Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w3b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG GLU 52.A OE2 no hydrogen 3.805 N/A MET 4.A N TYR 96.A O no hydrogen 2.843 N/A VAL 5.A N LEU 46.A O no hydrogen 3.119 N/A LYS 6.A N ILE 98.A O no hydrogen 2.765 N/A LYS 6.A NZ GLU 45.A OE2 no hydrogen 3.152 N/A VAL 7.A N GLY 44.A O no hydrogen 2.814 N/A LEU 8.A N ALA 100.A O no hydrogen 2.867 N/A ASP 9.A N SER 14.A O no hydrogen 2.700 N/A ALA 10.A N LEU 102.A O no hydrogen 2.775 N/A VAL 11.A N ASP 9.A OD1 no hydrogen 2.789 N/A ARG 12.A N.A ASP 9.A OD1 no hydrogen 2.791 N/A ARG 12.A N.B ASP 9.A OD1 no hydrogen 2.781 N/A ARG 12.A NE.A ASP 9.A OD2 no hydrogen 2.925 N/A ARG 12.A NE.B ASP 9.A OD2 no hydrogen 3.288 N/A ARG 12.A NH2.A ASP 9.A OD2 no hydrogen 2.960 N/A ARG 12.A NH2.B TYR 69.A OH no hydrogen 2.981 N/A GLY 13.A N ASP 9.A O no hydrogen 2.764 N/A SER 14.A N ASP 9.A O no hydrogen 3.153 N/A SER 14.A OG PRO 15.A O no hydrogen 2.950 N/A ALA 16.A N VAL 7.A O no hydrogen 2.859 N/A ASN 18.A N.A THR 40.A O no hydrogen 3.078 N/A ASN 18.A N.B THR 40.A O no hydrogen 2.860 N/A VAL 19.A N THR 40.A OG1 no hydrogen 2.913 N/A VAL 21.A N GLY 38.A O no hydrogen 2.703 N/A HIS 22.A N.A GLU 63.A O.A no hydrogen 2.907 N/A HIS 22.A N.A GLU 63.A O.B no hydrogen 2.752 N/A HIS 22.A N.B GLU 63.A O.A no hydrogen 2.915 N/A HIS 22.A N.B GLU 63.A O.B no hydrogen 2.756 N/A VAL 23.A N ALA 36.A O no hydrogen 2.609 N/A PHE 24.A N LYS 61.A O no hydrogen 2.657 N/A ARG 25.A N.A GLU 33.A O.A no hydrogen 2.931 N/A ARG 25.A N.A GLU 33.A O.B no hydrogen 2.791 N/A ARG 25.A N.B GLU 33.A O.A no hydrogen 2.898 N/A ARG 25.A N.B GLU 33.A O.B no hydrogen 2.774 N/A ARG 25.A N.C GLU 33.A O.A no hydrogen 2.931 N/A ARG 25.A N.C GLU 33.A O.B no hydrogen 2.802 N/A ARG 25.A NE.A GLU 57.A O no hydrogen 3.186 N/A ARG 25.A NH1.B GLU 57.A O no hydrogen 3.053 N/A ARG 25.A NH1.C GLU 33.A OE2.B no hydrogen 2.825 N/A ARG 25.A NH2.A GLU 57.A O no hydrogen 2.554 N/A ARG 25.A NH2.B GLU 57.A O no hydrogen 2.826 N/A ARG 25.A NH2.C GLU 33.A OE2.B no hydrogen 2.825 N/A LYS 26.A N ILE 59.A O no hydrogen 2.734 N/A ALA 27.A N THR 31.A O no hydrogen 2.692 N/A ASP 30.A N ALA 27.A O no hydrogen 2.679 N/A THR 31.A N ASP 29.A OD2.B no hydrogen 3.196 N/A THR 31.A OG1 ASP 29.A OD2.B no hydrogen 2.393 N/A GLU 33.A N.A ARG 25.A O.A no hydrogen 2.782 N/A GLU 33.A N.A ARG 25.A O.B no hydrogen 2.649 N/A GLU 33.A N.A ARG 25.A O.C no hydrogen 2.825 N/A GLU 33.A N.B ARG 25.A O.A no hydrogen 2.735 N/A GLU 33.A N.B ARG 25.A O.B no hydrogen 2.598 N/A GLU 33.A N.B ARG 25.A O.C no hydrogen 2.779 N/A PHE 35.A N VAL 23.A O no hydrogen 2.675 N/A ALA 36.A N VAL 23.A O no hydrogen 3.002 N/A GLY 38.A N VAL 21.A O no hydrogen 2.837 N/A THR 40.A N VAL 19.A O no hydrogen 2.895 N/A THR 40.A OG1 ALA 16.A O no hydrogen 2.606 N/A SER 41.A N GLU 45.A O no hydrogen 2.790 N/A SER 41.A OG GLU 45.A O no hydrogen 3.264 N/A SER 43.A N SER 41.A OG no hydrogen 2.995 N/A SER 43.A OG SER 41.A OG no hydrogen 2.535 N/A GLY 44.A N SER 41.A O no hydrogen 2.840 N/A LEU 46.A N VAL 5.A O no hydrogen 2.757 N/A HIS 47.A NE2.B GLU 45.A OE1 no hydrogen 2.642 N/A THR 50.A OG1 THR 51.A O no hydrogen 3.498 N/A THR 50.A OG1 GLU 54.A OE1 no hydrogen 2.531 N/A THR 51.A N THR 50.A OG1 no hydrogen 2.735 N/A GLU 54.A N THR 51.A O no hydrogen 3.138 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.139 N/A PHE 55.A N THR 51.A O no hydrogen 2.799 N/A VAL 56.A N GLU 54.A O no hydrogen 2.782 N/A GLY 58.A N ALA 88.A O no hydrogen 3.280 N/A TYR 60.A N PHE 86.A O no hydrogen 2.696 N/A TYR 60.A OH VAL 56.A O no hydrogen 2.610 N/A LYS 61.A N PHE 24.A O no hydrogen 2.703 N/A LYS 61.A NZ GLU 63.A OE2.B no hydrogen 2.975 N/A VAL 62.A N VAL 84.A O no hydrogen 2.695 N/A GLU 63.A N.A HIS 22.A O.A no hydrogen 2.538 N/A GLU 63.A N.A HIS 22.A O.B no hydrogen 2.560 N/A GLU 63.A N.B HIS 22.A O.A no hydrogen 2.561 N/A GLU 63.A N.B HIS 22.A O.B no hydrogen 2.579 N/A ILE 64.A N ALA 82.A O no hydrogen 2.641 N/A ASP 65.A N.A ALA 20.A O no hydrogen 2.791 N/A ASP 65.A N.B ALA 20.A O no hydrogen 2.752 N/A THR 66.A N ILE 64.A O no hydrogen 2.721 N/A LYS 67.A NZ GLU 80.A OE1 no hydrogen 3.502 N/A LYS 67.A NZ GLU 80.A OE2 no hydrogen 2.993 N/A SER 68.A N ASP 65.A OD1.A no hydrogen 3.191 N/A SER 68.A N ASP 65.A OD1.B no hydrogen 3.111 N/A SER 68.A OG ASP 65.A OD1.B no hydrogen 2.996 N/A SER 68.A OG ASP 65.A OD2.A no hydrogen 2.618 N/A SER 68.A OG ASP 65.A OD2.B no hydrogen 2.646 N/A TYR 69.A N ASP 65.A O.A no hydrogen 3.468 N/A TYR 69.A N ASP 65.A O.B no hydrogen 3.465 N/A TYR 69.A OH ASP 9.A OD2 no hydrogen 2.451 N/A TRP 70.A N THR 66.A O no hydrogen 2.942 N/A LYS 71.A N.A LYS 67.A O no hydrogen 2.807 N/A LYS 71.A N.B LYS 67.A O no hydrogen 2.785 N/A ALA 72.A N SER 68.A O no hydrogen 2.978 N/A LEU 73.A N TRP 70.A O no hydrogen 2.887 N/A GLY 74.A N LYS 71.A O.A no hydrogen 3.096 N/A GLY 74.A N LYS 71.A O.B no hydrogen 2.750 N/A ILE 75.A N TRP 70.A O no hydrogen 2.934 N/A PHE 78.A N PRO 104.A O no hydrogen 2.809 N/A HIS 81.A NE2.A GLU 83.A OE1 no hydrogen 2.940 N/A ALA 82.A N ILE 64.A O no hydrogen 2.883 N/A VAL 84.A N VAL 62.A O no hydrogen 2.737 N/A PHE 86.A N TYR 60.A O no hydrogen 2.856 N/A ALA 88.A N GLY 58.A O no hydrogen 2.780 N/A ASN 89.A N TYR 96.A OH no hydrogen 2.826 N/A ASN 89.A ND2 VAL 56.A O no hydrogen 3.349 N/A GLY 92.A N ASN 89.A O no hydrogen 3.101 N/A ARG 94.A N ASN 89.A OD1 no hydrogen 3.074 N/A ARG 94.A NH1 SER 91.A O no hydrogen 3.529 N/A ARG 94.A NH1 PRO 93.A O no hydrogen 3.148 N/A ARG 94.A NH2 SER 91.A O no hydrogen 3.304 N/A ARG 95.A N.A THR 114.A O no hydrogen 2.837 N/A ARG 95.A N.B THR 114.A O no hydrogen 2.849 N/A TYR 96.A N PRO 2.A O no hydrogen 2.691 N/A THR 97.A N VAL 112.A O no hydrogen 2.790 N/A ILE 98.A N MET 4.A O no hydrogen 2.779 N/A ALA 99.A N THR 110.A O no hydrogen 2.757 N/A ALA 100.A N LYS 6.A O no hydrogen 2.771 N/A LEU 101.A N SER 108.A O no hydrogen 2.775 N/A LEU 102.A N LEU 8.A O no hydrogen 2.795 N/A SER 103.A N SER 106.A O no hydrogen 2.708 N/A SER 106.A N SER 103.A O no hydrogen 3.197 N/A SER 108.A N LEU 101.A O no hydrogen 3.020 N/A THR 109.A OG1 ALA 99.A O no hydrogen 2.766 N/A THR 110.A N ALA 99.A O no hydrogen 2.868 N/A VAL 112.A N THR 97.A O no hydrogen 2.778 N/A THR 114.A N ARG 95.A O.A no hydrogen 2.882 N/A THR 114.A N ARG 95.A O.B no hydrogen 2.873 N/A