Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a3i_K.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N GLU 8.A OE2 no hydrogen 2.966 N/A GLU 8.A N ASP 5.A O no hydrogen 3.367 N/A LEU 9.A N ARG 6.A O no hydrogen 2.996 N/A PHE 10.A N PHE 7.A O no hydrogen 3.349 N/A LEU 11.A N PHE 7.A O no hydrogen 3.099 N/A SER 17.A OG LEU 19.A O no hydrogen 3.435 N/A LYS 18.A NZ GLU 36.A O no hydrogen 2.698 N/A LYS 18.A NZ LYS 37.A O no hydrogen 2.975 N/A LYS 20.A N THR 34.A O no hydrogen 3.211 N/A ASP 22.A N VAL 32.A O no hydrogen 2.730 N/A ASP 24.A N ALA 30.A O no hydrogen 2.911 N/A VAL 31.A N ILE 75.A O no hydrogen 2.802 N/A VAL 32.A N ASP 22.A O no hydrogen 2.619 N/A ILE 33.A N LEU 73.A O no hydrogen 2.786 N/A THR 34.A N LYS 20.A O no hydrogen 2.784 N/A PHE 35.A N PHE 71.A O no hydrogen 2.842 N/A GLU 36.A N LYS 18.A O no hydrogen 3.014 N/A HIS 40.A ND1 TYR 61.A OH no hydrogen 2.661 N/A THR 41.A OG1 ASP 39.A OD1 no hydrogen 3.130 N/A LEU 42.A N ASP 39.A O no hydrogen 2.913 N/A GLY 43.A N ASP 39.A O no hydrogen 2.870 N/A ILE 46.A N LEU 42.A O no hydrogen 3.141 N/A ARG 47.A N GLY 43.A O no hydrogen 3.109 N/A ARG 47.A NH2 ASN 44.A OD1 no hydrogen 3.412 N/A ALA 48.A N ASN 44.A O no hydrogen 2.861 N/A GLU 49.A N LEU 45.A O no hydrogen 3.115 N/A LEU 50.A N ILE 46.A O no hydrogen 2.895 N/A LEU 51.A N ARG 47.A O no hydrogen 3.045 N/A ASN 52.A N GLU 49.A O no hydrogen 2.987 N/A ASN 52.A ND2 GLU 49.A OE2 no hydrogen 3.343 N/A ASP 53.A N LEU 50.A O no hydrogen 3.134 N/A LYS 55.A N ASP 53.A OD1 no hydrogen 3.093 N/A VAL 56.A N ASP 53.A O no hydrogen 3.047 N/A LEU 57.A N GLN 76.A O no hydrogen 2.740 N/A PHE 58.A N GLN 76.A O no hydrogen 2.922 N/A ALA 60.A N ARG 74.A O no hydrogen 3.208 N/A TYR 61.A OH HIS 40.A ND1 no hydrogen 2.661 N/A LYS 62.A N LYS 72.A O no hydrogen 2.930 N/A LYS 62.A NZ GLU 64.A OE1 no hydrogen 3.537 N/A PHE 67.A N HIS 65.A ND1 no hydrogen 3.066 N/A PHE 68.A N HIS 65.A O no hydrogen 3.430 N/A ARG 70.A NE GLU 36.A OE1 no hydrogen 2.889 N/A PHE 71.A N PHE 35.A O no hydrogen 3.067 N/A LYS 72.A N LYS 62.A O no hydrogen 3.119 N/A LYS 72.A NZ GLU 64.A OE2 no hydrogen 2.801 N/A LEU 73.A N ILE 33.A O no hydrogen 2.792 N/A ARG 74.A N ALA 60.A O no hydrogen 2.902 N/A ILE 75.A N VAL 31.A O no hydrogen 2.891 N/A GLN 76.A N PHE 58.A O no hydrogen 2.878 N/A THR 77.A N ASN 29.A O no hydrogen 3.281 N/A THR 77.A OG1 ASN 29.A OD1 no hydrogen 2.933 N/A THR 77.A OG1 TYR 81.A O no hydrogen 3.107 N/A THR 78.A N LYS 55.A O no hydrogen 2.938 N/A THR 78.A OG1 LYS 55.A O no hydrogen 2.842 N/A TYR 81.A N THR 78.A O no hydrogen 2.944 N/A TYR 81.A OH ASP 53.A OD2 no hydrogen 2.649 N/A LYS 84.A N ASP 82.A OD1 no hydrogen 3.101 N/A ASP 85.A N ASP 82.A O no hydrogen 2.796 N/A ALA 86.A N ASP 82.A O no hydrogen 3.153 N/A LEU 87.A N PRO 83.A O no hydrogen 3.045 N/A LYS 88.A N LYS 84.A O no hydrogen 3.077 N/A ASN 89.A N ASP 85.A O no hydrogen 2.780 N/A ASN 89.A ND2 TYR 81.A OH no hydrogen 3.440 N/A ALA 90.A N ALA 86.A O no hydrogen 2.859 N/A CYS 91.A N LEU 87.A O no hydrogen 2.965 N/A CYS 91.A N LYS 88.A O no hydrogen 3.212 N/A ASN 92.A N LYS 88.A O no hydrogen 3.195 N/A SER 93.A N ASN 89.A O no hydrogen 3.065 N/A SER 93.A OG GLU 49.A OE1 no hydrogen 2.750 N/A ILE 94.A N ALA 90.A O no hydrogen 3.136 N/A ILE 95.A N CYS 91.A O no hydrogen 3.156 N/A ASN 96.A N ASN 92.A O no hydrogen 2.744 N/A LYS 97.A N SER 93.A O no hydrogen 2.976 N/A LYS 97.A NZ GLU 49.A OE2 no hydrogen 2.567 N/A LEU 98.A N ILE 94.A O no hydrogen 2.874 N/A GLY 99.A N ILE 95.A O no hydrogen 2.717 N/A ALA 100.A N ASN 96.A O no hydrogen 3.219 N/A LEU 101.A N LYS 97.A O no hydrogen 3.060 N/A LYS 102.A N LEU 98.A O no hydrogen 2.752 N/A LYS 102.A NZ GLU 106.A OE2 no hydrogen 3.272 N/A THR 103.A N GLY 99.A O no hydrogen 3.007 N/A THR 103.A OG1 GLY 99.A O no hydrogen 2.660 N/A THR 103.A OG1 ALA 100.A O no hydrogen 3.413 N/A ASN 104.A N ALA 100.A O no hydrogen 2.854 N/A ASN 104.A ND2 ALA 100.A O no hydrogen 2.682 N/A PHE 105.A N LEU 101.A O no hydrogen 2.959 N/A PHE 105.A N LYS 102.A O no hydrogen 3.089 N/A GLU 106.A N LYS 102.A O no hydrogen 2.994 N/A THR 107.A N THR 103.A O no hydrogen 2.981 N/A GLU 108.A N ASN 104.A O no hydrogen 3.192 N/A TRP 109.A N PHE 105.A O no hydrogen 2.720 N/A ASN 110.A N GLU 106.A O no hydrogen 2.727 N/A LEU 111.A N THR 107.A O no hydrogen 3.184 N/A LEU 111.A N GLU 108.A O no hydrogen 3.196 N/A GLN 112.A N TRP 109.A O no hydrogen 2.958 N/A GLN 112.A NE2 GLU 108.A OE1 no hydrogen 3.449 N/A