Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a9s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 TYR 10.A OH no hydrogen 3.182 N/A TYR 5.A N ASN 3.A OD1 no hydrogen 2.818 N/A TYR 5.A OH ASN 55.A O no hydrogen 2.961 N/A THR 6.A N ASP 9.A OD2 no hydrogen 3.077 N/A THR 6.A OG1 ASP 9.A OD2 no hydrogen 3.480 N/A ASP 9.A N THR 6.A O no hydrogen 2.852 N/A GLN 11.A N TYR 7.A O no hydrogen 3.069 N/A ASP 12.A N GLU 8.A O no hydrogen 2.755 N/A THR 13.A N ASP 9.A O no hydrogen 3.223 N/A THR 13.A OG1 ASP 9.A O no hydrogen 3.105 N/A THR 13.A OG1 ASN 55.A OD1 no hydrogen 3.109 N/A ALA 14.A N TYR 10.A O no hydrogen 2.969 N/A LYS 15.A N GLN 11.A O no hydrogen 2.922 N/A TRP 16.A N ASP 12.A O no hydrogen 2.945 N/A LEU 17.A N THR 13.A O no hydrogen 3.108 N/A LEU 18.A N ALA 14.A O no hydrogen 2.951 N/A SER 19.A N LYS 15.A O no hydrogen 2.931 N/A SER 19.A OG LYS 15.A O no hydrogen 3.061 N/A SER 19.A OG TRP 16.A O no hydrogen 2.990 N/A HIS 20.A N LEU 17.A O no hydrogen 2.961 N/A THR 21.A OG1 GLN 46.A OE1 no hydrogen 2.732 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.789 N/A GLN 23.A N THR 21.A OG1 no hydrogen 3.286 N/A GLN 23.A NE2 GLU 22.A OE2 no hydrogen 3.020 N/A ARG 24.A NE GLN 23.A O no hydrogen 2.871 N/A ARG 24.A NH2 LEU 18.A O no hydrogen 3.091 N/A ARG 24.A NH2 GLN 23.A O no hydrogen 3.197 N/A GLN 26.A N ALA 77.A O no hydrogen 2.963 N/A ALA 28.A N THR 110.A O no hydrogen 2.909 N/A VAL 29.A N VAL 79.A O no hydrogen 2.863 N/A ILE 30.A N VAL 112.A O no hydrogen 3.089 N/A CYS 31.A N MET 81.A O no hydrogen 2.881 N/A CYS 31.A SG LEU 35.A O no hydrogen 3.830 N/A GLY 32.A N THR 114.A OG1 no hydrogen 3.049 N/A LEU 35.A N GLY 32.A O no hydrogen 2.985 N/A LEU 38.A N LEU 35.A O no hydrogen 3.205 N/A ASN 40.A N GLY 37.A O no hydrogen 2.959 N/A LEU 42.A N VAL 39.A O no hydrogen 3.031 N/A THR 43.A N ILE 72.A O no hydrogen 2.855 N/A THR 43.A OG1 ILE 72.A O no hydrogen 2.955 N/A GLN 46.A N PHE 70.A O no hydrogen 2.909 N/A GLN 46.A NE2 HIS 20.A O no hydrogen 2.839 N/A PHE 48.A N LEU 68.A O no hydrogen 2.834 N/A ASP 49.A N GLU 52.A OE2 no hydrogen 3.016 N/A TYR 50.A N GLY 66.A O no hydrogen 3.130 N/A TYR 50.A OH GLY 83.A O no hydrogen 2.669 N/A GLU 52.A N ASP 49.A O no hydrogen 2.994 N/A ILE 53.A N TYR 50.A O no hydrogen 3.173 N/A PHE 56.A N ILE 53.A O no hydrogen 3.106 N/A GLU 58.A N TYR 91.A OH no hydrogen 2.915 N/A SER 59.A OG ARG 84.A O no hydrogen 3.261 N/A THR 60.A N GLU 89.A OE1 no hydrogen 3.020 N/A THR 60.A OG1 GLU 89.A OE1 no hydrogen 2.633 N/A HIS 64.A N VAL 61.A O no hydrogen 3.077 N/A GLY 66.A N GLN 82.A O no hydrogen 2.787 N/A ARG 67.A N GLN 82.A O no hydrogen 3.435 N/A LEU 68.A N PHE 48.A O no hydrogen 2.710 N/A VAL 69.A N MET 80.A O no hydrogen 2.879 N/A PHE 70.A N GLN 46.A O no hydrogen 2.836 N/A GLY 71.A N CYS 78.A O no hydrogen 2.989 N/A ILE 72.A N THR 43.A O no hydrogen 2.882 N/A LEU 73.A N ARG 76.A O no hydrogen 2.802 N/A ASN 74.A ND2 SER 276.A O no hydrogen 2.769 N/A ARG 76.A N LEU 73.A O no hydrogen 2.939 N/A ARG 76.A NE GLN 26.A OE1 no hydrogen 3.371 N/A ALA 77.A N GLN 26.A OE1 no hydrogen 2.721 N/A CYS 78.A N GLY 71.A O no hydrogen 2.856 N/A VAL 79.A N VAL 27.A O no hydrogen 3.008 N/A MET 80.A N VAL 69.A O no hydrogen 2.722 N/A MET 81.A N VAL 29.A O no hydrogen 2.807 N/A GLN 82.A N ARG 67.A O no hydrogen 2.838 N/A GLN 82.A NE2 GLY 36.A O no hydrogen 3.102 N/A ARG 84.A NE GLU 224.A OE1 no hydrogen 3.349 N/A ARG 84.A NE GLU 224.A OE2 no hydrogen 2.971 N/A ARG 84.A NH1 THR 114.A O no hydrogen 2.854 N/A ARG 84.A NH2 THR 114.A O no hydrogen 3.106 N/A ARG 84.A NH2 GLU 224.A OE1 no hydrogen 2.881 N/A HIS 86.A N GLU 89.A OE2 no hydrogen 2.793 N/A HIS 86.A ND1 GLU 89.A OE2 no hydrogen 2.945 N/A GLU 89.A N HIS 86.A O no hydrogen 3.240 N/A GLY 90.A N MET 87.A O no hydrogen 2.944 N/A TYR 91.A OH GLU 58.A O no hydrogen 2.590 N/A LYS 95.A N PRO 92.A O no hydrogen 2.921 N/A VAL 96.A N PRO 92.A O no hydrogen 3.084 N/A THR 97.A N PHE 93.A O no hydrogen 3.078 N/A THR 97.A OG1 PHE 93.A O no hydrogen 2.869 N/A PHE 98.A N LYS 95.A O no hydrogen 3.108 N/A VAL 100.A N THR 97.A O no hydrogen 3.115 N/A ARG 101.A NH1 TYR 10.A OH no hydrogen 3.297 N/A ARG 101.A NH2 HIS 230.A ND1 no hydrogen 3.417 N/A VAL 102.A N PHE 98.A O no hydrogen 3.376 N/A PHE 103.A N PRO 99.A O no hydrogen 2.899 N/A ARG 104.A N VAL 100.A O no hydrogen 3.222 N/A ARG 104.A NE ARG 104.A O no hydrogen 3.463 N/A ARG 104.A NH1 CYS 231.A O no hydrogen 3.361 N/A LEU 105.A N ARG 101.A O no hydrogen 3.198 N/A LEU 106.A N PHE 103.A O no hydrogen 2.879 N/A GLY 107.A N PHE 103.A O no hydrogen 3.217 N/A GLY 107.A N ARG 104.A O no hydrogen 3.082 N/A VAL 108.A N PHE 103.A O no hydrogen 3.132 N/A GLU 109.A N GLN 26.A O no hydrogen 3.026 N/A THR 110.A N GLN 26.A O no hydrogen 3.359 N/A LEU 111.A N ARG 234.A O no hydrogen 2.866 N/A VAL 112.A N ALA 28.A O no hydrogen 2.878 N/A VAL 113.A N PHE 236.A O no hydrogen 2.856 N/A THR 114.A N ILE 30.A O no hydrogen 3.176 N/A THR 114.A OG1 ILE 30.A O no hydrogen 2.748 N/A ASN 115.A N PHE 238.A O no hydrogen 3.304 N/A ASN 115.A ND2 THR 221.A OG1 no hydrogen 2.911 N/A ALA 117.A N LEU 240.A O no hydrogen 2.904 N/A GLY 118.A N VAL 217.A O no hydrogen 2.923 N/A GLY 119.A N ASN 243.A O no hydrogen 2.870 N/A LEU 120.A N ASP 215.A O no hydrogen 2.687 N/A ASN 121.A N ASP 215.A O no hydrogen 2.968 N/A ASN 121.A ND2 ASP 215.A OD1 no hydrogen 2.905 N/A ASN 123.A N ASN 121.A OD1 no hydrogen 2.865 N/A PHE 124.A N ASN 121.A O no hydrogen 2.895 N/A GLU 125.A N ASP 128.A OD2 no hydrogen 2.831 N/A GLY 127.A N ILE 241.A O no hydrogen 2.903 N/A ASP 128.A N GLU 125.A O no hydrogen 3.042 N/A MET 130.A N SER 239.A O no hydrogen 2.924 N/A LEU 131.A N GLN 188.A O no hydrogen 2.785 N/A ILE 132.A N GLY 237.A O no hydrogen 3.039 N/A ARG 133.A N GLY 190.A O no hydrogen 2.857 N/A ARG 133.A NH1 GLU 189.A OE1 no hydrogen 3.062 N/A HIS 135.A N ASP 134.A OD1 no hydrogen 2.823 N/A HIS 135.A ND1 TYR 166.A OH no hydrogen 2.761 N/A ILE 136.A N TYR 192.A O no hydrogen 2.901 N/A PHE 141.A N ASN 137.A O no hydrogen 3.209 N/A PHE 141.A N LEU 138.A O no hydrogen 2.915 N/A SER 142.A N PRO 139.A O no hydrogen 3.062 N/A SER 142.A OG PRO 139.A O no hydrogen 2.841 N/A GLY 143.A N GLY 140.A O no hydrogen 3.076 N/A GLU 144.A N PRO 139.A O no hydrogen 3.228 N/A LEU 147.A N ASN 145.A OD1 no hydrogen 2.921 N/A ARG 148.A N ASN 145.A O no hydrogen 2.991 N/A ASN 151.A ND2 GLU 153.A OE2 no hydrogen 2.888 N/A ASN 151.A ND2 GLY 156.A O no hydrogen 2.866 N/A ARG 154.A N GLU 152.A OE2 no hydrogen 3.258 N/A ARG 154.A NE GLU 152.A OE2 no hydrogen 3.045 N/A ARG 154.A NH2 GLU 152.A OE1 no hydrogen 3.532 N/A PHE 155.A N GLU 152.A O no hydrogen 2.954 N/A GLY 156.A N GLU 152.A O no hydrogen 3.196 N/A ARG 158.A NE ARG 158.A O no hydrogen 3.031 N/A ARG 158.A NH1 GLY 149.A O no hydrogen 2.759 N/A ARG 158.A NH2 LEU 147.A O no hydrogen 2.881 N/A ARG 158.A NH2 GLY 149.A O no hydrogen 3.147 N/A ALA 165.A N MET 162.A O no hydrogen 3.117 N/A TYR 166.A OH HIS 135.A ND1 no hydrogen 2.761 N/A ASP 167.A N VAL 235.A O no hydrogen 2.929 N/A MET 170.A N ASP 167.A OD2 no hydrogen 2.950 N/A ARG 171.A N ASP 167.A O no hydrogen 3.248 N/A ARG 171.A NE TYR 166.A O no hydrogen 3.425 N/A ARG 171.A NH1 GLU 189.A OE2 no hydrogen 3.216 N/A ARG 171.A NH2 TYR 166.A O no hydrogen 3.055 N/A GLN 172.A N ARG 168.A O no hydrogen 3.116 N/A LYS 173.A N ASP 169.A O no hydrogen 3.035 N/A ALA 174.A N MET 170.A O no hydrogen 2.845 N/A HIS 175.A N ARG 171.A O no hydrogen 3.206 N/A HIS 175.A ND1 ARG 171.A O no hydrogen 2.963 N/A SER 176.A N GLN 172.A O no hydrogen 3.067 N/A SER 176.A OG GLN 172.A O no hydrogen 3.491 N/A THR 177.A N LYS 173.A O no hydrogen 2.903 N/A THR 177.A OG1 LYS 173.A O no hydrogen 2.833 N/A TRP 178.A N ALA 174.A O no hydrogen 2.974 N/A TRP 178.A NE1 ARG 185.A O no hydrogen 2.827 N/A LYS 179.A N HIS 175.A O no hydrogen 3.221 N/A GLN 180.A N SER 176.A O no hydrogen 3.219 N/A MET 181.A N THR 177.A O no hydrogen 3.201 N/A MET 181.A N TRP 178.A O no hydrogen 3.104 N/A GLY 182.A N LYS 179.A O no hydrogen 3.097 N/A ARG 185.A NE ASP 128.A OD1 no hydrogen 2.800 N/A GLN 188.A N ILE 129.A O no hydrogen 2.982 N/A GLN 188.A NE2 GLU 186.A O no hydrogen 3.031 N/A GLN 188.A NE2 GLU 186.A OE1 no hydrogen 3.470 N/A GLY 190.A N LEU 131.A O no hydrogen 2.857 N/A THR 191.A N ASP 215.A OD2 no hydrogen 3.005 N/A TYR 192.A N ASP 134.A O no hydrogen 2.896 N/A TYR 192.A OH SER 220.A O no hydrogen 3.214 N/A VAL 193.A N ALA 216.A O no hydrogen 2.920 N/A MET 194.A N ILE 136.A O no hydrogen 3.184 N/A LEU 195.A N GLY 218.A O no hydrogen 3.105 N/A ASN 199.A ND2 PHE 200.A O no hydrogen 2.919 N/A THR 202.A N GLU 205.A OE1 no hydrogen 2.956 N/A GLU 205.A N THR 202.A OG1 no hydrogen 3.180 N/A CYS 206.A N THR 202.A O no hydrogen 3.126 N/A CYS 206.A SG THR 202.A O no hydrogen 3.559 N/A ARG 207.A N VAL 203.A O no hydrogen 3.008 N/A ARG 207.A NE MET 247.A O no hydrogen 2.951 N/A ARG 207.A NH2 MET 247.A O no hydrogen 2.988 N/A LEU 208.A N ALA 204.A O no hydrogen 3.117 N/A LEU 209.A N GLU 205.A O no hydrogen 2.929 N/A ARG 210.A N CYS 206.A O no hydrogen 2.943 N/A ARG 210.A NH1 ALA 214.A O no hydrogen 3.244 N/A ARG 210.A NH1 ASP 215.A OD1 no hydrogen 2.816 N/A ASN 211.A N ARG 207.A O no hydrogen 2.984 N/A LEU 212.A N LEU 209.A O no hydrogen 3.013 N/A GLY 213.A N ARG 210.A O no hydrogen 2.832 N/A ALA 214.A N LEU 209.A O no hydrogen 3.247 N/A ASP 215.A N THR 191.A O no hydrogen 2.870 N/A ALA 216.A N THR 191.A O no hydrogen 3.330 N/A VAL 217.A N GLY 118.A O no hydrogen 2.896 N/A GLY 218.A N VAL 193.A O no hydrogen 3.020 N/A SER 220.A N TYR 192.A OH no hydrogen 3.328 N/A SER 220.A OG THR 221.A OG1 no hydrogen 3.099 N/A THR 221.A OG1 SER 220.A OG no hydrogen 3.099 N/A VAL 222.A N SER 220.A O no hydrogen 2.826 N/A VAL 225.A N THR 221.A O no hydrogen 3.094 N/A ILE 226.A N VAL 222.A O no hydrogen 3.046 N/A VAL 227.A N PRO 223.A O no hydrogen 3.238 N/A ALA 228.A N GLU 224.A O no hydrogen 2.922 N/A ARG 229.A N VAL 225.A O no hydrogen 2.876 N/A ARG 229.A NH1 LEU 233.A O no hydrogen 2.919 N/A HIS 230.A N ILE 226.A O no hydrogen 2.908 N/A HIS 230.A NE2 ASN 151.A OD1 no hydrogen 2.933 N/A CYS 231.A N VAL 227.A O no hydrogen 3.067 N/A CYS 231.A SG VAL 227.A O no hydrogen 3.489 N/A CYS 231.A SG ALA 228.A O no hydrogen 3.597 N/A GLY 232.A N ARG 229.A O no hydrogen 3.111 N/A LEU 233.A N ALA 228.A O no hydrogen 2.833 N/A ARG 234.A N GLU 109.A O no hydrogen 2.976 N/A PHE 236.A N LEU 111.A O no hydrogen 3.089 N/A PHE 238.A N VAL 113.A O no hydrogen 3.037 N/A SER 239.A N MET 130.A O no hydrogen 2.857 N/A SER 239.A OG ASN 115.A OD1 no hydrogen 2.771 N/A LEU 240.A N ASN 115.A O no hydrogen 2.893 N/A ILE 241.A N ASP 128.A O no hydrogen 2.871 N/A THR 242.A N ALA 117.A O no hydrogen 2.972 N/A THR 242.A OG1 ALA 117.A O no hydrogen 3.414 N/A THR 242.A OG1 ASN 243.A OD1 no hydrogen 3.190 N/A LYS 244.A NZ PHE 124.A O no hydrogen 2.987 N/A VAL 245.A N GLY 119.A O no hydrogen 3.362 N/A ASN 256.A N GLU 259.A OE2 no hydrogen 2.985 N/A ASN 256.A ND2 LYS 254.A O no hydrogen 3.429 N/A HIS 257.A NE2 PRO 62.A O no hydrogen 2.815 N/A GLU 259.A N ASN 256.A OD1 no hydrogen 2.810 N/A LEU 261.A N HIS 257.A O no hydrogen 3.131 N/A GLU 262.A N GLU 258.A O no hydrogen 2.848 N/A ALA 263.A N GLU 259.A O no hydrogen 2.902 N/A GLY 264.A N VAL 260.A O no hydrogen 3.157 N/A LYS 265.A N LEU 261.A O no hydrogen 3.380 N/A LYS 265.A NZ GLU 262.A OE1 no hydrogen 2.887 N/A LYS 265.A NZ GLU 262.A OE2 no hydrogen 2.826 N/A GLN 266.A N GLU 262.A O no hydrogen 3.309 N/A GLN 266.A NE2 GLU 262.A OE2 no hydrogen 2.977 N/A ALA 267.A N ALA 263.A O no hydrogen 3.105 N/A ALA 268.A N LYS 265.A O no hydrogen 3.238 N/A LYS 270.A NZ GLY 127.A O no hydrogen 2.950 N/A LEU 271.A N ALA 267.A O no hydrogen 2.870 N/A GLU 272.A N ALA 268.A O no hydrogen 2.842 N/A GLN 273.A N GLN 269.A O no hydrogen 3.261 N/A PHE 274.A N LYS 270.A O no hydrogen 2.942 N/A VAL 275.A N LEU 271.A O no hydrogen 2.904 N/A SER 276.A N GLU 272.A O no hydrogen 2.994 N/A SER 276.A OG GLU 272.A O no hydrogen 3.403 N/A SER 276.A OG GLN 273.A O no hydrogen 2.898 N/A LEU 277.A N GLN 273.A O no hydrogen 3.006 N/A LEU 278.A N PHE 274.A O no hydrogen 2.906 N/A MET 279.A N VAL 275.A O no hydrogen 3.200 N/A MET 279.A N SER 276.A O no hydrogen 3.176 N/A ALA 280.A N LEU 277.A O no hydrogen 3.152 N/A SER 281.A N LEU 278.A O no hydrogen 2.896 N/A