Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aqq_z.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N GLY 1.A O no hydrogen 3.152 N/A ALA 6.A N THR 2.A O no hydrogen 3.313 N/A PHE 7.A N LEU 3.A O no hydrogen 3.396 N/A TYR 8.A N GLY 4.A O no hydrogen 2.911 N/A SER 9.A N ARG 5.A O no hydrogen 2.911 N/A VAL 10.A N ALA 6.A O no hydrogen 2.936 N/A GLY 11.A N PHE 7.A O no hydrogen 2.862 N/A PHE 12.A N TYR 8.A O no hydrogen 2.969 N/A TRP 13.A N SER 9.A O no hydrogen 2.959 N/A ILE 14.A N VAL 10.A O no hydrogen 2.950 N/A ARG 15.A N GLY 11.A O no hydrogen 2.883 N/A GLU 16.A N PHE 12.A O no hydrogen 2.866 N/A THR 17.A N TRP 13.A O no hydrogen 2.979 N/A THR 17.A OG1 TRP 13.A O no hydrogen 2.929 N/A GLY 18.A N ILE 14.A O no hydrogen 2.911 N/A GLN 19.A N ARG 15.A O no hydrogen 2.884 N/A ALA 20.A N GLU 16.A O no hydrogen 2.914 N/A LEU 21.A N THR 17.A O no hydrogen 2.939 N/A ASP 22.A N GLY 18.A O no hydrogen 2.916 N/A ARG 23.A N GLN 19.A O no hydrogen 2.902 N/A LEU 24.A N ALA 20.A O no hydrogen 2.914 N/A GLY 25.A N LEU 21.A O no hydrogen 2.900 N/A CYS 26.A N ASP 22.A O no hydrogen 2.908 N/A CYS 26.A SG ASP 22.A O no hydrogen 3.493 N/A CYS 26.A SG ASP 22.A OD2 no hydrogen 3.453 N/A CYS 26.A SG TYR 33.A OH no hydrogen 2.922 N/A ARG 27.A N ARG 23.A O no hydrogen 2.911 N/A LEU 28.A N LEU 24.A O no hydrogen 3.051 N/A GLN 29.A N GLY 25.A O no hydrogen 3.442 N/A GLY 30.A N ARG 27.A O no hydrogen 3.158 N/A LYS 31.A N CYS 26.A O no hydrogen 3.044 N/A LYS 31.A NZ GLN 29.A OE1 no hydrogen 3.507 N/A ARG 35.A N ASN 32.A O no hydrogen 3.197 N/A GLU 36.A N TYR 33.A O no hydrogen 3.344 N/A LEU 38.A N GLU 36.A O no hydrogen 3.062 N/A THR 43.A OG1 ALA 61.A O no hydrogen 3.502 N/A THR 43.A OG1 ALA 64.A O no hydrogen 3.190 N/A MET 45.A N VAL 66.A O no hydrogen 2.840 N/A ASN 46.A ND2 TYR 8.A OH no hydrogen 3.125 N/A ASN 46.A ND2 PHE 48.A O no hydrogen 2.692 N/A VAL 47.A N LYS 50.A O no hydrogen 2.785 N/A LYS 50.A N VAL 47.A O no hydrogen 3.132 N/A LYS 50.A NZ ASP 87.A O no hydrogen 2.316 N/A ILE 53.A N VAL 70.A O no hydrogen 2.677 N/A ASP 55.A N ILE 72.A O no hydrogen 3.286 N/A LYS 56.A NZ VAL 54.A O no hydrogen 3.436 N/A GLU 57.A N ASP 55.A OD2 no hydrogen 3.060 N/A PHE 59.A N SER 76.A O no hydrogen 3.303 N/A ALA 61.A N ILE 78.A O no hydrogen 2.882 N/A ALA 64.A N ALA 61.A O no hydrogen 2.971 N/A SER 65.A N CYS 82.A O no hydrogen 2.813 N/A VAL 66.A N THR 43.A O no hydrogen 2.961 N/A ILE 67.A N LEU 84.A O no hydrogen 2.952 N/A GLY 68.A N MET 45.A O no hydrogen 3.141 N/A HIS 71.A N VAL 91.A O no hydrogen 2.993 N/A ILE 72.A N ILE 53.A O no hydrogen 2.949 N/A GLY 73.A N VAL 93.A O no hydrogen 3.102 N/A GLY 73.A N GLY 94.A O no hydrogen 3.258 N/A GLY 75.A N GLU 57.A O no hydrogen 2.964 N/A SER 76.A N GLY 73.A O no hydrogen 3.436 N/A SER 76.A OG THR 97.A O no hydrogen 3.332 N/A SER 76.A OG THR 97.A OG1 no hydrogen 2.837 N/A SER 77.A N THR 97.A O no hydrogen 3.112 N/A ILE 78.A N PHE 59.A O no hydrogen 2.743 N/A TRP 79.A N ILE 99.A O no hydrogen 2.897 N/A TYR 80.A OH HIS 213.A ND1 no hydrogen 3.307 N/A GLY 81.A N SER 63.A OG no hydrogen 3.082 N/A CYS 82.A N TRP 79.A O no hydrogen 3.496 N/A CYS 82.A SG TRP 79.A O no hydrogen 3.169 N/A CYS 82.A SG ILE 99.A O no hydrogen 3.291 N/A CYS 82.A SG GLN 100.A O no hydrogen 3.017 N/A VAL 83.A N SER 103.A O no hydrogen 3.087 N/A LEU 84.A N SER 65.A O no hydrogen 2.796 N/A ARG 85.A NH1 ASP 87.A OD2 no hydrogen 3.107 N/A ARG 85.A NH2 HIS 106.A ND1 no hydrogen 3.114 N/A ARG 85.A NH2 VAL 107.A O no hydrogen 2.399 N/A GLY 86.A N ILE 67.A O no hydrogen 3.063 N/A VAL 88.A N ASP 87.A OD1 no hydrogen 2.791 N/A ASN 89.A ND2 VAL 116.A O no hydrogen 2.546 N/A THR 90.A N ASN 89.A OD1 no hydrogen 2.775 N/A THR 90.A OG1 ASP 69.A O no hydrogen 3.224 N/A THR 90.A OG1 ASP 69.A OD2 no hydrogen 2.949 N/A VAL 91.A N ASP 69.A O no hydrogen 2.959 N/A SER 92.A N THR 119.A O no hydrogen 2.814 N/A VAL 93.A N HIS 71.A O no hydrogen 2.788 N/A SER 95.A N ASP 123.A OD1 no hydrogen 2.373 N/A SER 95.A OG ARG 74.A O no hydrogen 2.523 N/A THR 97.A OG1 SER 76.A OG no hydrogen 2.837 N/A ASN 98.A N VAL 125.A O no hydrogen 3.297 N/A ILE 99.A N SER 77.A O no hydrogen 2.901 N/A ASN 102.A N TYR 80.A O no hydrogen 2.819 N/A SER 103.A OG ALA 131.A O no hydrogen 2.887 N/A LEU 104.A N ALA 131.A O no hydrogen 2.952 N/A VAL 105.A N VAL 83.A O no hydrogen 3.157 N/A HIS 106.A N LEU 133.A O no hydrogen 3.009 N/A VAL 107.A N ARG 85.A O no hydrogen 3.309 N/A LEU 112.A N SER 110.A OG no hydrogen 3.099 N/A GLY 114.A N ASN 111.A O no hydrogen 2.938 N/A THR 119.A N THR 90.A O no hydrogen 3.140 N/A ILE 120.A N CYS 136.A O no hydrogen 3.401 N/A ILE 121.A N SER 92.A O no hydrogen 2.689 N/A ASN 124.A N SER 95.A O no hydrogen 3.281 N/A THR 126.A N THR 142.A O no hydrogen 3.146 N/A SER 130.A N ASP 101.A O no hydrogen 3.332 N/A SER 130.A OG ASN 102.A O no hydrogen 3.495 N/A VAL 132.A N ALA 148.A O no hydrogen 2.793 N/A LEU 133.A N LEU 104.A O no hydrogen 2.797 N/A HIS 134.A N LEU 150.A O no hydrogen 3.095 N/A GLY 135.A N HIS 106.A O no hydrogen 3.148 N/A THR 137.A N VAL 154.A O no hydrogen 2.913 N/A VAL 138.A N ILE 120.A O no hydrogen 3.042 N/A GLU 139.A N VAL 156.A O no hydrogen 2.758 N/A GLU 141.A N ASP 123.A O no hydrogen 2.641 N/A THR 142.A OG1 GLY 160.A O no hydrogen 2.133 N/A PHE 143.A N GLY 160.A O no hydrogen 3.082 N/A ILE 144.A N THR 126.A O no hydrogen 2.730 N/A GLY 147.A N HIS 129.A O no hydrogen 2.891 N/A ALA 148.A N GLY 145.A O no hydrogen 3.419 N/A THR 149.A N ALA 166.A O no hydrogen 3.060 N/A THR 149.A OG1 GLY 147.A O no hydrogen 3.412 N/A VAL 155.A N THR 172.A O no hydrogen 3.139 N/A VAL 156.A N THR 137.A O no hydrogen 3.144 N/A GLU 157.A N ILE 174.A O no hydrogen 3.193 N/A VAL 162.A N PHE 143.A O no hydrogen 2.941 N/A ALA 163.A N TRP 180.A O no hydrogen 2.849 N/A GLY 165.A N MET 146.A O no hydrogen 2.653 N/A ALA 166.A N ALA 163.A O no hydrogen 3.432 N/A LEU 167.A N GLY 182.A O no hydrogen 3.384 N/A GLN 170.A NE2 ASP 152.A OD1 no hydrogen 3.157 N/A ASN 171.A N ASP 152.A O no hydrogen 3.308 N/A THR 172.A OG1 ARG 169.A O no hydrogen 2.752 N/A THR 172.A OG1 GLN 170.A O no hydrogen 3.448 N/A ARG 173.A NH1 GLU 157.A OE2 no hydrogen 3.256 N/A ARG 173.A NH2 GLU 157.A OE2 no hydrogen 3.519 N/A ILE 174.A N VAL 155.A O no hydrogen 3.050 N/A SER 176.A OG GLU 157.A OE1 no hydrogen 2.679 N/A SER 176.A OG LYS 158.A O no hydrogen 3.223 N/A GLY 177.A N HIS 159.A O no hydrogen 2.942 N/A GLU 178.A N PRO 175.A O no hydrogen 3.375 N/A VAL 179.A N ARG 189.A O no hydrogen 2.788 N/A TRP 180.A N MET 161.A O no hydrogen 3.267 N/A TRP 180.A NE1 GLU 178.A OE1 no hydrogen 3.374 N/A GLY 181.A N ARG 186.A O no hydrogen 3.119 N/A ALA 185.A N LEU 167.A O no hydrogen 3.098 N/A ARG 186.A N GLY 181.A O no hydrogen 3.050 N/A LEU 188.A N VAL 179.A O no hydrogen 2.924 N/A LEU 191.A N GLY 177.A O no hydrogen 2.637 N/A THR 192.A OG1 ASP 193.A OD1 no hydrogen 2.867 N/A ILE 196.A N THR 192.A O no hydrogen 3.112 N/A ALA 197.A N ASP 193.A O no hydrogen 2.916 N/A PHE 198.A N GLU 194.A O no hydrogen 2.909 N/A ILE 199.A N GLU 195.A O no hydrogen 2.878 N/A SER 200.A N ILE 196.A O no hydrogen 2.931 N/A SER 200.A OG ALA 197.A O no hydrogen 2.518 N/A GLN 201.A N ALA 197.A O no hydrogen 2.923 N/A SER 202.A N PHE 198.A O no hydrogen 2.899 N/A THR 204.A OG1 GLN 201.A O no hydrogen 2.656 N/A ASN 205.A N GLN 201.A O no hydrogen 2.939 N/A TYR 206.A N SER 202.A O no hydrogen 2.931 N/A SER 207.A N ALA 203.A O no hydrogen 2.877 N/A ASN 208.A N THR 204.A O no hydrogen 2.922 N/A LEU 209.A N ASN 205.A O no hydrogen 2.937 N/A ALA 210.A N TYR 206.A O no hydrogen 2.873 N/A HIS 213.A N LEU 209.A O no hydrogen 2.997 N/A ALA 214.A N ALA 210.A O no hydrogen 2.844 N/A ALA 215.A N GLN 211.A O no hydrogen 2.900 N/A GLU 216.A N ALA 212.A O no hydrogen 2.936 N/A ASN 217.A N HIS 213.A O no hydrogen 2.904 N/A ASN 217.A N ALA 214.A O no hydrogen 3.168 N/A ASN 217.A ND2 TYR 80.A OH no hydrogen 3.217 N/A ASN 217.A ND2 HIS 213.A O no hydrogen 2.727 N/A GLU 225.A N ASN 222.A OD1 no hydrogen 2.761 N/A GLU 227.A N VAL 223.A O no hydrogen 2.909 N/A LYS 228.A N ILE 224.A O no hydrogen 2.896 N/A LYS 228.A NZ GLU 225.A OE2 no hydrogen 2.816 N/A VAL 229.A N GLU 225.A O no hydrogen 2.934 N/A LEU 230.A N PHE 226.A O no hydrogen 3.095 N/A ARG 231.A N GLU 227.A O no hydrogen 3.232 N/A ARG 231.A NH2 GLU 227.A OE1 no hydrogen 3.348 N/A