Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tol_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASP 39.A OD2 no hydrogen 2.649 N/A ASP 5.A N ASP 2.A OD1 no hydrogen 2.926 N/A ASN 6.A N ASP 2.A O no hydrogen 3.043 N/A ASN 6.A ND2 ASP 39.A OD2 no hydrogen 3.231 N/A MET 7.A N LEU 3.A O no hydrogen 2.902 N/A GLU 8.A N GLU 4.A O no hydrogen 2.990 N/A THR 9.A N ASP 5.A O no hydrogen 3.072 N/A THR 9.A OG1 ASP 5.A O no hydrogen 3.131 N/A LEU 10.A N ASN 6.A O no hydrogen 2.983 N/A ASN 11.A N MET 7.A O no hydrogen 2.994 N/A ASP 12.A N GLU 8.A O no hydrogen 2.829 N/A ASN 13.A N THR 9.A O no hydrogen 3.040 N/A ASN 13.A ND2 THR 9.A O no hydrogen 2.870 N/A LEU 14.A N LEU 10.A O no hydrogen 3.147 N/A LYS 15.A N ASN 11.A O no hydrogen 3.434 N/A VAL 16.A N ASP 12.A O no hydrogen 3.069 N/A ILE 17.A N ASN 13.A O no hydrogen 2.898 N/A GLU 18.A N LEU 14.A O no hydrogen 2.976 N/A LYS 19.A N LYS 15.A O no hydrogen 3.084 N/A ALA 20.A N ILE 17.A O no hydrogen 3.197 N/A ASP 21.A N GLN 25.A OE1 no hydrogen 2.776 N/A GLN 25.A N ASN 22.A OD1 no hydrogen 2.886 N/A GLN 25.A NE2 ASP 21.A OD2 no hydrogen 3.405 N/A VAL 26.A N ASN 22.A O no hydrogen 3.315 N/A GLU 27.A N ALA 23.A O no hydrogen 2.855 N/A LYS 28.A N ALA 24.A O no hydrogen 3.156 N/A LYS 28.A NZ GLN 25.A O no hydrogen 2.666 N/A ALA 29.A N GLN 25.A O no hydrogen 3.152 N/A LEU 30.A N VAL 26.A O no hydrogen 2.970 N/A GLU 31.A N GLU 27.A O no hydrogen 2.975 N/A LYS 32.A N LYS 28.A O no hydrogen 3.041 N/A MET 33.A N ALA 29.A O no hydrogen 3.052 N/A LEU 34.A N LEU 30.A O no hydrogen 2.930 N/A ALA 35.A N GLU 31.A O no hydrogen 3.082 N/A ALA 36.A N LYS 32.A O no hydrogen 3.052 N/A ALA 37.A N MET 33.A O no hydrogen 2.828 N/A ALA 38.A N LEU 34.A O no hydrogen 2.986 N/A ASP 39.A N ALA 35.A O no hydrogen 2.902 N/A ALA 40.A N ALA 36.A O no hydrogen 2.941 N/A LEU 41.A N ALA 37.A O no hydrogen 3.248 N/A LEU 41.A N ALA 38.A O no hydrogen 3.277 N/A LYS 42.A NZ ASP 39.A O no hydrogen 3.331 N/A ALA 43.A N ALA 40.A O no hydrogen 2.979 N/A LYS 47.A NZ ARG 106.A O no hydrogen 3.072 N/A LEU 48.A N PRO 45.A O no hydrogen 2.901 N/A GLU 49.A N PRO 46.A O no hydrogen 3.310 N/A LYS 51.A N LEU 48.A O no hydrogen 3.055 N/A ASP 54.A N SER 52.A OG no hydrogen 3.020 N/A SER 55.A N SER 52.A O no hydrogen 2.994 N/A SER 55.A OG SER 52.A O no hydrogen 2.785 N/A GLU 57.A N GLU 57.A OE2 no hydrogen 2.810 N/A MET 58.A N SER 55.A OG no hydrogen 3.267 N/A ARG 59.A N SER 55.A O no hydrogen 2.966 N/A ASP 60.A N PRO 56.A O no hydrogen 2.771 N/A PHE 61.A N GLU 57.A O no hydrogen 2.847 N/A ARG 62.A N MET 58.A O no hydrogen 3.035 N/A ARG 62.A NH2 PRO 53.A O no hydrogen 2.820 N/A HIS 63.A N ARG 59.A O no hydrogen 3.005 N/A GLY 64.A N ASP 60.A O no hydrogen 3.145 N/A PHE 65.A N PHE 61.A O no hydrogen 3.476 N/A ALA 66.A N ARG 62.A O no hydrogen 3.141 N/A ILE 67.A N HIS 63.A O no hydrogen 2.970 N/A LEU 68.A N GLY 64.A O no hydrogen 2.842 N/A MET 69.A N PHE 65.A O no hydrogen 2.823 N/A GLY 70.A N ALA 66.A O no hydrogen 3.106 N/A GLN 71.A N ILE 67.A O no hydrogen 3.043 N/A GLN 71.A NE2 THR 97.A OG1 no hydrogen 2.661 N/A ILE 72.A N LEU 68.A O no hydrogen 2.918 N/A HIS 73.A N MET 69.A O no hydrogen 2.837 N/A ASP 74.A N GLY 70.A O no hydrogen 2.981 N/A ALA 75.A N GLN 71.A O no hydrogen 3.019 N/A ALA 76.A N ILE 72.A O no hydrogen 2.817 N/A HIS 77.A N HIS 73.A O no hydrogen 3.150 N/A LEU 78.A N ASP 74.A O no hydrogen 3.166 N/A ALA 79.A N ALA 75.A O no hydrogen 3.144 N/A ASN 80.A N ALA 76.A O no hydrogen 2.856 N/A ASN 80.A ND2 GLU 27.A OE1 no hydrogen 3.012 N/A GLU 81.A N HIS 77.A O no hydrogen 3.012 N/A GLU 81.A N LEU 78.A O no hydrogen 3.142 N/A GLY 82.A N ALA 79.A O no hydrogen 2.925 N/A LYS 83.A N LEU 78.A O no hydrogen 3.098 N/A ALA 87.A N LYS 83.A O no hydrogen 2.982 N/A GLN 88.A N VAL 84.A O no hydrogen 2.950 N/A GLN 88.A NE2 ILE 17.A O no hydrogen 2.829 N/A ALA 89.A N LYS 85.A O no hydrogen 2.989 N/A ALA 90.A N GLU 86.A O no hydrogen 3.005 N/A ALA 91.A N ALA 87.A O no hydrogen 2.886 N/A GLU 92.A N GLN 88.A O no hydrogen 2.963 N/A GLN 93.A N ALA 89.A O no hydrogen 2.928 N/A LEU 94.A N ALA 90.A O no hydrogen 3.205 N/A LEU 94.A N ALA 91.A O no hydrogen 3.202 N/A LYS 95.A N GLU 92.A O no hydrogen 3.148 N/A LYS 95.A NZ GLU 18.A OE2 no hydrogen 3.536 N/A LYS 95.A NZ GLU 92.A OE2 no hydrogen 2.877 N/A THR 96.A N GLN 93.A O no hydrogen 3.290 N/A THR 97.A N LEU 94.A O no hydrogen 2.844 N/A CYS 98.A N LEU 94.A O no hydrogen 3.158 N/A CYS 98.A SG LEU 94.A O no hydrogen 3.404 N/A ASN 99.A N LYS 95.A O no hydrogen 2.789 N/A ALA 100.A N THR 96.A O no hydrogen 3.179 N/A CYS 101.A N THR 97.A O no hydrogen 3.309 N/A HIS 102.A N CYS 98.A O no hydrogen 3.115 N/A GLN 103.A N ASN 99.A O no hydrogen 2.897 N/A LYS 104.A N ALA 100.A O no hydrogen 3.376 N/A LYS 104.A NZ ASP 60.A OD2 no hydrogen 2.703 N/A TYR 105.A N CYS 101.A O no hydrogen 2.803 N/A TYR 105.A OH ASP 60.A OD2 no hydrogen 2.639 N/A ARG 106.A N HIS 102.A O no hydrogen 2.928 N/A