Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jjr_l.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ILE 1.A O no hydrogen 3.174 N/A TYR 6.A OH TRP 32.A O no hydrogen 2.849 N/A GLN 8.A N ALA 5.A O no hydrogen 3.065 N/A GLN 8.A NE2 ILE 1.A O no hydrogen 2.494 N/A GLN 8.A NE2 ILE 4.A O no hydrogen 2.520 N/A ARG 12.A NH1 GLU 16.A OE2 no hydrogen 2.987 N/A LEU 15.A N PRO 11.A O no hydrogen 3.327 N/A ALA 17.A N GLU 16.A OE1 no hydrogen 3.360 N/A VAL 19.A N ASP 18.A OD1 no hydrogen 2.349 N/A LEU 20.A N GLU 16.A O no hydrogen 2.872 N/A GLU 21.A N ALA 17.A O no hydrogen 2.905 N/A LYS 22.A N ASP 18.A O no hydrogen 2.929 N/A LYS 22.A NZ GLY 74.A O no hydrogen 3.094 N/A LYS 22.A NZ LEU 77.A O no hydrogen 3.472 N/A LEU 23.A N VAL 19.A O no hydrogen 2.859 N/A LEU 24.A N LEU 20.A O no hydrogen 2.909 N/A MET 25.A N GLU 21.A O no hydrogen 2.919 N/A ASN 26.A N LYS 22.A O no hydrogen 2.894 N/A ASN 26.A ND2 LYS 22.A O no hydrogen 2.584 N/A ASN 26.A ND2 LEU 78.A O no hydrogen 3.030 N/A THR 27.A N LEU 23.A O no hydrogen 2.902 N/A THR 27.A OG1 LEU 23.A O no hydrogen 2.610 N/A ARG 29.A NH1 ARG 29.A O no hydrogen 3.503 N/A ARG 29.A NH1 GLU 33.A OE2 no hydrogen 3.088 N/A GLN 31.A N PRO 28.A O no hydrogen 3.169 N/A TRP 32.A N ARG 29.A O no hydrogen 3.085 N/A THR 39.A OG1 PRO 36.A O no hydrogen 2.737 N/A TYR 42.A N THR 39.A OG1 no hydrogen 3.148 N/A THR 43.A N THR 39.A O no hydrogen 2.973 N/A THR 43.A OG1 THR 39.A O no hydrogen 3.260 N/A LEU 44.A N TYR 40.A O no hydrogen 2.892 N/A LYS 45.A N LEU 41.A O no hydrogen 2.867 N/A THR 46.A N TYR 42.A O no hydrogen 2.916 N/A THR 46.A OG1 TYR 42.A O no hydrogen 2.865 N/A PHE 47.A N THR 43.A O no hydrogen 2.971 N/A ALA 48.A N LEU 44.A O no hydrogen 2.830 N/A GLU 49.A N LYS 45.A O no hydrogen 2.946 N/A VAL 50.A N PHE 47.A O no hydrogen 3.376 N/A TYR 51.A N PHE 47.A O no hydrogen 2.895 N/A GLY 52.A N ALA 56.A O no hydrogen 3.436 N/A LYS 55.A N GLY 52.A O no hydrogen 3.170 N/A LYS 55.A NZ PRO 53.A O no hydrogen 3.335 N/A TYR 64.A N GLY 60.A O no hydrogen 2.905 N/A TYR 64.A OH THR 13.A O no hydrogen 3.222 N/A PHE 65.A N TRP 61.A O no hydrogen 2.888 N/A ARG 66.A N TRP 62.A O no hydrogen 2.903 N/A LEU 67.A N ASP 63.A O no hydrogen 2.912 N/A LYS 68.A N TYR 64.A O no hydrogen 2.911 N/A LYS 68.A NZ THR 13.A O no hydrogen 2.764 N/A LYS 68.A NZ ILE 14.A O no hydrogen 2.771 N/A LEU 69.A N PHE 65.A O no hydrogen 2.894 N/A ASP 70.A N ARG 66.A O no hydrogen 2.937 N/A LEU 71.A N LEU 67.A O no hydrogen 2.912 N/A GLU 76.A N PRO 73.A O no hydrogen 3.270 N/A LEU 78.A N ASN 26.A OD1 no hydrogen 2.802 N/A ASP 79.A N GLU 82.A OE1 no hydrogen 3.291 N/A GLU 80.A N ASP 79.A OD1 no hydrogen 2.419 N/A MET 83.A N ASP 79.A O no hydrogen 2.899 N/A LYS 84.A N GLU 80.A O no hydrogen 2.918 N/A VAL 85.A N ASP 81.A O no hydrogen 2.881 N/A ALA 86.A N GLU 82.A O no hydrogen 2.935 N/A ALA 87.A N MET 83.A O no hydrogen 2.892 N/A ASP 88.A N LYS 84.A O no hydrogen 2.893 N/A TYR 89.A N VAL 85.A O no hydrogen 2.922 N/A ASP 90.A N ALA 86.A O no hydrogen 2.953 N/A LYS 91.A N ALA 87.A O no hydrogen 2.871 N/A LEU 92.A N ASP 88.A O no hydrogen 2.899 N/A MET 93.A N TYR 89.A O no hydrogen 3.001 N/A MET 94.A N ASP 90.A O no hydrogen 2.922 N/A GLU 95.A N LYS 91.A O no hydrogen 2.875 N/A GLY 96.A N MET 93.A O no hydrogen 3.143 N/A LYS 97.A N LEU 92.A O no hydrogen 3.074 N/A LYS 97.A NZ GLN 116.A OE1 no hydrogen 3.346 N/A ILE 98.A N ILE 115.A O no hydrogen 2.999 N/A PHE 100.A N ALA 113.A O no hydrogen 2.518 N/A VAL 102.A N TRP 109.A O no hydrogen 2.965 N/A GLY 104.A N GLY 107.A O no hydrogen 2.426 N/A TRP 109.A N VAL 102.A O no hydrogen 2.881 N/A THR 111.A N PHE 100.A O no hydrogen 3.086 N/A ILE 115.A N ILE 98.A O no hydrogen 3.051 N/A GLN 116.A NE2 LYS 118.A O no hydrogen 2.977 N/A TRP 117.A N GLY 96.A O no hydrogen 3.160 N/A LYS 118.A N GLY 96.A O no hydrogen 3.379 N/A LYS 118.A NZ GLN 122.A OE1 no hydrogen 3.251 N/A GLU 121.A N GLN 127.A OE1 no hydrogen 3.313 N/A ALA 124.A N GLU 121.A O no hydrogen 3.204 N/A GLN 127.A N ALA 124.A O no hydrogen 3.402 N/A GLN 129.A N TRP 117.A O no hydrogen 2.830 N/A THR 130.A N ASN 134.A OD1 no hydrogen 3.054 N/A ASN 134.A N THR 130.A O no hydrogen 2.584 N/A GLY 135.A N LEU 131.A O no hydrogen 3.283 N/A ARG 136.A NE GLN 140.A OE1 no hydrogen 2.580 N/A SER 138.A OG LEU 131.A O no hydrogen 3.060 N/A SER 138.A OG THR 132.A O no hydrogen 2.539 N/A LYS 139.A N GLY 135.A O no hydrogen 2.890 N/A LYS 139.A NZ ASN 134.A O no hydrogen 3.519 N/A GLN 140.A N ARG 136.A O no hydrogen 2.932 N/A PHE 141.A N PHE 137.A O no hydrogen 2.889 N/A LEU 142.A N SER 138.A O no hydrogen 2.923 N/A ALA 143.A N LYS 139.A O no hydrogen 2.897 N/A ASN 144.A N GLN 140.A O no hydrogen 2.909 N/A ASN 144.A N PHE 141.A O no hydrogen 3.070 N/A ASN 144.A ND2 GLN 140.A O no hydrogen 2.815 N/A LEU 145.A N LEU 142.A O no hydrogen 3.239 N/A TYR 148.A N LEU 145.A O no hydrogen 2.954 N/A ARG 149.A N LEU 145.A O no hydrogen 2.631 N/A ARG 149.A NH1 ASN 144.A O no hydrogen 2.246 N/A ARG 149.A NH2 GLU 160.A OE2 no hydrogen 3.248 N/A LYS 153.A N GLN 156.A OE1 no hydrogen 3.259 N/A ARG 157.A N LYS 153.A O no hydrogen 2.978 N/A ARG 157.A NE ALA 146.A O no hydrogen 3.017 N/A GLY 158.A N PRO 154.A O no hydrogen 2.928 N/A LEU 159.A N TRP 155.A O no hydrogen 2.844 N/A GLU 160.A N GLN 156.A O no hydrogen 2.995 N/A ILE 161.A N ARG 157.A O no hydrogen 3.008 N/A GLY 162.A N GLY 158.A O no hydrogen 2.851 N/A MET 163.A N LEU 159.A O no hydrogen 2.883 N/A ALA 164.A N GLU 160.A O no hydrogen 3.081 N/A HIS 165.A N ILE 161.A O no hydrogen 2.915 N/A GLY 166.A N GLY 162.A O no hydrogen 2.899 N/A TYR 167.A N MET 163.A O no hydrogen 2.991 N/A PHE 168.A N ALA 164.A O no hydrogen 3.039 N/A LEU 169.A N HIS 165.A O no hydrogen 2.864 N/A ILE 170.A N GLY 166.A O no hydrogen 3.075 N/A THR 174.A N ILE 170.A O no hydrogen 3.233 N/A THR 174.A OG1 ILE 170.A O no hydrogen 2.918 N/A SER 175.A N GLY 171.A O no hydrogen 2.931 N/A LEU 176.A N PRO 172.A O no hydrogen 2.923 N/A ARG 180.A N GLY 177.A O no hydrogen 3.134 N/A ARG 180.A NH1 GLY 177.A O no hydrogen 3.151 N/A THR 182.A N LEU 179.A O no hydrogen 3.207 N/A THR 182.A OG1 LEU 179.A O no hydrogen 2.773 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 3.157 N/A ALA 185.A N THR 182.A O no hydrogen 3.144 N/A VAL 188.A N GLU 184.A O no hydrogen 2.926 N/A GLY 189.A N ALA 185.A O no hydrogen 2.890 N/A LEU 190.A N ALA 186.A O no hydrogen 2.881 N/A LEU 191.A N THR 187.A O no hydrogen 2.919 N/A CYS 192.A N VAL 188.A O no hydrogen 2.923 N/A CYS 192.A SG VAL 188.A O no hydrogen 2.930 N/A GLY 193.A N GLY 189.A O no hydrogen 2.863 N/A CYS 194.A N LEU 190.A O no hydrogen 2.909 N/A CYS 194.A SG LEU 190.A O no hydrogen 3.255 N/A ALA 195.A N LEU 191.A O no hydrogen 2.908 N/A ILE 196.A N CYS 192.A O no hydrogen 2.905 N/A VAL 197.A N GLY 193.A O no hydrogen 2.903 N/A GLY 198.A N CYS 194.A O no hydrogen 2.899 N/A LEU 199.A N ALA 195.A O no hydrogen 2.893 N/A VAL 200.A N ILE 196.A O no hydrogen 2.941 N/A SER 201.A N VAL 197.A O no hydrogen 2.901 N/A SER 201.A OG VAL 197.A O no hydrogen 2.585 N/A ILE 202.A N GLY 198.A O no hydrogen 2.864 N/A GLY 203.A N LEU 199.A O no hydrogen 2.923 N/A GLY 204.A N VAL 200.A O no hydrogen 2.880 N/A LEU 205.A N SER 201.A O no hydrogen 2.866 N/A ILE 206.A N ILE 202.A O no hydrogen 2.920 N/A PHE 207.A N GLY 203.A O no hydrogen 2.896 N/A GLY 208.A N GLY 204.A O no hydrogen 2.887 N/A SER 209.A N LEU 205.A O no hydrogen 2.883 N/A SER 209.A N ILE 206.A O no hydrogen 3.199 N/A SER 209.A OG LEU 205.A O no hydrogen 3.168 N/A THR 210.A N ILE 206.A O no hydrogen 2.919 N/A THR 210.A OG1 ILE 206.A O no hydrogen 2.583 N/A THR 210.A OG1 PHE 207.A O no hydrogen 3.187 N/A ILE 211.A N PHE 207.A O no hydrogen 2.896 N/A LYS 212.A N PHE 207.A O no hydrogen 3.433 N/A LYS 212.A NZ SER 209.A O no hydrogen 3.051 N/A GLY 220.A N GLU 219.A OE1 no hydrogen 3.358 N/A LYS 222.A N ASP 221.A OD1 no hydrogen 2.922 N/A ALA 224.A N ASP 217.A OD2 no hydrogen 2.382 N/A SER 225.A N LYS 222.A O no hydrogen 3.146 N/A ILE 228.A N ALA 224.A O no hydrogen 2.911 N/A GLU 229.A N SER 225.A O no hydrogen 2.919 N/A MET 230.A N GLY 226.A O no hydrogen 2.898 N/A ILE 231.A N PHE 227.A O no hydrogen 2.918 N/A ASN 232.A N ILE 228.A O no hydrogen 2.926 N/A TRP 233.A N GLU 229.A O no hydrogen 2.960 N/A HIS 234.A N MET 230.A O no hydrogen 2.839 N/A ALA 235.A N ILE 231.A O no hydrogen 2.957 N/A ILE 236.A N ASN 232.A O no hydrogen 3.005 N/A GLY 237.A N TRP 233.A O no hydrogen 2.841 N/A GLY 238.A N HIS 234.A O no hydrogen 2.829 N/A LEU 239.A N ALA 235.A O no hydrogen 2.992 N/A GLY 240.A N ILE 236.A O no hydrogen 2.936 N/A GLY 241.A N GLY 237.A O no hydrogen 2.820 N/A ALA 242.A N GLY 238.A O no hydrogen 2.907 N/A GLY 243.A N LEU 239.A O no hydrogen 2.936 N/A PHE 244.A N GLY 240.A O no hydrogen 2.871 N/A ALA 245.A N GLY 241.A O no hydrogen 2.906 N/A HIS 246.A N ALA 242.A O no hydrogen 2.932 N/A ALA 247.A N GLY 243.A O no hydrogen 2.851 N/A LEU 248.A N PHE 244.A O no hydrogen 2.909 N/A ILE 249.A N ALA 245.A O no hydrogen 2.916 N/A THR 250.A N HIS 246.A O no hydrogen 2.904 N/A THR 250.A OG1 HIS 246.A O no hydrogen 3.292 N/A VAL 251.A N ALA 247.A O no hydrogen 2.874 N/A PHE 252.A N LEU 248.A O no hydrogen 2.905 N/A