Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u1i_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N ALA 67.A O no hydrogen 2.788 N/A VAL 9.A N ASP 8.A OD2 no hydrogen 2.636 N/A GLY 18.A N GLN 38.A O no hydrogen 2.934 N/A TYR 20.A N GLY 36.A O no hydrogen 2.779 N/A TYR 20.A OH GLU 16.A O no hydrogen 2.482 N/A ARG 21.A NH1 GLN 32.A OE1 no hydrogen 3.062 N/A ARG 21.A NH1 GLU 98.A O no hydrogen 2.994 N/A ARG 21.A NH1 LYS 101.A O no hydrogen 3.425 N/A ARG 21.A NH2 LYS 101.A O no hydrogen 2.934 N/A ILE 22.A N GLY 34.A O no hydrogen 2.631 N/A GLN 24.A N THR 31.A O no hydrogen 2.874 N/A GLY 26.A N GLN 25.A OE1 no hydrogen 2.683 N/A THR 31.A N GLN 24.A O no hydrogen 3.001 N/A GLN 32.A NE2 VAL 97.A O no hydrogen 2.810 N/A GLN 32.A NE2 GLY 130.A O no hydrogen 2.951 N/A VAL 33.A N ILE 22.A O no hydrogen 2.847 N/A GLY 34.A N ILE 22.A O no hydrogen 3.360 N/A VAL 35.A N SER 132.A O no hydrogen 2.869 N/A GLY 36.A N TYR 20.A O no hydrogen 2.917 N/A VAL 37.A N HIS 44.A O no hydrogen 2.853 N/A GLN 38.A N GLY 18.A O no hydrogen 2.843 N/A GLN 38.A NE2 LEU 15.A O no hydrogen 3.457 N/A LYS 39.A N VAL 42.A O no hydrogen 2.998 N/A LYS 39.A NZ ARG 81.A O no hydrogen 3.040 N/A GLU 40.A N GLU 17.A OE2 no hydrogen 2.784 N/A VAL 42.A N LYS 39.A O no hydrogen 3.242 N/A PHE 43.A N TYR 76.A O no hydrogen 2.866 N/A HIS 44.A N VAL 37.A O no hydrogen 2.732 N/A HIS 44.A ND1 VAL 37.A O no hydrogen 2.967 N/A THR 45.A N ILE 74.A O no hydrogen 2.962 N/A THR 45.A OG1 VAL 35.A O no hydrogen 2.821 N/A MET 46.A N THR 45.A OG1 no hydrogen 2.620 N/A HIS 48.A N ASP 72.A OD1 no hydrogen 2.865 N/A HIS 48.A ND1 ASP 72.A OD2 no hydrogen 2.633 N/A VAL 49.A N MET 46.A O no hydrogen 3.036 N/A THR 50.A N TRP 47.A O no hydrogen 3.334 N/A THR 50.A OG1 TYR 76.A OH no hydrogen 2.909 N/A ARG 51.A N TRP 47.A O no hydrogen 2.772 N/A GLY 52.A N THR 50.A OG1 no hydrogen 3.160 N/A ALA 53.A N THR 50.A O no hydrogen 3.073 N/A LEU 55.A N LEU 62.A O no hydrogen 2.965 N/A HIS 57.A N LYS 60.A O no hydrogen 3.411 N/A LEU 62.A N LEU 55.A O no hydrogen 2.953 N/A ASN 65.A N SER 75.A O no hydrogen 2.887 N/A ASN 65.A ND2 GLU 63.A O no hydrogen 2.779 N/A TRP 66.A N SER 75.A O no hydrogen 3.342 N/A ALA 67.A N LEU 6.A O no hydrogen 3.006 N/A SER 68.A N LEU 73.A O no hydrogen 2.916 N/A VAL 69.A N GLY 4.A O no hydrogen 3.038 N/A LYS 71.A N SER 68.A OG no hydrogen 3.239 N/A ASP 72.A N VAL 69.A O no hydrogen 2.922 N/A LEU 73.A N SER 68.A O no hydrogen 3.174 N/A ILE 74.A N THR 45.A O no hydrogen 2.920 N/A SER 75.A N TRP 66.A O no hydrogen 2.785 N/A SER 75.A OG GLY 78.A O no hydrogen 2.813 N/A TYR 76.A N PHE 43.A O no hydrogen 2.696 N/A TYR 76.A OH THR 50.A OG1 no hydrogen 2.909 N/A TYR 76.A OH ALA 53.A O no hydrogen 2.523 N/A TRP 80.A NE1 GLN 164.A OE1 no hydrogen 2.806 N/A ARG 81.A N HIS 44.A NE2 no hydrogen 3.036 N/A GLN 85.A NE2 THR 165.A O no hydrogen 3.516 N/A TRP 86.A NE1 GLU 90.A O no hydrogen 2.829 N/A GLN 87.A NE2 GLN 85.A O no hydrogen 2.749 N/A GLU 90.A N GLN 87.A O no hydrogen 3.189 N/A GLU 91.A N GLU 91.A OE2 no hydrogen 2.790 N/A VAL 92.A N THR 108.A O no hydrogen 2.946 N/A GLN 93.A N ILE 137.A O no hydrogen 3.030 N/A GLN 93.A NE2 GLN 107.A OE1 no hydrogen 3.242 N/A VAL 94.A N PHE 106.A O no hydrogen 2.982 N/A ILE 95.A N PRO 135.A O no hydrogen 3.052 N/A ALA 96.A N LYS 104.A O no hydrogen 3.057 N/A VAL 97.A N SER 134.A OG no hydrogen 3.277 N/A LYS 101.A N GLU 98.A O no hydrogen 3.156 N/A LYS 101.A NZ GLU 98.A OE2 no hydrogen 3.500 N/A LYS 104.A N ALA 96.A O no hydrogen 3.143 N/A ASN 105.A ND2 GLN 93.A OE1 no hydrogen 2.718 N/A PHE 106.A N VAL 94.A O no hydrogen 2.911 N/A THR 108.A N VAL 92.A O no hydrogen 3.020 N/A GLY 111.A N ALA 122.A O no hydrogen 2.923 N/A PHE 113.A N ILE 120.A O no hydrogen 2.678 N/A THR 115.A N GLY 118.A O no hydrogen 3.001 N/A THR 115.A OG1 GLY 118.A O no hydrogen 3.160 N/A GLY 118.A N THR 115.A OG1 no hydrogen 2.875 N/A ILE 120.A N PHE 113.A O no hydrogen 3.085 N/A ALA 122.A N GLY 111.A O no hydrogen 2.918 N/A ILE 123.A N SER 160.A O no hydrogen 2.733 N/A PHE 127.A N TYR 147.A OH no hydrogen 3.010 N/A LYS 128.A N GLU 98.A OE1 no hydrogen 2.813 N/A SER 132.A OG HIS 48.A NE2 no hydrogen 3.413 N/A GLY 133.A N TYR 147.A O no hydrogen 2.795 N/A SER 134.A N THR 131.A O no hydrogen 3.252 N/A SER 134.A OG ILE 95.A O no hydrogen 3.429 N/A SER 134.A OG THR 131.A O no hydrogen 2.869 N/A ILE 136.A N GLY 145.A O no hydrogen 2.813 N/A ILE 137.A N GLN 93.A O no hydrogen 2.725 N/A ASN 138.A N LYS 142.A O no hydrogen 2.801 N/A GLY 141.A N ASN 138.A O no hydrogen 2.853 N/A LYS 142.A N ASN 138.A OD1 no hydrogen 2.980 N/A VAL 144.A N ILE 136.A O no hydrogen 2.764 N/A LEU 146.A N ALA 163.A O no hydrogen 2.802 N/A TYR 147.A N SER 134.A O no hydrogen 2.852 N/A TYR 147.A OH LEU 125.A O no hydrogen 2.814 N/A GLY 148.A N SER 160.A OG no hydrogen 3.047 N/A VAL 151.A N VAL 159.A O no hydrogen 2.898 N/A THR 153.A N GLY 157.A O no hydrogen 2.770 N/A THR 153.A OG1 GLY 157.A O no hydrogen 3.494 N/A ASN 155.A N THR 153.A OG1 no hydrogen 3.297 N/A GLY 156.A N THR 153.A O no hydrogen 3.006 N/A GLY 157.A N THR 153.A OG1 no hydrogen 2.937 N/A VAL 159.A N VAL 151.A O no hydrogen 2.978 N/A SER 160.A N ILE 123.A O no hydrogen 2.886 N/A SER 160.A OG GLY 161.A O no hydrogen 2.682 N/A GLY 161.A N ASN 149.A O no hydrogen 2.828 N/A ILE 162.A N GLY 121.A O no hydrogen 3.128 N/A ALA 163.A N LEU 146.A O no hydrogen 2.978 N/A GLN 164.A NE2 ALA 84.A O no hydrogen 2.938 N/A THR 165.A N GLN 164.A OE1 no hydrogen 2.936 N/A GLU 168.A N TRP 80.A O no hydrogen 2.761 N/A