Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6hib_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 4.A OE1 no hydrogen 3.125 N/A GLN 3.A N GLN 3.A OE1 no hydrogen 3.150 N/A GLU 4.A N SER 1.A OG no hydrogen 3.339 N/A GLU 5.A N SER 1.A O no hydrogen 3.210 N/A ASP 6.A N MET 2.A O no hydrogen 2.926 N/A THR 7.A N GLN 3.A O no hydrogen 3.043 N/A THR 7.A OG1 GLN 3.A O no hydrogen 3.098 N/A PHE 8.A N GLU 4.A O no hydrogen 3.113 N/A ARG 9.A N GLU 5.A O no hydrogen 3.004 N/A GLU 10.A N ASP 6.A O no hydrogen 2.960 N/A LEU 11.A N THR 7.A O no hydrogen 3.001 N/A ARG 12.A N PHE 8.A O no hydrogen 2.920 N/A ILE 13.A N ARG 9.A O no hydrogen 2.971 N/A PHE 14.A N GLU 10.A O no hydrogen 2.922 N/A LEU 15.A N LEU 11.A O no hydrogen 2.755 N/A ARG 16.A N ARG 12.A O no hydrogen 2.806 N/A ARG 16.A NE ASP 61.A OD1 no hydrogen 2.748 N/A ARG 16.A NH2 ASP 61.A OD1 no hydrogen 2.985 N/A ASN 17.A N ILE 13.A O no hydrogen 3.153 N/A VAL 18.A N PHE 14.A O no hydrogen 3.035 N/A THR 19.A N LEU 15.A O no hydrogen 2.926 N/A THR 19.A OG1 LEU 15.A O no hydrogen 2.702 N/A THR 19.A OG1 TYR 71.A OH no hydrogen 2.797 N/A HIS 20.A N ARG 16.A O no hydrogen 2.843 N/A ARG 21.A N ASN 17.A O no hydrogen 3.061 N/A ARG 21.A NH1 ASN 17.A OD1 no hydrogen 2.850 N/A ARG 21.A NH1 GLU 114.A OE1 no hydrogen 3.011 N/A ARG 21.A NH1 GLU 114.A OE2 no hydrogen 3.514 N/A ARG 21.A NH2 GLU 114.A OE2 no hydrogen 2.661 N/A LEU 22.A N VAL 18.A O no hydrogen 3.012 N/A ALA 23.A N THR 19.A O no hydrogen 2.899 N/A ILE 24.A N HIS 20.A O no hydrogen 3.104 N/A ASP 25.A N LEU 22.A O no hydrogen 3.129 N/A ARG 27.A N ASP 25.A OD1 no hydrogen 2.951 N/A ARG 27.A NE ASP 25.A OD1 no hydrogen 3.040 N/A ARG 27.A NE ASP 25.A OD2 no hydrogen 3.385 N/A ARG 27.A NH2 ASP 25.A OD2 no hydrogen 2.790 N/A PHE 28.A N ASP 25.A O no hydrogen 2.860 N/A ARG 29.A N LYS 26.A O no hydrogen 3.437 N/A PHE 31.A N PHE 28.A O no hydrogen 2.880 N/A THR 32.A N ARG 29.A O no hydrogen 3.104 N/A THR 32.A OG1 ARG 29.A O no hydrogen 2.679 N/A LYS 33.A NZ SER 54.A OG.B no hydrogen 3.247 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 2.925 N/A GLU 39.A N ASP 36.A OD1 no hydrogen 3.391 N/A VAL 40.A N ASP 36.A O no hydrogen 3.169 N/A VAL 46.A N ASP 42.A O no hydrogen 3.211 N/A ILE 47.A N TYR 43.A O no hydrogen 2.758 N/A LYS 48.A NZ THR 45.A O no hydrogen 2.820 N/A LEU 53.A N PHE 31.A O no hydrogen 2.799 N/A SER 54.A N THR 32.A O no hydrogen 3.291 N/A SER 54.A N ASP 52.A OD2 no hydrogen 2.807 N/A SER 54.A OG.A ASP 52.A OD2 no hydrogen 2.528 N/A SER 54.A OG.B THR 32.A O no hydrogen 2.433 N/A SER 55.A N ASP 52.A OD2 no hydrogen 3.189 N/A SER 55.A OG ASP 52.A OD1 no hydrogen 2.654 N/A VAL 56.A N ASP 52.A O no hydrogen 2.895 N/A ILE 57.A N LEU 53.A O no hydrogen 3.075 N/A SER 58.A N SER 54.A O no hydrogen 3.113 N/A SER 58.A OG SER 54.A O no hydrogen 3.243 N/A LYS 59.A N SER 55.A O no hydrogen 2.963 N/A LYS 59.A NZ ASP 74.A OD2 no hydrogen 2.657 N/A ILE 60.A N VAL 56.A O no hydrogen 2.980 N/A ASP 61.A N ILE 57.A O no hydrogen 3.119 N/A LEU 62.A N SER 58.A O no hydrogen 2.967 N/A HIS 63.A N ILE 60.A O no hydrogen 2.876 N/A LYS 64.A N LYS 59.A O no hydrogen 2.981 N/A TYR 65.A OH ASP 74.A OD2 no hydrogen 2.609 N/A LEU 66.A N ASP 70.A OD2 no hydrogen 3.477 N/A VAL 68.A N GLU 120.A OE1 no hydrogen 2.870 N/A ASP 70.A N THR 67.A OG1 no hydrogen 3.013 N/A TYR 71.A N THR 67.A O no hydrogen 3.338 N/A TYR 71.A OH THR 19.A OG1 no hydrogen 2.797 N/A LEU 72.A N VAL 68.A O no hydrogen 2.774 N/A ARG 73.A N LYS 69.A O no hydrogen 2.991 N/A ARG 73.A NE LYS 69.A O no hydrogen 3.010 N/A ARG 73.A NH2 TYR 108.A OH no hydrogen 3.413 N/A ILE 75.A N TYR 71.A O no hydrogen 3.162 N/A ASP 76.A N LEU 72.A O no hydrogen 2.879 N/A LEU 77.A N ARG 73.A O no hydrogen 2.916 N/A ILE 78.A N ASP 74.A O no hydrogen 2.990 N/A CYS 79.A N ILE 75.A O no hydrogen 3.144 N/A CYS 79.A SG ALA 100.A O no hydrogen 3.432 N/A SER 80.A N ASP 76.A O no hydrogen 2.829 N/A SER 80.A OG ASP 76.A O no hydrogen 3.274 N/A SER 80.A OG LEU 77.A O no hydrogen 3.478 N/A ASN 81.A N LEU 77.A O no hydrogen 2.917 N/A ASN 81.A ND2 GLN 49.A O no hydrogen 2.977 N/A ALA 82.A N ILE 78.A O no hydrogen 3.153 N/A LEU 83.A N CYS 79.A O no hydrogen 2.931 N/A GLU 84.A N SER 80.A O no hydrogen 2.914 N/A GLU 84.A N ASN 81.A O no hydrogen 3.122 N/A TYR 85.A N ASN 81.A O no hydrogen 2.855 N/A TYR 85.A OH ASP 42.A OD1 no hydrogen 2.895 N/A TYR 85.A OH ASP 42.A OD2 no hydrogen 3.300 N/A ASN 86.A ND2 ALA 82.A O no hydrogen 2.985 N/A ASP 88.A N ASP 93.A OD2 no hydrogen 2.899 N/A ARG 94.A N ASP 90.A O no hydrogen 2.891 N/A LEU 95.A N PRO 91.A O no hydrogen 2.928 N/A ILE 96.A N GLY 92.A O no hydrogen 3.215 N/A ARG 97.A N ASP 93.A O no hydrogen 2.999 N/A ARG 97.A NH1 ASN 86.A O no hydrogen 2.590 N/A ARG 97.A NH1 ASP 88.A O no hydrogen 2.838 N/A ARG 97.A NH2 ASP 88.A O no hydrogen 3.501 N/A HIS 98.A N ARG 94.A O no hydrogen 2.882 N/A ARG 99.A N LEU 95.A O no hydrogen 2.915 N/A ALA 100.A N ILE 96.A O no hydrogen 2.731 N/A CYS 101.A N ARG 97.A O no hydrogen 3.051 N/A CYS 101.A SG ARG 97.A O no hydrogen 3.586 N/A ALA 102.A N HIS 98.A O no hydrogen 3.040 N/A LEU 103.A N ARG 99.A O no hydrogen 2.792 N/A ARG 104.A N ALA 100.A O no hydrogen 3.052 N/A ARG 104.A NE.A ASP 105.A OD1 no hydrogen 2.833 N/A ARG 104.A NE.B ASP 76.A OD1 no hydrogen 2.604 N/A ARG 104.A NH2.A ASP 105.A OD1 no hydrogen 2.899 N/A ASP 105.A N CYS 101.A O no hydrogen 2.861 N/A THR 106.A N ALA 102.A O no hydrogen 2.825 N/A THR 106.A OG1 ALA 102.A O no hydrogen 2.764 N/A ALA 107.A N LEU 103.A O no hydrogen 3.009 N/A TYR 108.A N ARG 104.A O no hydrogen 3.066 N/A TYR 108.A OH ASP 76.A OD1 no hydrogen 3.136 N/A TYR 108.A OH ASP 76.A OD2 no hydrogen 2.810 N/A ALA 109.A N ASP 105.A O no hydrogen 2.955 N/A ILE 110.A N THR 106.A O no hydrogen 2.905 N/A ILE 111.A N ALA 107.A O no hydrogen 3.070 N/A LYS 112.A N TYR 108.A O no hydrogen 2.842 N/A GLU 113.A N ALA 109.A O no hydrogen 3.014 N/A GLU 114.A N ILE 110.A O no hydrogen 2.839 N/A LEU 115.A N ILE 111.A O no hydrogen 2.853 N/A ASP 118.A N ASP 116.A OD1 no hydrogen 2.637 N/A GLU 120.A N ASP 116.A O no hydrogen 3.104 N/A GLN 121.A N GLU 117.A O no hydrogen 2.948 N/A GLN 121.A NE2 GLU 125.A OE2 no hydrogen 2.910 N/A LEU 122.A N ASP 118.A O no hydrogen 2.876 N/A CYS 123.A N PHE 119.A O no hydrogen 2.997 N/A CYS 123.A SG PHE 119.A O no hydrogen 3.531 N/A GLU 124.A N GLU 120.A O no hydrogen 2.932 N/A GLU 125.A N GLN 121.A O no hydrogen 2.938 N/A ILE 126.A N LEU 122.A O no hydrogen 2.918 N/A GLN 127.A N CYS 123.A O no hydrogen 2.955 N/A GLU 128.A N GLU 124.A O no hydrogen 2.805 N/A SER 129.A N GLU 125.A O no hydrogen 3.258 N/A SER 129.A N ILE 126.A O no hydrogen 3.191 N/A SER 129.A OG ILE 126.A O no hydrogen 2.831 N/A ARG 130.A N GLN 127.A O no hydrogen 3.159 N/A ARG 130.A NH1 GLU 4.A OE1 no hydrogen 3.390 N/A ARG 130.A NH1 GLU 5.A OE2 no hydrogen 2.878 N/A ARG 130.A NH2 GLU 5.A OE2 no hydrogen 3.481 N/A