Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7bju_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N GLN 9.A OE1 no hydrogen 2.746 N/A GLN 9.A N THR 6.A OG1 no hydrogen 3.270 N/A LYS 10.A N THR 6.A O no hydrogen 2.908 N/A SER 11.A N ALA 7.A O no hydrogen 3.049 N/A SER 11.A OG ALA 7.A O no hydrogen 2.462 N/A LEU 12.A N ASN 8.A O no hydrogen 3.007 N/A ILE 13.A N GLN 9.A O no hydrogen 3.027 N/A ALA 14.A N LYS 10.A O no hydrogen 3.069 N/A ARG 15.A N SER 11.A O no hydrogen 2.897 N/A ARG 15.A NH2 GLY 59.A O no hydrogen 3.095 N/A LEU 16.A N LEU 12.A O no hydrogen 2.978 N/A VAL 17.A N ILE 13.A O no hydrogen 2.982 N/A TYR 18.A N ALA 14.A O no hydrogen 3.033 N/A TYR 19.A N ARG 15.A O no hydrogen 3.153 N/A GLN 20.A N LEU 16.A O no hydrogen 2.895 N/A GLN 20.A NE2 ASN 137.A O no hydrogen 3.225 N/A GLU 21.A N VAL 17.A O no hydrogen 3.298 N/A GLY 22.A N TYR 18.A O no hydrogen 3.420 N/A TYR 23.A N TYR 19.A O no hydrogen 2.947 N/A GLU 29.A N SER 27.A OG no hydrogen 3.145 N/A ASP 30.A N SER 27.A O no hydrogen 2.895 N/A ARG 33.A N GLU 29.A O no hydrogen 3.088 N/A VAL 34.A N ASP 30.A O no hydrogen 2.613 N/A ARG 40.A N ASP 36.A O no hydrogen 2.947 N/A GLN 41.A N MET 37.A O no hydrogen 2.863 N/A ILE 42.A N PRO 38.A O no hydrogen 3.355 N/A THR 43.A N PHE 39.A O no hydrogen 3.204 N/A THR 43.A OG1 PHE 39.A O no hydrogen 3.068 N/A THR 43.A OG1 ARG 40.A O no hydrogen 3.058 N/A GLU 44.A N ARG 40.A O no hydrogen 2.975 N/A MET 45.A N GLN 41.A O no hydrogen 2.965 N/A THR 46.A N ILE 42.A O no hydrogen 2.905 N/A THR 46.A OG1 ILE 42.A O no hydrogen 2.840 N/A THR 46.A OG1 TYR 106.A OH no hydrogen 2.872 N/A ILE 47.A N THR 43.A O no hydrogen 3.111 N/A LEU 48.A N GLU 44.A O no hydrogen 3.247 N/A THR 49.A N MET 45.A O no hydrogen 3.010 N/A THR 49.A OG1 MET 45.A O no hydrogen 2.750 N/A THR 49.A OG1 THR 46.A O no hydrogen 2.882 N/A VAL 50.A N THR 46.A O no hydrogen 2.693 N/A GLN 51.A N ILE 47.A O no hydrogen 3.028 N/A LEU 52.A N LEU 48.A O no hydrogen 3.211 N/A ILE 53.A N THR 49.A O no hydrogen 3.071 N/A VAL 54.A N VAL 50.A O no hydrogen 2.926 N/A GLU 55.A N GLN 51.A O no hydrogen 3.110 N/A PHE 56.A N LEU 52.A O no hydrogen 2.921 N/A ALA 57.A N ILE 53.A O no hydrogen 2.815 N/A LYS 58.A N VAL 54.A O no hydrogen 2.774 N/A GLY 59.A N GLU 55.A O no hydrogen 3.214 N/A LEU 60.A N ALA 57.A O no hydrogen 2.897 N/A PHE 63.A N LEU 60.A O no hydrogen 3.111 N/A LYS 65.A N GLY 62.A O no hydrogen 3.055 N/A SER 67.A OG SER 69.A OG no hydrogen 3.365 N/A SER 67.A OG GLU 156.A OE1 no hydrogen 3.226 N/A SER 69.A OG SER 67.A OG no hydrogen 3.365 N/A SER 69.A OG GLU 156.A OE2 no hydrogen 2.737 N/A GLN 71.A N SER 67.A O no hydrogen 2.900 N/A GLN 71.A NE2 PHE 63.A O no hydrogen 2.801 N/A GLN 71.A NE2 ILE 66.A O no hydrogen 3.552 N/A ILE 72.A N GLN 68.A O no hydrogen 2.943 N/A THR 73.A N SER 69.A O no hydrogen 2.971 N/A THR 73.A OG1 SER 69.A O no hydrogen 2.716 N/A LEU 74.A N ASP 70.A O no hydrogen 3.047 N/A LEU 75.A N GLN 71.A O no hydrogen 2.936 N/A LYS 76.A N ILE 72.A O no hydrogen 2.944 N/A LYS 76.A NZ GLU 227.A O no hydrogen 2.960 N/A ALA 77.A N THR 73.A O no hydrogen 3.229 N/A ALA 77.A N LEU 74.A O no hydrogen 3.204 N/A CYS 78.A N LEU 74.A O no hydrogen 2.847 N/A CYS 78.A SG LEU 74.A O no hydrogen 3.284 N/A CYS 78.A SG LEU 75.A O no hydrogen 4.010 N/A SER 79.A N LEU 75.A O no hydrogen 3.246 N/A SER 79.A OG LEU 75.A O no hydrogen 3.353 N/A SER 79.A OG LYS 76.A O no hydrogen 3.195 N/A VAL 82.A N CYS 78.A O no hydrogen 2.809 N/A MET 83.A N SER 79.A O no hydrogen 3.055 N/A MET 84.A N SER 80.A O no hydrogen 3.121 N/A LEU 85.A N GLU 81.A O no hydrogen 3.306 N/A ARG 86.A N VAL 82.A O no hydrogen 2.949 N/A ARG 86.A NH1 TYR 23.A O no hydrogen 3.088 N/A ARG 86.A NH2 TYR 23.A O no hydrogen 3.144 N/A ARG 86.A NH2 GLU 24.A O no hydrogen 3.135 N/A VAL 87.A N MET 83.A O no hydrogen 3.113 N/A ALA 88.A N MET 84.A O no hydrogen 2.886 N/A ARG 89.A N LEU 85.A O no hydrogen 2.837 N/A ARG 89.A NH1 MET 135.A O no hydrogen 2.805 N/A ARG 89.A NH2 MET 135.A O no hydrogen 2.660 N/A ARG 90.A N VAL 87.A O no hydrogen 3.129 N/A TYR 91.A N ALA 88.A O no hydrogen 3.161 N/A TYR 91.A OH ASP 96.A OD1 no hydrogen 2.762 N/A ASP 92.A N SER 97.A O no hydrogen 2.798 N/A THR 95.A N ASP 92.A OD2 no hydrogen 3.361 N/A THR 95.A OG1 ASP 92.A OD2 no hydrogen 2.862 N/A THR 95.A OG1 SER 97.A OG no hydrogen 2.965 N/A ASP 96.A N ALA 93.A O no hydrogen 3.254 N/A SER 97.A N ASP 92.A O no hydrogen 3.309 N/A SER 97.A OG THR 95.A OG1 no hydrogen 2.965 N/A LEU 99.A N ARG 90.A O no hydrogen 2.872 N/A ASN 102.A N PHE 100.A O no hydrogen 2.399 N/A ASN 103.A ND2 VAL 98.A O no hydrogen 2.606 N/A TYR 106.A OH THR 46.A OG1 no hydrogen 2.872 N/A THR 107.A OG1 GLN 104.A O no hydrogen 2.807 N/A ARG 108.A NH1 ASP 96.A O no hydrogen 3.349 N/A ARG 108.A NH2 ASP 96.A O no hydrogen 2.795 N/A ASN 110.A ND2 ALA 105.A O no hydrogen 3.608 N/A TYR 111.A N THR 107.A O no hydrogen 3.476 N/A ARG 112.A N ARG 108.A O no hydrogen 2.805 N/A LYS 113.A N ASP 109.A O no hydrogen 2.770 N/A ALA 114.A N ASN 110.A O no hydrogen 2.994 N/A GLY 115.A N ARG 112.A O no hydrogen 3.323 N/A MET 116.A N TYR 111.A O no hydrogen 2.972 N/A ILE 120.A N ALA 117.A O no hydrogen 3.219 N/A LEU 123.A N VAL 119.A O no hydrogen 3.092 N/A LEU 124.A N ILE 120.A O no hydrogen 2.824 N/A HIS 125.A N GLU 121.A O no hydrogen 2.952 N/A PHE 126.A N ASP 122.A O no hydrogen 3.405 N/A CYS 127.A N LEU 123.A O no hydrogen 2.905 N/A CYS 127.A SG LEU 123.A O no hydrogen 3.357 N/A ARG 128.A N LEU 124.A O no hydrogen 2.779 N/A ARG 128.A NE ASP 96.A OD1 no hydrogen 2.977 N/A ARG 128.A NE ASP 96.A OD2 no hydrogen 3.409 N/A ARG 128.A NH2 ASP 96.A OD2 no hydrogen 2.854 N/A CYS 129.A N HIS 125.A O no hydrogen 2.879 N/A CYS 129.A SG HIS 125.A O no hydrogen 3.355 N/A MET 130.A N PHE 126.A O no hydrogen 2.805 N/A TYR 131.A N CYS 127.A O no hydrogen 2.876 N/A SER 132.A N ARG 128.A O no hydrogen 3.144 N/A SER 132.A OG ARG 128.A O no hydrogen 3.491 N/A SER 132.A OG CYS 129.A O no hydrogen 2.763 N/A MET 133.A N MET 130.A O no hydrogen 3.092 N/A MET 134.A N TYR 131.A O no hydrogen 3.264 N/A ASP 136.A N HIS 139.A ND1 no hydrogen 3.261 N/A HIS 139.A N ASP 136.A OD1 no hydrogen 2.716 N/A TYR 140.A N ASP 136.A O no hydrogen 2.983 N/A ALA 141.A N ASN 137.A O no hydrogen 3.028 N/A LEU 142.A N VAL 138.A O no hydrogen 2.964 N/A LEU 143.A N HIS 139.A O no hydrogen 2.984 N/A THR 144.A N TYR 140.A O no hydrogen 3.089 N/A THR 144.A OG1 TYR 140.A O no hydrogen 2.981 N/A ALA 145.A N ALA 141.A O no hydrogen 3.127 N/A ILE 146.A N LEU 142.A O no hydrogen 2.925 N/A VAL 147.A N LEU 143.A O no hydrogen 2.821 N/A ILE 148.A N THR 144.A O no hydrogen 3.117 N/A PHE 149.A N ALA 145.A O no hydrogen 3.078 N/A SER 150.A N VAL 147.A O no hydrogen 3.231 N/A SER 150.A OG ILE 146.A O no hydrogen 2.773 N/A SER 150.A OG VAL 147.A O no hydrogen 3.007 N/A ARG 152.A NH1 GLU 81.A OE1 no hydrogen 3.415 N/A ARG 152.A NH1 GLU 81.A OE2 no hydrogen 2.703 N/A ARG 152.A NH2 GLU 81.A OE1 no hydrogen 2.800 N/A ARG 152.A NH2 VAL 147.A O no hydrogen 3.060 N/A GLU 156.A N ASP 70.A OD1 no hydrogen 2.749 N/A GLN 157.A N ASP 70.A OD2 no hydrogen 3.117 N/A VAL 161.A N GLN 157.A O no hydrogen 3.317 N/A GLU 162.A N PRO 158.A O no hydrogen 3.026 N/A GLU 163.A N SER 159.A O no hydrogen 3.070 N/A ILE 164.A N LEU 160.A O no hydrogen 3.076 N/A GLN 165.A N VAL 161.A O no hydrogen 2.956 N/A GLN 165.A NE2 ILE 146.A O no hydrogen 3.081 N/A ARG 166.A N GLU 162.A O no hydrogen 2.903 N/A TYR 167.A N ILE 164.A O no hydrogen 3.133 N/A TYR 168.A OH PRO 61.A O no hydrogen 2.525 N/A LEU 169.A N GLN 165.A O no hydrogen 2.829 N/A ASN 170.A N ARG 166.A O no hydrogen 2.828 N/A THR 171.A N TYR 167.A O no hydrogen 3.166 N/A THR 171.A OG1 TYR 167.A O no hydrogen 2.638 N/A LEU 172.A N TYR 168.A O no hydrogen 2.884 N/A ARG 173.A N LEU 169.A O no hydrogen 2.900 N/A ARG 173.A NE ASN 170.A OD1 no hydrogen 3.538 N/A ARG 173.A NH2 ASN 170.A OD1 no hydrogen 3.272 N/A VAL 174.A N ASN 170.A O no hydrogen 3.015 N/A TYR 175.A N THR 171.A O no hydrogen 2.983 N/A TYR 175.A OH ASP 136.A OD2 no hydrogen 2.681 N/A ILE 176.A N LEU 172.A O no hydrogen 3.047 N/A LEU 177.A N ARG 173.A O no hydrogen 2.949 N/A ASN 178.A N VAL 174.A O no hydrogen 2.891 N/A ASN 178.A ND2 PRO 3.A O no hydrogen 2.953 N/A GLN 179.A N TYR 175.A O no hydrogen 2.934 N/A ASN 180.A N LEU 177.A O no hydrogen 3.218 N/A ASN 180.A ND2 ILE 176.A O no hydrogen 2.772 N/A ALA 182.A N LEU 177.A O no hydrogen 2.879 N/A SER 183.A N ASN 180.A O no hydrogen 3.022 N/A ARG 185.A N SER 183.A OG no hydrogen 3.297 N/A SER 186.A N SER 183.A O no hydrogen 2.965 N/A SER 186.A OG SER 183.A O no hydrogen 2.742 N/A ALA 187.A N PRO 184.A O no hydrogen 3.301 N/A ILE 189.A N ARG 185.A O no hydrogen 3.068 N/A PHE 190.A N SER 186.A O no hydrogen 2.853 N/A GLY 191.A N ALA 187.A O no hydrogen 2.682 N/A LYS 192.A N VAL 188.A O no hydrogen 2.913 N/A ILE 193.A N ILE 189.A O no hydrogen 3.196 N/A LEU 194.A N PHE 190.A O no hydrogen 3.094 N/A GLY 195.A N GLY 191.A O no hydrogen 2.863 N/A ILE 196.A N ILE 193.A O no hydrogen 3.045 N/A LEU 197.A N LEU 194.A O no hydrogen 3.123 N/A THR 198.A N GLY 195.A O no hydrogen 3.145 N/A GLU 199.A N GLY 195.A O no hydrogen 3.411 N/A ILE 200.A N ILE 196.A O no hydrogen 2.990 N/A THR 202.A N GLU 199.A O no hydrogen 3.107 N/A LEU 203.A N GLU 199.A O no hydrogen 3.411 N/A GLY 204.A N ILE 200.A O no hydrogen 2.940 N/A MET 205.A N ARG 201.A O no hydrogen 3.076 N/A GLN 206.A N THR 202.A O no hydrogen 2.825 N/A GLN 206.A NE2 ASP 122.A OD2 no hydrogen 2.947 N/A ASN 207.A N LEU 203.A O no hydrogen 2.845 N/A SER 208.A N GLY 204.A O no hydrogen 2.940 N/A SER 208.A OG GLY 204.A O no hydrogen 3.179 N/A ASN 209.A N MET 205.A O no hydrogen 2.764 N/A MET 210.A N GLN 206.A O no hydrogen 3.060 N/A MET 210.A N ASN 207.A O no hydrogen 3.220 N/A CYS 211.A N ASN 207.A O no hydrogen 3.123 N/A CYS 211.A SG ASN 207.A O no hydrogen 3.456 N/A ILE 212.A N SER 208.A O no hydrogen 3.088 N/A SER 213.A N ASN 209.A O no hydrogen 3.082 N/A SER 213.A OG ASN 209.A O no hydrogen 2.887 N/A LEU 214.A N MET 210.A O no hydrogen 2.812 N/A LYS 215.A N CYS 211.A O no hydrogen 3.290 N/A LEU 216.A N ILE 212.A O no hydrogen 3.159 N/A LYS 217.A N SER 213.A O no hydrogen 3.015 N/A ASN 218.A N LYS 215.A O no hydrogen 3.011 N/A ARG 219.A NH1 ALA 114.A O no hydrogen 3.264 N/A ARG 219.A NH2 ALA 114.A O no hydrogen 3.204 N/A GLU 226.A N PRO 222.A O no hydrogen 3.079 N/A GLU 227.A N PRO 223.A O no hydrogen 3.078 N/A ILE 228.A N PHE 224.A O no hydrogen 3.233 N/A TRP 229.A N LEU 225.A O no hydrogen 2.916 N/A TRP 229.A NE1 SER 79.A OG no hydrogen 3.073 N/A VAL 231.A N GLU 226.A O no hydrogen 3.251 N/A