrogen 2.995 N/A ARG 89.A NE THR 103.A OG1 no hydrogen 2.846 N/A ARG 89.A NH1 GLN 85.A OE1 no hydrogen 2.877 N/A ARG 89.A NH2 SER 100.A O no hydrogen 2.767 N/A ILE 90.A N.A ASP 86.A O no hydrogen 2.938 N/A ILE 90.A N.B ASP 86.A O no hydrogen 2.881 N/A HIS 91.A N TYR 87.A O no hydrogen 2.942 N/A HIS 91.A ND1 TYR 40.A OH no hydrogen 2.787 N/A HIS 91.A NE2 TYR 34.A O no hydrogen 2.942 N/A ASN 92.A N ALA 88.A O no hydrogen 3.148 N/A GLY 93.A N ARG 89.A O no hydrogen 2.837 N/A GLY 94.A N ILE 90.A O.A no hydrogen 2.977 N/A GLY 94.A N ILE 90.A O.B no hydrogen 2.817 N/A GLY 97.A N GLY 94.A O no hydrogen 2.770 N/A LYS 99.A N ARG 96.A O.A no hydrogen 3.170 N/A LYS 99.A N ARG 96.A O.B no hydrogen 3.194 N/A LYS 99.A NZ CYS 76.A O no hydrogen 2.890 N/A SER 100.A N GLY 97.A O no hydrogen 3.104 N/A ALA 102.A N SER 100.A OG no hydrogen 3.145 N/A THR 103.A N SER 100.A O no hydrogen 3.168 N/A THR 103.A OG1 GLY 97.A O no hydrogen 2.702 N/A THR 103.A OG1 SER 100.A O no hydrogen 2.925 N/A VAL 104.A N SER 101.A O no hydrogen 3.224 N/A TYR 106.A OH GLU 13.A OE2 no hydrogen 2.673 N/A TRP 107.A N THR 103.A O no hydrogen 3.045 N/A ASN 108.A N VAL 104.A O no hydrogen 2.827 N/A LYS 109.A N GLY 105.A O no hydrogen 3.186 N/A VAL 110.A N TYR 106.A O no hydrogen 3.045 N/A GLN 111.A N TRP 107.A O no hydrogen 2.771 N/A LYS 112.A N.A ASN 108.A O no hydrogen 3.046 N/A LYS 112.A N.B ASN 108.A O no hydrogen 3.007 N/A CYS 113.A N LYS 109.A O no hydrogen 3.217 N/A LEU 114.A N VAL 110.A O no hydrogen 2.987 N/A ARG 115.A N.A GLN 111.A O no hydrogen 2.952 N/A ARG 115.A N.A LYS 112.A O.B no hydrogen 2.914 N/A ARG 115.A N.B GLN 111.A O no hydrogen 2.738 N/A ARG 115.A NE.B ARG 115.A O.B no hydrogen 2.711 N/A ARG 115.A NH2.B ARG 115.A O.B no hydrogen 3.418 N/A GLY 116.A N.A CYS 113.A O no hydrogen 3.160 N/A GLY 116.A N.B LYS 112.A O.B no hydrogen 2.881 N/A THR 117.A N.A LYS 112.A O.A no hydrogen 2.854 N/A THR 117.A N.A LYS 112.A O.B no hydrogen 3.069 N/A THR 117.A N.B LYS 112.A O.A no hydrogen 3.209 N/A THR 117.A N.B LYS 112.A O.B no hydrogen 3.267 N/A