Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2y6b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 243.A O no hydrogen 2.854 N/A LYS 2.A NZ PHE 246.A O no hydrogen 2.870 N/A LYS 2.A NZ ASP 248.A O no hydrogen 2.619 N/A SER 3.A N ALA 247.A O no hydrogen 2.856 N/A TYR 4.A OH GLU 243.A OE1 no hydrogen 2.606 N/A TYR 4.A OH GLU 243.A OE2 no hydrogen 3.360 N/A TYR 11.A N SER 8.A OG no hydrogen 2.969 N/A TYR 11.A OH ASP 94.A OD2 no hydrogen 2.549 N/A GLN 12.A N SER 8.A O no hydrogen 2.991 N/A LYS 13.A N ALA 9.A O no hydrogen 2.902 N/A ALA 14.A N ASP 10.A O no hydrogen 3.045 N/A VAL 15.A N TYR 11.A O no hydrogen 2.983 N/A GLU 16.A N GLN 12.A O no hydrogen 3.056 N/A LYS 17.A N LYS 13.A O no hydrogen 2.940 N/A LYS 17.A NZ LYS 17.A O no hydrogen 2.771 N/A ALA 18.A N ALA 14.A O no hydrogen 2.699 N/A LYS 19.A N VAL 15.A O no hydrogen 2.824 N/A LYS 20.A N GLU 16.A O no hydrogen 3.225 N/A LYS 21.A N LYS 17.A O no hydrogen 3.063 N/A LEU 22.A N ALA 18.A O no hydrogen 2.758 N/A ARG 23.A N LYS 19.A O no hydrogen 2.983 N/A ARG 23.A NE GLU 105.A OE2 no hydrogen 2.689 N/A ARG 23.A NH2 GLU 105.A OE1 no hydrogen 3.256 N/A ARG 23.A NH2 GLU 105.A OE2 no hydrogen 3.208 N/A GLY 24.A N LYS 20.A O no hydrogen 3.280 N/A PHE 25.A N LYS 21.A O no hydrogen 3.026 N/A ILE 26.A N LEU 22.A O no hydrogen 2.885 N/A ALA 27.A N ARG 23.A O no hydrogen 2.978 N/A GLU 28.A N GLY 24.A O no hydrogen 2.902 N/A LYS 29.A N PHE 25.A O no hydrogen 2.848 N/A ARG 30.A N ALA 27.A O no hydrogen 3.325 N/A CYS 31.A N ILE 26.A O no hydrogen 3.297 N/A MET 35.A N CYS 31.A O no hydrogen 3.044 N/A LEU 36.A N ALA 32.A O no hydrogen 2.792 N/A LYS 37.A N PRO 33.A O no hydrogen 2.818 N/A LYS 37.A NZ ASN 71.A O no hydrogen 3.209 N/A LEU 38.A N LEU 34.A O no hydrogen 2.860 N/A ALA 39.A N MET 35.A O no hydrogen 3.050 N/A TRP 40.A N LEU 36.A O no hydrogen 2.925 N/A HIS 41.A N LYS 37.A O no hydrogen 2.782 N/A HIS 41.A ND1 ASN 70.A OD1 no hydrogen 2.768 N/A SER 42.A N LEU 38.A O no hydrogen 3.046 N/A SER 42.A OG LEU 38.A O no hydrogen 2.839 N/A ALA 43.A N ALA 39.A O no hydrogen 3.031 N/A GLY 44.A N TRP 40.A O no hydrogen 2.783 N/A THR 45.A OG1 SER 42.A O no hydrogen 3.432 N/A PHE 46.A N ALA 43.A O no hydrogen 3.290 N/A ASP 47.A N THR 52.A O no hydrogen 2.800 N/A LYS 48.A N ALA 147.A O no hydrogen 2.727 N/A LYS 48.A NZ GLY 145.A O no hydrogen 2.777 N/A THR 50.A N ASP 47.A OD2 no hydrogen 3.288 N/A THR 50.A OG1 ASP 47.A OD2 no hydrogen 2.837 N/A THR 50.A OG1 THR 52.A OG1 no hydrogen 2.662 N/A THR 52.A N ASP 47.A O no hydrogen 3.368 N/A THR 52.A OG1 THR 50.A OG1 no hydrogen 2.662 N/A GLY 54.A N THR 45.A OG1 no hydrogen 2.893 N/A PHE 56.A N GLY 54.A O no hydrogen 2.885 N/A THR 58.A OG1 GLU 64.A OE1 no hydrogen 2.683 N/A LYS 60.A NZ GLY 57.A O no hydrogen 2.546 N/A HIS 61.A N THR 58.A O no hydrogen 2.867 N/A LEU 65.A N HIS 61.A O no hydrogen 2.882 N/A ALA 66.A N PRO 62.A O no hydrogen 2.910 N/A HIS 67.A N GLU 64.A O no hydrogen 3.197 N/A SER 68.A N GLU 127.A OE2 no hydrogen 3.049 N/A ASN 70.A N HIS 67.A O no hydrogen 2.886 N/A ASN 70.A ND2 GLU 64.A O no hydrogen 2.792 N/A ASN 71.A N SER 68.A O no hydrogen 3.336 N/A ASN 71.A ND2 ARG 171.A O no hydrogen 3.236 N/A LEU 73.A N ASN 70.A O no hydrogen 3.019 N/A VAL 77.A N LEU 73.A O no hydrogen 2.962 N/A ARG 78.A N ASP 74.A O no hydrogen 2.919 N/A LEU 79.A N ILE 75.A O no hydrogen 2.783 N/A LEU 80.A N ALA 76.A O no hydrogen 3.222 N/A GLU 81.A N ARG 78.A O no hydrogen 3.291 N/A LYS 84.A N LEU 80.A O no hydrogen 2.866 N/A LYS 84.A NZ PHE 87.A O no hydrogen 2.785 N/A LYS 84.A NZ LEU 90.A O no hydrogen 2.810 N/A ALA 85.A N GLU 81.A O no hydrogen 2.986 N/A GLU 86.A N LEU 83.A O no hydrogen 2.947 N/A PHE 87.A N LYS 84.A O no hydrogen 2.693 N/A LEU 90.A N PHE 87.A O no hydrogen 3.109 N/A SER 91.A N TYR 11.A OH no hydrogen 3.080 N/A SER 91.A OG TYR 11.A OH no hydrogen 3.352 N/A SER 91.A OG ARG 118.A O no hydrogen 2.567 N/A TYR 92.A N ASP 120.A OD2 no hydrogen 2.909 N/A TYR 92.A OH GLU 81.A OE2 no hydrogen 2.670 N/A ALA 93.A N ASP 120.A OD1 no hydrogen 2.764 N/A ASP 94.A N SER 91.A OG no hydrogen 3.093 N/A PHE 95.A N SER 91.A O no hydrogen 2.989 N/A TYR 96.A N TYR 92.A O no hydrogen 2.845 N/A GLN 97.A N ALA 93.A O no hydrogen 3.217 N/A GLN 97.A NE2 ALA 39.A O no hydrogen 3.032 N/A LEU 98.A N ASP 94.A O no hydrogen 2.763 N/A ALA 99.A N PHE 95.A O no hydrogen 2.847 N/A GLY 100.A N TYR 96.A O no hydrogen 3.092 N/A VAL 101.A N GLN 97.A O no hydrogen 3.057 N/A VAL 102.A N LEU 98.A O no hydrogen 2.897 N/A ALA 103.A N ALA 99.A O no hydrogen 2.742 N/A VAL 104.A N GLY 100.A O no hydrogen 3.173 N/A GLU 105.A N VAL 101.A O no hydrogen 3.011 N/A VAL 106.A N VAL 102.A O no hydrogen 2.787 N/A THR 107.A OG1 ALA 103.A O no hydrogen 2.984 N/A THR 107.A OG1 VAL 104.A O no hydrogen 3.164 N/A GLY 108.A N GLU 105.A O no hydrogen 2.962 N/A GLY 109.A N VAL 104.A O no hydrogen 2.827 N/A HIS 115.A ND1 GLU 243.A OE2 no hydrogen 3.184 N/A GLY 117.A N ASP 94.A OD2 no hydrogen 2.718 N/A ARG 118.A N ASP 94.A OD1 no hydrogen 2.946 N/A ARG 118.A NE SER 242.A O no hydrogen 2.902 N/A ARG 118.A NH1 ASP 94.A OD1 no hydrogen 2.931 N/A ARG 118.A NH1 HIS 115.A O no hydrogen 2.775 N/A ARG 118.A NH2 SER 242.A O no hydrogen 2.940 N/A LYS 121.A N PHE 56.A O no hydrogen 2.930 N/A ARG 129.A NH1 THR 45.A O no hydrogen 2.814 N/A ARG 129.A NH1 THR 52.A O no hydrogen 3.290 N/A ARG 129.A NH1 THR 52.A OG1 no hydrogen 3.025 N/A ARG 129.A NH2 THR 52.A OG1 no hydrogen 2.958 N/A THR 134.A N ASP 132.A OD1 no hydrogen 2.907 N/A THR 134.A OG1 ASP 132.A OD1 no hydrogen 2.603 N/A LYS 135.A N ASP 132.A O no hydrogen 3.104 N/A LEU 140.A N GLY 136.A O no hydrogen 3.054 N/A ARG 141.A N SER 137.A O no hydrogen 3.020 N/A ARG 141.A NE ASP 152.A OD1 no hydrogen 3.159 N/A ARG 141.A NE ASP 152.A OD2 no hydrogen 2.932 N/A ARG 141.A NH1 ASP 213.A OD1 no hydrogen 2.901 N/A ARG 141.A NH2 ASP 152.A OD2 no hydrogen 2.775 N/A ARG 141.A NH2 ASP 213.A OD1 no hydrogen 3.507 N/A ARG 141.A NH2 ASP 213.A OD2 no hydrogen 2.801 N/A ASP 142.A N ASP 138.A O no hydrogen 2.955 N/A VAL 143.A N HIS 139.A O no hydrogen 3.006 N/A VAL 143.A N LEU 140.A O no hydrogen 3.238 N/A PHE 144.A N LEU 140.A O no hydrogen 2.885 N/A GLY 145.A N ARG 141.A O no hydrogen 2.895 N/A LYS 146.A N ARG 141.A O no hydrogen 2.918 N/A ALA 147.A N ASP 142.A O no hydrogen 2.993 N/A MET 148.A N VAL 143.A O no hydrogen 2.999 N/A GLY 149.A N GLY 145.A O no hydrogen 2.979 N/A LEU 150.A N PHE 144.A O no hydrogen 2.719 N/A THR 151.A N ASP 154.A OD2 no hydrogen 3.032 N/A ASP 154.A N THR 151.A OG1 no hydrogen 3.161 N/A ILE 155.A N THR 151.A O no hydrogen 3.045 N/A VAL 156.A N ASP 152.A O no hydrogen 3.300 N/A ALA 157.A N GLN 153.A O no hydrogen 2.924 N/A LEU 158.A N ASP 154.A O no hydrogen 2.837 N/A SER 159.A N ILE 155.A O no hydrogen 2.999 N/A SER 159.A OG ILE 155.A O no hydrogen 2.704 N/A GLY 160.A N VAL 156.A O no hydrogen 3.374 N/A GLY 160.A N ALA 157.A O no hydrogen 2.973 N/A GLY 161.A N LEU 158.A O no hydrogen 2.801 N/A HIS 162.A N SER 159.A O no hydrogen 3.099 N/A HIS 162.A ND1 ASP 207.A OD1 no hydrogen 3.040 N/A THR 163.A N GLY 160.A O no hydrogen 2.897 N/A THR 163.A OG1 ASP 186.A O no hydrogen 2.750 N/A THR 163.A OG1 ASP 186.A OD1 no hydrogen 2.993 N/A ILE 164.A N GLY 161.A O no hydrogen 3.292 N/A GLY 165.A N PRO 182.A O no hydrogen 2.803 N/A ALA 167.A N GLY 176.A O no hydrogen 2.911 N/A LYS 169.A N GLU 175.A OE1 no hydrogen 2.785 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.761 N/A ARG 171.A N HIS 168.A O no hydrogen 2.862 N/A GLY 173.A N HIS 168.A O no hydrogen 3.243 N/A PHE 174.A N SER 172.A OG no hydrogen 3.076 N/A GLY 176.A N ALA 167.A O no hydrogen 2.889 N/A TRP 178.A NE1 ASP 207.A OD2 no hydrogen 2.777 N/A THR 179.A OG1 THR 163.A O no hydrogen 2.988 N/A ILE 184.A N ASN 181.A O no hydrogen 2.952 N/A PHE 185.A N THR 107.A O no hydrogen 2.805 N/A ASN 187.A N GLU 227.A OE1 no hydrogen 2.994 N/A ASN 187.A ND2 TYR 223.A O no hydrogen 2.895 N/A SER 188.A N ASP 186.A OD1 no hydrogen 3.029 N/A SER 188.A OG ASP 186.A OD2 no hydrogen 2.994 N/A TYR 189.A OH ASP 207.A OD1 no hydrogen 2.616 N/A THR 191.A N ASN 187.A O no hydrogen 3.365 N/A THR 191.A OG1 ASN 187.A O no hydrogen 3.565 N/A GLU 192.A N SER 188.A O no hydrogen 2.902 N/A LEU 193.A N TYR 189.A O no hydrogen 2.909 N/A LEU 194.A N PHE 190.A O no hydrogen 3.010 N/A SER 195.A N THR 191.A O no hydrogen 3.161 N/A SER 195.A OG THR 191.A O no hydrogen 3.545 N/A SER 195.A OG GLU 192.A O no hydrogen 3.328 N/A SER 195.A OG GLY 196.A O no hydrogen 3.528 N/A LEU 201.A N LYS 198.A O no hydrogen 3.214 N/A LEU 202.A N PRO 177.A O no hydrogen 2.793 N/A GLN 203.A NE2 LEU 193.A O no hydrogen 3.652 N/A LEU 204.A N ASP 207.A OD2 no hydrogen 2.832 N/A SER 206.A N ALA 133.A O no hydrogen 2.981 N/A SER 206.A OG ALA 133.A O no hydrogen 3.446 N/A LYS 208.A N LEU 204.A O no hydrogen 2.998 N/A LYS 208.A NZ GLU 197.A OE2 no hydrogen 2.967 N/A ALA 209.A N PRO 205.A O no hydrogen 2.897 N/A LEU 210.A N ASP 207.A O no hydrogen 3.064 N/A LEU 211.A N LYS 208.A O no hydrogen 2.978 N/A SER 212.A OG ALA 209.A O no hydrogen 3.453 N/A VAL 215.A N ASP 213.A OD2 no hydrogen 2.996 N/A PHE 216.A N ASP 213.A OD2 no hydrogen 2.882 N/A ARG 217.A N ASP 213.A O no hydrogen 2.923 N/A ARG 217.A NE ASP 221.A OD1 no hydrogen 2.875 N/A ARG 217.A NH1 LEU 211.A O no hydrogen 3.557 N/A ARG 217.A NH2 ASP 221.A OD1 no hydrogen 3.542 N/A VAL 220.A N PHE 216.A O no hydrogen 2.998 N/A ASP 221.A N ARG 217.A O no hydrogen 2.946 N/A LYS 222.A N PRO 218.A O no hydrogen 2.905 N/A LYS 222.A NZ ASP 233.A OD2 no hydrogen 2.861 N/A TYR 223.A N LEU 219.A O no hydrogen 2.926 N/A TYR 223.A OH ASP 233.A OD2 no hydrogen 2.499 N/A ALA 224.A N VAL 220.A O no hydrogen 2.900 N/A ALA 225.A N ASP 221.A O no hydrogen 3.022 N/A ASP 226.A N TYR 223.A O no hydrogen 3.336 N/A ALA 229.A N ASP 226.A OD1 no hydrogen 3.129 N/A PHE 230.A N ASP 226.A O no hydrogen 3.084 N/A PHE 231.A N GLU 227.A O no hydrogen 2.791 N/A ALA 232.A N ASP 228.A O no hydrogen 3.003 N/A ASP 233.A N ALA 229.A O no hydrogen 3.041 N/A TYR 234.A N PHE 230.A O no hydrogen 2.670 N/A ALA 235.A N PHE 231.A O no hydrogen 2.963 N/A GLU 236.A N ALA 232.A O no hydrogen 3.172 N/A ALA 237.A N ASP 233.A O no hydrogen 3.039 N/A HIS 238.A N TYR 234.A O no hydrogen 2.830 N/A GLN 239.A N ALA 235.A O no hydrogen 3.049 N/A GLN 239.A NE2 GLU 243.A OE2 no hydrogen 3.226 N/A LYS 240.A N GLU 236.A O no hydrogen 3.095 N/A LYS 240.A NZ ASP 154.A OD2 no hydrogen 2.744 N/A LEU 241.A N ALA 237.A O no hydrogen 2.827 N/A SER 242.A N HIS 238.A O no hydrogen 2.826 N/A SER 242.A OG HIS 238.A O no hydrogen 3.333 N/A SER 242.A OG GLN 239.A O no hydrogen 2.830 N/A GLU 243.A N LYS 240.A O no hydrogen 3.093 N/A LEU 244.A N LEU 241.A O no hydrogen 3.301 N/A PHE 246.A N GLU 243.A O no hydrogen 2.978 N/A