Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7wt1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N THR 4.A OG1 no hydrogen 3.190 N/A ALA 8.A N THR 4.A O no hydrogen 3.058 N/A LEU 9.A N ASP 5.A O no hydrogen 2.829 N/A SER 10.A N GLU 6.A O no hydrogen 2.821 N/A SER 10.A OG GLU 6.A O no hydrogen 2.706 N/A CYS 11.A N ALA 8.A O no hydrogen 3.042 N/A CYS 11.A SG ALA 7.A O no hydrogen 3.418 N/A CYS 12.A N LEU 9.A O no hydrogen 2.872 N/A CYS 12.A SG ALA 8.A O no hydrogen 3.399 N/A SER 18.A N ASP 16.A OD1 no hydrogen 2.715 N/A SER 18.A OG ASP 16.A OD1 no hydrogen 2.381 N/A THR 19.A N ASP 16.A O no hydrogen 2.922 N/A THR 19.A OG1 ASP 16.A O no hydrogen 2.717 N/A LYS 20.A N PRO 17.A O no hydrogen 3.155 N/A PHE 22.A N THR 19.A O no hydrogen 3.091 N/A GLN 25.A NE2 ARG 87.A O no hydrogen 3.162 N/A GLN 26.A NE2 GLN 25.A OE1 no hydrogen 2.818 N/A THR 27.A N THR 90.A O no hydrogen 3.094 N/A LEU 29.A N GLU 92.A O no hydrogen 2.929 N/A VAL 31.A N THR 94.A O no hydrogen 2.838 N/A LYS 32.A N ASP 160.A OD1 no hydrogen 2.750 N/A LYS 32.A NZ THR 99.A O no hydrogen 2.671 N/A LYS 32.A NZ ASP 102.A O no hydrogen 2.599 N/A LYS 32.A NZ GLN 105.A O no hydrogen 2.929 N/A LYS 32.A NZ GLN 105.A OE1 no hydrogen 3.236 N/A LYS 35.A N ASP 33.A OD1 no hydrogen 3.041 N/A LYS 35.A NZ ASP 33.A OD1 no hydrogen 3.377 N/A SER 37.A N ASP 33.A O no hydrogen 3.215 N/A SER 37.A OG ASP 33.A O no hydrogen 3.347 N/A LEU 38.A N PRO 34.A O no hydrogen 2.875 N/A ASP 39.A N LYS 35.A O no hydrogen 3.152 N/A PHE 40.A N LYS 36.A O no hydrogen 2.946 N/A TYR 41.A N SER 37.A O no hydrogen 2.885 N/A TYR 41.A OH ASP 158.A OD2 no hydrogen 2.612 N/A THR 42.A N LEU 38.A O no hydrogen 3.044 N/A THR 42.A OG1 LEU 38.A O no hydrogen 2.635 N/A THR 42.A OG1 ASP 39.A O no hydrogen 3.534 N/A ARG 43.A N ASP 39.A O no hydrogen 2.823 N/A ARG 43.A NE ASP 39.A OD1 no hydrogen 2.835 N/A ARG 43.A NH2 ASP 39.A OD2 no hydrogen 2.881 N/A VAL 44.A N PHE 40.A O no hydrogen 2.961 N/A LEU 45.A N PHE 40.A O no hydrogen 3.161 N/A GLY 46.A N THR 42.A O no hydrogen 2.987 N/A MET 47.A N TYR 41.A O no hydrogen 2.880 N/A THR 48.A N ALA 66.A O no hydrogen 2.773 N/A THR 48.A OG1 GLU 68.A O no hydrogen 2.944 N/A ILE 50.A N PHE 64.A O no hydrogen 2.755 N/A GLN 51.A NE2 LYS 52.A O no hydrogen 2.948 N/A LYS 52.A NZ ASP 54.A OD1 no hydrogen 3.232 N/A LYS 52.A NZ ASP 54.A OD2 no hydrogen 2.646 N/A CYS 53.A N LEU 62.A O no hydrogen 2.906 N/A PHE 55.A N PHE 60.A O no hydrogen 2.844 N/A MET 58.A N PHE 55.A O no hydrogen 3.181 N/A LYS 59.A N PRO 56.A O no hydrogen 3.231 N/A PHE 60.A N PHE 55.A O no hydrogen 3.272 N/A SER 61.A N HIS 95.A O no hydrogen 2.918 N/A SER 61.A OG ASP 54.A OD1 no hydrogen 2.478 N/A LEU 62.A N CYS 53.A O no hydrogen 2.713 N/A TYR 63.A N LEU 93.A O no hydrogen 2.905 N/A PHE 64.A N GLN 51.A O no hydrogen 2.762 N/A LEU 65.A N LEU 91.A O no hydrogen 2.846 N/A ALA 66.A N THR 48.A O no hydrogen 2.971 N/A TYR 67.A OH LEU 45.A O no hydrogen 2.641 N/A ASN 71.A N ASP 69.A OD1 no hydrogen 2.973 N/A ASP 72.A N ASP 69.A O no hydrogen 3.082 N/A ILE 73.A N LYS 70.A O no hydrogen 3.419 N/A LYS 80.A N GLU 76.A O no hydrogen 2.775 N/A LYS 80.A NZ ILE 50.A O no hydrogen 2.945 N/A LYS 80.A NZ GLN 51.A OE1 no hydrogen 3.172 N/A ILE 81.A N LYS 77.A O no hydrogen 3.108 N/A ALA 82.A N ASP 78.A O no hydrogen 3.269 N/A TRP 83.A N GLU 79.A O no hydrogen 2.871 N/A ALA 84.A N LYS 80.A O no hydrogen 2.806 N/A LEU 85.A N ILE 81.A O no hydrogen 2.907 N/A SER 86.A N TRP 83.A O no hydrogen 3.254 N/A SER 86.A OG ALA 82.A O no hydrogen 2.734 N/A SER 86.A OG TRP 83.A O no hydrogen 3.006 N/A ARG 87.A N ALA 84.A O no hydrogen 3.232 N/A ARG 87.A NE TRP 83.A O no hydrogen 2.790 N/A ARG 87.A NH2 SER 86.A OG no hydrogen 3.064 N/A ALA 89.A N LEU 24.A O no hydrogen 3.229 N/A THR 90.A N GLN 25.A O no hydrogen 2.909 N/A THR 90.A OG1 GLN 25.A O no hydrogen 2.761 N/A LEU 91.A N LEU 65.A O no hydrogen 2.792 N/A GLU 92.A N THR 27.A O no hydrogen 2.796 N/A LEU 93.A N TYR 63.A O no hydrogen 2.803 N/A THR 94.A N LEU 29.A O no hydrogen 2.879 N/A HIS 95.A N SER 61.A O no hydrogen 2.885 N/A HIS 95.A NE2 GLU 100.A OE1 no hydrogen 2.819 N/A ASN 96.A ND2 TYR 107.A OH no hydrogen 3.172 N/A TRP 97.A N LYS 59.A O no hydrogen 3.090 N/A TRP 97.A NE1 SER 61.A OG no hydrogen 2.928 N/A GLY 98.A N GLU 100.A OE1 no hydrogen 3.046 N/A THR 99.A N ASN 96.A O no hydrogen 3.322 N/A THR 99.A OG1 LYS 32.A O no hydrogen 2.590 N/A THR 99.A OG1 ASN 96.A O no hydrogen 3.186 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.650 N/A ASP 101.A N GLY 98.A O no hydrogen 2.978 N/A ASP 102.A N THR 99.A O no hydrogen 3.113 N/A GLU 103.A N GLU 103.A OE1 no hydrogen 2.858 N/A THR 104.A N ASP 102.A OD1 no hydrogen 3.084 N/A THR 104.A OG1 ASP 102.A OD1 no hydrogen 2.551 N/A GLN 105.A N ASP 102.A O no hydrogen 3.199 N/A HIS 108.A NE2 PRO 114.A O no hydrogen 2.933 N/A ASN 109.A ND2 GLY 161.A O no hydrogen 2.942 N/A ASN 111.A N ASN 109.A OD1 no hydrogen 2.862 N/A ASN 111.A ND2 GLY 118.A O no hydrogen 2.832 N/A GLY 116.A N GLY 110.A O no hydrogen 3.308 N/A ILE 120.A N TRP 163.A O no hydrogen 3.225 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 2.844 N/A TYR 128.A OH ASP 146.A OD1 no hydrogen 3.291 N/A SER 129.A N ASP 126.A OD1 no hydrogen 3.154 N/A SER 129.A OG ASP 126.A O no hydrogen 3.410 N/A ALA 130.A N ASP 126.A O no hydrogen 2.954 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 3.217 N/A LYS 132.A N TYR 128.A O no hydrogen 2.879 N/A ARG 133.A N SER 129.A O no hydrogen 3.081 N/A ARG 133.A NH1 VAL 44.A O no hydrogen 2.714 N/A ARG 133.A NH2 ARG 43.A O no hydrogen 2.848 N/A ARG 133.A NH2 VAL 44.A O no hydrogen 3.445 N/A PHE 134.A N ALA 130.A O no hydrogen 2.952 N/A GLU 135.A N CYS 131.A O no hydrogen 2.841 N/A GLU 136.A N LYS 132.A O no hydrogen 3.061 N/A LEU 137.A N ARG 133.A O no hydrogen 2.935 N/A LEU 137.A N PHE 134.A O no hydrogen 3.035 N/A GLY 138.A N GLU 135.A O no hydrogen 3.015 N/A VAL 139.A N PHE 134.A O no hydrogen 2.996 N/A VAL 142.A N PHE 155.A O no hydrogen 2.849 N/A LYS 143.A N PHE 155.A O no hydrogen 3.046 N/A LYS 143.A NZ LYS 144.A O no hydrogen 3.227 N/A LYS 143.A NZ ASP 147.A O no hydrogen 2.630 N/A LYS 143.A NZ MET 150.A O no hydrogen 2.738 N/A LYS 143.A NZ LEU 153.A O no hydrogen 2.781 N/A LYS 144.A NZ GLU 135.A OE2 no hydrogen 2.887 N/A ASP 147.A N LYS 144.A O no hydrogen 3.115 N/A LYS 151.A N LYS 149.A O no hydrogen 2.987 N/A LYS 151.A NZ ASP 146.A O no hydrogen 2.967 N/A LYS 151.A NZ GLY 148.A O no hydrogen 2.559 N/A GLY 152.A N PRO 145.A O no hydrogen 3.069 N/A ALA 154.A N ILE 166.A O no hydrogen 3.032 N/A PHE 155.A N LYS 143.A O no hydrogen 2.901 N/A ILE 156.A N ILE 164.A O no hydrogen 2.889 N/A GLN 157.A N LYS 140.A O no hydrogen 2.971 N/A ASP 158.A N TYR 162.A O no hydrogen 2.944 N/A ASP 160.A N ASP 158.A OD1 no hydrogen 2.890 N/A GLY 161.A N ASP 158.A O no hydrogen 2.854 N/A TYR 162.A N ASP 158.A OD1 no hydrogen 3.030 N/A TYR 162.A OH ARG 30.A O no hydrogen 2.642 N/A ILE 164.A N ILE 156.A O no hydrogen 2.827 N/A GLU 165.A N ILE 120.A O no hydrogen 2.833 N/A ILE 166.A N ALA 154.A O no hydrogen 2.818 N/A LEU 167.A N ILE 122.A O no hydrogen 3.079 N/A ASN 168.A ND2 VAL 124.A O no hydrogen 2.919 N/A LYS 171.A N ASN 168.A OD1 no hydrogen 3.052 N/A MET 172.A N ASN 168.A O no hydrogen 3.163 N/A THR 174.A OG1 LYS 171.A O no hydrogen 2.730 N/A LEU 175.A N LYS 171.A O no hydrogen 3.094 N/A MET 176.A N ALA 173.A O no hydrogen 2.953 N/A