Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fro_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 GLU 6.A OE1 no hydrogen 3.421 N/A ALA 7.A N THR 4.A OG1 no hydrogen 2.935 N/A ALA 8.A N THR 4.A O no hydrogen 2.889 N/A LEU 9.A N ASP 5.A O no hydrogen 2.905 N/A SER 10.A N GLU 6.A O no hydrogen 3.002 N/A SER 10.A OG GLU 6.A O no hydrogen 3.461 N/A SER 10.A OG ALA 7.A O no hydrogen 2.728 N/A CYS 11.A N ALA 8.A O no hydrogen 3.026 N/A CYS 11.A SG ALA 7.A O no hydrogen 3.394 N/A CYS 12.A N LEU 9.A O no hydrogen 2.934 N/A CYS 12.A SG ALA 8.A O no hydrogen 3.423 N/A SER 18.A N ASP 16.A OD1 no hydrogen 2.926 N/A SER 18.A OG ASP 16.A OD1 no hydrogen 2.756 N/A THR 19.A N ASP 16.A O no hydrogen 2.887 N/A THR 19.A OG1 ASP 16.A O no hydrogen 2.777 N/A LYS 20.A N PRO 17.A O no hydrogen 3.113 N/A PHE 22.A N THR 19.A O no hydrogen 3.176 N/A GLN 25.A NE2 ARG 87.A O no hydrogen 3.205 N/A GLN 26.A NE2 GLN 25.A OE1 no hydrogen 2.857 N/A THR 27.A N THR 90.A O no hydrogen 3.139 N/A LEU 29.A N GLU 92.A O no hydrogen 3.025 N/A VAL 31.A N THR 94.A O no hydrogen 2.950 N/A LYS 32.A N ASP 160.A OD2 no hydrogen 2.891 N/A LYS 32.A NZ THR 99.A O no hydrogen 2.618 N/A LYS 32.A NZ ASP 102.A O no hydrogen 2.479 N/A LYS 32.A NZ GLN 105.A O no hydrogen 2.942 N/A LYS 32.A NZ GLN 105.A OE1 no hydrogen 3.158 N/A LYS 35.A N ASP 33.A OD1 no hydrogen 3.043 N/A SER 37.A N ASP 33.A O no hydrogen 3.088 N/A SER 37.A OG ASP 33.A O no hydrogen 3.040 N/A SER 37.A OG ASP 160.A OD1 no hydrogen 3.548 N/A LEU 38.A N PRO 34.A O no hydrogen 2.804 N/A ASP 39.A N LYS 35.A O no hydrogen 3.240 N/A PHE 40.A N LYS 36.A O no hydrogen 3.013 N/A TYR 41.A N SER 37.A O no hydrogen 2.916 N/A TYR 41.A OH ASP 158.A OD2 no hydrogen 2.618 N/A THR 42.A N LEU 38.A O no hydrogen 3.069 N/A THR 42.A OG1 LEU 38.A O no hydrogen 2.694 N/A ARG 43.A N ASP 39.A O no hydrogen 2.867 N/A ARG 43.A NE ASP 39.A OD1 no hydrogen 2.786 N/A ARG 43.A NE ASP 39.A OD2 no hydrogen 3.368 N/A ARG 43.A NH2 ASP 39.A OD2 no hydrogen 2.925 N/A VAL 44.A N PHE 40.A O no hydrogen 2.977 N/A LEU 45.A N PHE 40.A O no hydrogen 3.091 N/A GLY 46.A N THR 42.A O no hydrogen 3.008 N/A MET 47.A N TYR 41.A O no hydrogen 2.831 N/A THR 48.A N ALA 66.A O no hydrogen 2.929 N/A THR 48.A OG1 GLU 68.A O no hydrogen 2.968 N/A ILE 50.A N PHE 64.A O no hydrogen 2.838 N/A LYS 52.A NZ ASP 54.A OD1 no hydrogen 3.150 N/A LYS 52.A NZ ASP 54.A OD2 no hydrogen 2.807 N/A CYS 53.A N LEU 62.A O no hydrogen 2.882 N/A CYS 53.A SG GLN 51.A OE1 no hydrogen 3.861 N/A PHE 55.A N PHE 60.A O no hydrogen 2.765 N/A LYS 59.A N PRO 56.A O no hydrogen 3.238 N/A PHE 60.A N PHE 55.A O no hydrogen 3.260 N/A SER 61.A N HIS 95.A O no hydrogen 2.893 N/A SER 61.A OG ASP 54.A OD1 no hydrogen 2.632 N/A LEU 62.A N CYS 53.A O no hydrogen 2.794 N/A TYR 63.A N LEU 93.A O no hydrogen 2.901 N/A PHE 64.A N GLN 51.A O no hydrogen 2.858 N/A LEU 65.A N LEU 91.A O no hydrogen 2.899 N/A ALA 66.A N THR 48.A O no hydrogen 3.079 N/A TYR 67.A OH LEU 45.A O no hydrogen 2.752 N/A ASN 71.A N ASP 69.A OD1 no hydrogen 3.112 N/A ASP 72.A N ASP 69.A O no hydrogen 2.825 N/A ILE 73.A N LYS 70.A O no hydrogen 3.338 N/A LYS 80.A N GLU 76.A O no hydrogen 2.719 N/A LYS 80.A N LYS 77.A O no hydrogen 2.948 N/A ILE 81.A N LYS 77.A O no hydrogen 3.019 N/A ALA 82.A N ASP 78.A O no hydrogen 3.427 N/A TRP 83.A N GLU 79.A O no hydrogen 3.229 N/A ALA 84.A N LYS 80.A O no hydrogen 2.856 N/A LEU 85.A N ILE 81.A O no hydrogen 2.966 N/A SER 86.A N TRP 83.A O no hydrogen 3.148 N/A SER 86.A OG ALA 82.A O no hydrogen 2.768 N/A SER 86.A OG TRP 83.A O no hydrogen 2.957 N/A ARG 87.A N ALA 84.A O no hydrogen 3.449 N/A ARG 87.A NE TRP 83.A O no hydrogen 2.785 N/A ARG 87.A NH2 SER 86.A OG no hydrogen 2.926 N/A ALA 89.A N LEU 24.A O no hydrogen 3.279 N/A THR 90.A N GLN 25.A O no hydrogen 3.006 N/A THR 90.A OG1 GLN 25.A O no hydrogen 2.903 N/A LEU 91.A N LEU 65.A O no hydrogen 2.809 N/A GLU 92.A N THR 27.A O no hydrogen 2.832 N/A LEU 93.A N TYR 63.A O no hydrogen 2.819 N/A THR 94.A N LEU 29.A O no hydrogen 2.847 N/A HIS 95.A N SER 61.A O no hydrogen 2.797 N/A HIS 95.A NE2 GLU 100.A OE1 no hydrogen 3.040 N/A ASN 96.A ND2 TYR 107.A OH no hydrogen 3.188 N/A TRP 97.A N LYS 59.A O no hydrogen 3.001 N/A TRP 97.A NE1 SER 61.A OG no hydrogen 2.852 N/A THR 99.A N ASN 96.A O no hydrogen 3.361 N/A THR 99.A OG1 LYS 32.A O no hydrogen 2.664 N/A THR 99.A OG1 ASN 96.A O no hydrogen 3.084 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.731 N/A ASP 101.A N GLY 98.A O no hydrogen 3.086 N/A ASP 102.A N GLY 98.A O no hydrogen 3.339 N/A THR 104.A N ASP 102.A OD1 no hydrogen 2.988 N/A THR 104.A OG1 ASP 102.A OD1 no hydrogen 2.660 N/A THR 104.A OG1 ASP 102.A OD2 no hydrogen 3.533 N/A GLN 105.A N ASP 102.A O no hydrogen 3.099 N/A HIS 108.A NE2 SER 112.A OG no hydrogen 2.900 N/A ASN 109.A ND2 GLY 161.A O no hydrogen 2.774 N/A ASN 111.A N ASN 109.A OD1 no hydrogen 2.949 N/A ASN 111.A ND2 GLY 118.A O no hydrogen 2.872 N/A SER 112.A OG HIS 108.A NE2 no hydrogen 2.900 N/A GLY 116.A N GLY 110.A O no hydrogen 3.301 N/A ILE 120.A N TRP 163.A O no hydrogen 3.397 N/A ILE 122.A N GLU 165.A O no hydrogen 2.791 N/A VAL 124.A N LEU 167.A O no hydrogen 2.873 N/A TYR 128.A OH ASP 146.A OD1 no hydrogen 2.605 N/A SER 129.A N ASP 126.A OD1 no hydrogen 3.284 N/A SER 129.A OG ASP 126.A O no hydrogen 3.329 N/A ALA 130.A N ASP 126.A O no hydrogen 2.940 N/A CYS 131.A N VAL 127.A O no hydrogen 2.862 N/A CYS 131.A SG VAL 127.A O no hydrogen 3.199 N/A LYS 132.A N TYR 128.A O no hydrogen 2.954 N/A ARG 133.A N SER 129.A O no hydrogen 3.217 N/A ARG 133.A NH1 VAL 44.A O no hydrogen 2.816 N/A ARG 133.A NH2 ARG 43.A O no hydrogen 2.857 N/A ARG 133.A NH2 VAL 44.A O no hydrogen 3.535 N/A PHE 134.A N ALA 130.A O no hydrogen 3.072 N/A GLU 135.A N CYS 131.A O no hydrogen 2.953 N/A GLU 136.A N LYS 132.A O no hydrogen 3.119 N/A LEU 137.A N ARG 133.A O no hydrogen 2.948 N/A GLY 138.A N GLU 135.A O no hydrogen 2.927 N/A VAL 139.A N PHE 134.A O no hydrogen 2.945 N/A VAL 142.A N PHE 155.A O no hydrogen 2.774 N/A LYS 143.A N PHE 155.A O no hydrogen 3.097 N/A LYS 143.A NZ LYS 144.A O no hydrogen 3.286 N/A LYS 143.A NZ ASP 147.A O no hydrogen 2.796 N/A LYS 143.A NZ MET 150.A O no hydrogen 2.576 N/A LYS 143.A NZ LEU 153.A O no hydrogen 2.733 N/A LYS 144.A N ASP 147.A OD2 no hydrogen 3.162 N/A ASP 147.A N LYS 144.A O no hydrogen 2.941 N/A LYS 151.A NZ ASP 146.A O no hydrogen 2.852 N/A LYS 151.A NZ GLY 148.A O no hydrogen 2.687 N/A GLY 152.A N PRO 145.A O no hydrogen 2.654 N/A ALA 154.A N ILE 166.A O no hydrogen 3.019 N/A PHE 155.A N LYS 143.A O no hydrogen 3.004 N/A ILE 156.A N ILE 164.A O no hydrogen 2.887 N/A GLN 157.A N LYS 140.A O no hydrogen 2.988 N/A GLN 157.A NE2 GLY 161.A O no hydrogen 3.215 N/A ASP 158.A N TYR 162.A O no hydrogen 2.998 N/A ASP 160.A N ASP 158.A OD1 no hydrogen 2.840 N/A GLY 161.A N ASP 158.A O no hydrogen 2.892 N/A TYR 162.A N ASP 158.A OD1 no hydrogen 2.862 N/A TYR 162.A OH ARG 30.A O no hydrogen 2.695 N/A ILE 164.A N ILE 156.A O no hydrogen 2.833 N/A GLU 165.A N ILE 120.A O no hydrogen 2.927 N/A ILE 166.A N ALA 154.A O no hydrogen 2.757 N/A LEU 167.A N ILE 122.A O no hydrogen 3.181 N/A ASN 170.A N ASN 168.A OD1 no hydrogen 2.883 N/A LYS 171.A N ASN 168.A O no hydrogen 2.978 N/A LEU 175.A N MET 172.A O no hydrogen 3.045 N/A MET 176.A N MET 172.A O no hydrogen 3.048 N/A