Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wu6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A ND1 PRO 166.A O no hydrogen 2.788 N/A HIS 4.A NE2 THR 50.A OG1 no hydrogen 2.775 N/A ILE 5.A N VAL 48.A O no hydrogen 2.972 N/A ALA 6.A N LEU 170.A O no hydrogen 2.888 N/A LEU 7.A N THR 50.A O no hydrogen 2.779 N/A ILE 8.A N ILE 172.A O no hydrogen 2.925 N/A GLY 11.A N ASP 10.A OD1 no hydrogen 2.953 N/A ARG 13.A NE GLU 65.A OE2 no hydrogen 2.930 N/A ARG 13.A NH2 GLU 65.A OE2 no hydrogen 2.395 N/A ARG 14.A NH1 GLY 175.A O no hydrogen 2.792 N/A ARG 14.A NH2 GLY 175.A O no hydrogen 3.135 N/A TRP 15.A N GLY 11.A O no hydrogen 2.937 N/A ALA 16.A N ASN 12.A O no hydrogen 3.179 N/A LYS 17.A N ARG 13.A O no hydrogen 2.984 N/A ALA 18.A N ARG 14.A O no hydrogen 2.941 N/A LYS 19.A N TRP 15.A O no hydrogen 3.329 N/A LYS 19.A N ALA 16.A O no hydrogen 3.093 N/A GLY 20.A N LYS 17.A O no hydrogen 3.248 N/A LEU 21.A N ALA 16.A O no hydrogen 2.963 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.958 N/A GLU 25.A N GLU 22.A O no hydrogen 3.023 N/A HIS 27.A NE2 GLU 65.A OE2 no hydrogen 2.942 N/A LYS 28.A N TYR 24.A O no hydrogen 3.034 N/A LYS 28.A NZ GLU 25.A OE2 no hydrogen 2.441 N/A LEU 29.A N GLY 26.A O no hydrogen 3.100 N/A ILE 30.A N HIS 27.A O no hydrogen 2.990 N/A LYS 33.A N LEU 29.A O no hydrogen 2.906 N/A LYS 33.A NZ GLU 36.A OE1 no hydrogen 2.657 N/A LYS 33.A NZ GLU 36.A OE2 no hydrogen 3.230 N/A LYS 33.A NZ PHE 203.A O no hydrogen 2.392 N/A LEU 34.A N ILE 30.A O no hydrogen 3.024 N/A LYS 35.A N ILE 31.A O no hydrogen 3.086 N/A LYS 35.A NZ GLU 79.A OE2 no hydrogen 3.405 N/A GLU 36.A N PRO 32.A O no hydrogen 2.862 N/A ILE 37.A N LYS 33.A O no hydrogen 2.848 N/A CYS 38.A N LEU 34.A O no hydrogen 2.868 N/A CYS 38.A SG LEU 34.A O no hydrogen 3.256 N/A ASP 39.A N LYS 35.A O no hydrogen 3.056 N/A ILE 40.A N GLU 36.A O no hydrogen 3.111 N/A SER 41.A N ILE 37.A O no hydrogen 2.917 N/A SER 41.A OG ILE 37.A O no hydrogen 2.669 N/A SER 42.A N CYS 38.A O no hydrogen 2.983 N/A SER 42.A OG CYS 38.A O no hydrogen 2.851 N/A LYS 43.A N ASP 39.A O no hydrogen 3.307 N/A LYS 43.A NZ ASP 39.A O no hydrogen 2.879 N/A LEU 44.A N ILE 40.A O no hydrogen 3.200 N/A GLY 45.A N SER 42.A O no hydrogen 3.092 N/A ILE 46.A N SER 41.A O no hydrogen 3.033 N/A ILE 49.A N HIS 118.A O no hydrogen 2.992 N/A THR 50.A N ILE 5.A O no hydrogen 2.964 N/A THR 50.A OG1 HIS 4.A NE2 no hydrogen 2.775 N/A ALA 51.A N VAL 120.A O no hydrogen 2.885 N/A PHE 52.A N LEU 7.A O no hydrogen 2.957 N/A ALA 53.A N ALA 122.A O no hydrogen 2.896 N/A PHE 54.A N ALA 122.A O no hydrogen 3.183 N/A SER 55.A OG ASN 58.A OD1 no hydrogen 3.490 N/A THR 56.A N TYR 125.A O no hydrogen 3.171 N/A THR 56.A OG1 GLU 57.A OE2 no hydrogen 2.959 N/A GLU 57.A N SER 55.A OG no hydrogen 3.196 N/A ASN 58.A N SER 55.A O no hydrogen 2.843 N/A TRP 59.A NE1 ASN 124.A OD1 no hydrogen 2.866 N/A LYS 60.A N GLU 57.A O no hydrogen 3.191 N/A ARG 61.A N ASN 58.A O no hydrogen 3.379 N/A GLU 65.A N SER 62.A OG no hydrogen 3.203 N/A VAL 66.A N SER 62.A O no hydrogen 2.902 N/A ASP 67.A N LYS 63.A O no hydrogen 2.827 N/A PHE 68.A N GLU 64.A O no hydrogen 3.020 N/A LEU 69.A N GLU 65.A O no hydrogen 2.966 N/A MET 70.A N VAL 66.A O no hydrogen 2.941 N/A GLN 71.A N ASP 67.A O no hydrogen 3.127 N/A LEU 72.A N PHE 68.A O no hydrogen 2.792 N/A PHE 73.A N LEU 69.A O no hydrogen 2.770 N/A GLU 74.A N MET 70.A O no hydrogen 3.192 N/A GLU 75.A N GLN 71.A O no hydrogen 3.084 N/A PHE 76.A N LEU 72.A O no hydrogen 2.872 N/A PHE 77.A N PHE 73.A O no hydrogen 2.979 N/A ASN 78.A N GLU 74.A O no hydrogen 3.050 N/A GLU 79.A N GLU 75.A O no hydrogen 2.880 N/A PHE 80.A N PHE 76.A O no hydrogen 3.028 N/A LEU 81.A N ASN 78.A O no hydrogen 3.325 N/A PHE 83.A N PHE 80.A O no hydrogen 3.328 N/A ARG 86.A N LEU 117.A O no hydrogen 3.305 N/A VAL 87.A N THR 111.A OG1 no hydrogen 3.067 N/A SER 88.A N LEU 119.A O no hydrogen 2.967 N/A SER 88.A OG HIS 118.A NE2 no hydrogen 2.700 N/A VAL 89.A N GLU 108.A OE2 no hydrogen 2.868 N/A ILE 90.A N ILE 121.A O no hydrogen 2.965 N/A GLY 91.A N GLU 162.A OE2 no hydrogen 2.735 N/A CYS 92.A N ASN 124.A O no hydrogen 2.959 N/A CYS 92.A SG SER 94.A OG no hydrogen 3.602 N/A LYS 93.A NZ VAL 89.A O no hydrogen 3.370 N/A LYS 93.A NZ GLU 108.A OE1 no hydrogen 3.331 N/A LEU 96.A N LYS 93.A O no hydrogen 3.069 N/A THR 99.A OG1 GLU 74.A OE1 no hydrogen 2.654 N/A GLN 101.A N PRO 97.A O no hydrogen 2.978 N/A GLN 101.A NE2 LEU 96.A O no hydrogen 2.891 N/A LYS 102.A N MET 98.A O no hydrogen 3.008 N/A CYS 103.A N THR 99.A O no hydrogen 2.916 N/A CYS 103.A SG ASN 78.A OD1 no hydrogen 3.656 N/A CYS 103.A SG THR 99.A O no hydrogen 3.257 N/A ILE 104.A N LEU 100.A O no hydrogen 2.867 N/A ALA 105.A N GLN 101.A O no hydrogen 3.086 N/A LEU 106.A N LYS 102.A O no hydrogen 2.956 N/A THR 107.A N CYS 103.A O no hydrogen 2.961 N/A THR 107.A OG1 PHE 77.A O no hydrogen 2.773 N/A THR 107.A OG1 CYS 103.A O no hydrogen 3.335 N/A GLU 108.A N ILE 104.A O no hydrogen 2.923 N/A GLU 109.A N ALA 105.A O no hydrogen 3.076 N/A THR 110.A N LEU 106.A O no hydrogen 2.796 N/A THR 110.A OG1 LEU 106.A O no hydrogen 2.774 N/A THR 111.A N THR 107.A O no hydrogen 2.988 N/A THR 111.A OG1 THR 107.A O no hydrogen 2.661 N/A LYS 112.A NZ GLU 109.A OE1 no hydrogen 3.303 N/A LYS 112.A NZ GLU 109.A OE2 no hydrogen 2.686 N/A ASN 114.A N THR 111.A O no hydrogen 2.873 N/A ASN 114.A ND2 VAL 85.A O no hydrogen 3.054 N/A HIS 118.A N GLN 47.A O no hydrogen 2.901 N/A HIS 118.A NE2 SER 88.A OG no hydrogen 2.700 N/A LEU 119.A N ARG 86.A O no hydrogen 2.738 N/A VAL 120.A N ILE 49.A O no hydrogen 2.749 N/A ILE 121.A N SER 88.A O no hydrogen 2.818 N/A ALA 122.A N ALA 51.A O no hydrogen 2.959 N/A LEU 123.A N ILE 90.A O no hydrogen 2.938 N/A ASN 124.A N PHE 54.A O no hydrogen 2.749 N/A ASN 124.A ND2 CYS 92.A O no hydrogen 2.803 N/A TYR 125.A N PHE 54.A O no hydrogen 3.282 N/A TYR 125.A OH ASP 130.A OD2 no hydrogen 2.668 N/A GLY 127.A N ASN 182.A O no hydrogen 2.845 N/A TYR 128.A N ASN 182.A OD1 no hydrogen 3.039 N/A TYR 129.A OH GLU 162.A OE1 no hydrogen 2.674 N/A ASP 130.A N GLY 126.A O no hydrogen 3.051 N/A ILE 131.A N GLY 127.A O no hydrogen 3.084 N/A LEU 132.A N TYR 128.A O no hydrogen 2.856 N/A GLN 133.A N TYR 129.A O no hydrogen 2.869 N/A GLN 133.A NE2 ASP 130.A O no hydrogen 3.117 N/A GLN 133.A NE2 ASP 130.A OD1 no hydrogen 3.008 N/A GLN 133.A NE2 GLU 160.A O no hydrogen 2.995 N/A ALA 134.A N ASP 130.A O no hydrogen 3.069 N/A THR 135.A N ILE 131.A O no hydrogen 2.934 N/A THR 135.A OG1 ILE 131.A O no hydrogen 3.090 N/A LYS 136.A N LEU 132.A O no hydrogen 2.864 N/A SER 137.A N GLN 133.A O no hydrogen 2.994 N/A SER 137.A OG GLU 160.A OE1 no hydrogen 2.671 N/A ILE 138.A N ALA 134.A O no hydrogen 2.979 N/A VAL 139.A N THR 135.A O no hydrogen 2.904 N/A ASN 140.A N LYS 136.A O no hydrogen 2.977 N/A LYS 141.A N SER 137.A O no hydrogen 2.984 N/A LYS 141.A NZ SER 137.A OG no hydrogen 3.283 N/A ALA 142.A N ILE 138.A O no hydrogen 2.980 N/A MET 143.A N VAL 139.A O no hydrogen 2.875 N/A ASN 144.A N ASN 140.A O no hydrogen 3.073 N/A ASN 144.A N LYS 141.A O no hydrogen 3.207 N/A ASN 144.A ND2 ASN 140.A O no hydrogen 3.076 N/A GLY 145.A N ALA 142.A O no hydrogen 3.115 N/A LEU 146.A N LYS 141.A O no hydrogen 2.897 N/A ASP 148.A N ASP 151.A OD2 no hydrogen 2.807 N/A ASP 151.A N ASP 148.A O no hydrogen 2.881 N/A ILE 152.A N VAL 149.A O no hydrogen 3.073 N/A LYS 154.A NZ GLU 158.A OE1 no hydrogen 2.849 N/A LYS 154.A NZ GLU 158.A OE2 no hydrogen 3.354 N/A LEU 156.A N ASN 153.A OD1 no hydrogen 3.010 N/A PHE 157.A N ASN 153.A O no hydrogen 2.901 N/A GLU 158.A N LYS 154.A O no hydrogen 2.826 N/A GLN 159.A N ASN 155.A O no hydrogen 3.256 N/A GLN 159.A N LEU 156.A O no hydrogen 3.195 N/A GLU 160.A N PHE 157.A O no hydrogen 2.932 N/A LEU 161.A N PHE 157.A O no hydrogen 3.251 N/A GLU 162.A N ASP 130.A OD1 no hydrogen 2.718 N/A LYS 164.A NZ LEU 161.A O no hydrogen 2.871 N/A CYS 165.A SG GLU 158.A OE1 no hydrogen 3.407 N/A ASP 169.A N HIS 4.A O no hydrogen 2.841 N/A LEU 170.A N HIS 4.A O no hydrogen 3.423 N/A LEU 171.A N GLU 192.A O no hydrogen 2.833 N/A ILE 172.A N ALA 6.A O no hydrogen 2.800 N/A ARG 173.A N TYR 194.A O no hydrogen 3.037 N/A ARG 173.A NH1 ARG 179.A O no hydrogen 2.996 N/A ARG 173.A NH1 SER 181.A OG no hydrogen 2.789 N/A ARG 173.A NH2 ASP 10.A OD2 no hydrogen 2.986 N/A THR 174.A N ILE 8.A O no hydrogen 3.201 N/A THR 174.A OG1 ILE 8.A O no hydrogen 3.340 N/A THR 174.A OG1 ASP 10.A O no hydrogen 2.782 N/A GLY 175.A N THR 198.A O no hydrogen 2.922 N/A ASN 182.A ND2 GLU 57.A OE2 no hydrogen 3.017 N/A PHE 183.A N VAL 180.A O no hydrogen 3.177 N/A TRP 186.A NE1 GLU 158.A OE2 no hydrogen 2.926 N/A GLN 187.A N GLN 187.A OE1 no hydrogen 2.775 N/A GLN 187.A NE2 ASP 130.A OD2 no hydrogen 3.105 N/A GLN 187.A NE2 SER 163.A O no hydrogen 3.110 N/A LEU 188.A N LEU 185.A O no hydrogen 3.361 N/A THR 191.A N LEU 188.A O no hydrogen 3.327 N/A THR 191.A OG1 PRO 168.A O no hydrogen 2.802 N/A GLU 192.A N ASP 169.A O no hydrogen 3.060 N/A TYR 194.A N LEU 171.A O no hydrogen 2.857 N/A THR 196.A N ARG 173.A O no hydrogen 3.145 N/A THR 196.A OG1 THR 198.A OG1 no hydrogen 3.125 N/A THR 198.A N THR 196.A OG1 no hydrogen 3.143 N/A THR 198.A OG1 THR 196.A OG1 no hydrogen 3.125 N/A PHE 200.A N ASP 10.A O no hydrogen 3.204 N/A ASP 202.A N LEU 199.A O no hydrogen 2.897 N/A PHE 203.A N PHE 200.A O no hydrogen 2.969 N/A GLY 204.A N ASP 207.A OD2 no hydrogen 2.763 N/A LEU 208.A N GLY 204.A O no hydrogen 2.926 N/A LYS 209.A N GLU 205.A O no hydrogen 2.931 N/A LYS 210.A N LYS 206.A O no hydrogen 3.055 N/A ALA 211.A N ASP 207.A O no hydrogen 3.110 N/A ILE 212.A N LEU 208.A O no hydrogen 2.991 N/A LEU 213.A N LYS 209.A O no hydrogen 2.838 N/A ASN 214.A N LYS 210.A O no hydrogen 2.880 N/A PHE 215.A N ALA 211.A O no hydrogen 2.880 N/A GLN 216.A N ILE 212.A O no hydrogen 2.884 N/A GLN 216.A NE2 LEU 1.A O no hydrogen 3.272 N/A GLN 217.A N LEU 213.A O no hydrogen 2.954 N/A ARG 218.A N ASN 214.A O no hydrogen 2.919 N/A ARG 218.A NE ASN 214.A OD1 no hydrogen 2.591 N/A ARG 218.A NH1 GLU 192.A OE1 no hydrogen 2.452 N/A ARG 218.A NH1 PHE 193.A O no hydrogen 2.803 N/A ARG 218.A NH2 PHE 193.A O no hydrogen 2.677 N/A HIS 219.A N PHE 215.A O no hydrogen 2.986 N/A ARG 220.A N GLN 216.A O no hydrogen 3.121 N/A ARG 221.A N GLN 217.A O no hydrogen 3.012 N/A PHE 222.A N ARG 218.A O no hydrogen 2.990 N/A