Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i6i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N ASP 75.A OD2 no hydrogen 2.969 N/A ARG 2.A NH1 HIS 72.A O no hydrogen 2.814 N/A VAL 3.A N PRO 26.A O no hydrogen 2.903 N/A LEU 4.A N ILE 76.A O.A no hydrogen 2.831 N/A LEU 4.A N ILE 76.A O.B no hydrogen 2.886 N/A ILE 5.A N TYR 28.A O no hydrogen 2.981 N/A ALA 6.A N VAL 78.A O no hydrogen 2.918 N/A GLY 10.A N GLY 7.A O no hydrogen 3.066 N/A GLN 14.A N GLY 10.A O no hydrogen 2.956 N/A VAL 16.A N ILE 12.A O no hydrogen 3.075 N/A ALA 17.A N GLY 13.A O no hydrogen 2.881 N/A THR 18.A N GLN 14.A O no hydrogen 3.059 N/A THR 18.A OG1 GLN 14.A O no hydrogen 2.885 N/A ALA 19.A N PHE 15.A O no hydrogen 3.046 N/A SER 20.A N VAL 16.A O no hydrogen 2.935 N/A SER 20.A OG THR 27.A OG1 no hydrogen 2.771 N/A LEU 21.A N ALA 17.A O no hydrogen 3.029 N/A ASP 22.A N THR 18.A O no hydrogen 2.879 N/A ALA 23.A N ALA 19.A O no hydrogen 2.894 N/A ALA 23.A N SER 20.A O no hydrogen 3.268 N/A HIS 24.A N LEU 21.A O no hydrogen 2.993 N/A ARG 25.A N SER 20.A O no hydrogen 3.209 N/A ARG 25.A NH1 ASP 195.A OD2 no hydrogen 2.918 N/A ARG 25.A NH2 ASP 195.A OD1 no hydrogen 3.037 N/A THR 27.A OG1 SER 20.A OG no hydrogen 2.771 N/A THR 27.A OG1 ARG 25.A O no hydrogen 2.719 N/A TYR 28.A N VAL 3.A O no hydrogen 2.742 N/A ILE 29.A N ILE 53.A O no hydrogen 2.870 N/A LEU 30.A N ILE 5.A O no hydrogen 3.069 N/A ALA 31.A N VAL 55.A O no hydrogen 2.757 N/A ALA 41.A N SER 37.A O no hydrogen 2.749 N/A LYS 42.A N PRO 38.A O no hydrogen 2.955 N/A ILE 43.A N SER 39.A O no hydrogen 2.905 N/A PHE 44.A N LYS 40.A O no hydrogen 2.842 N/A LYS 45.A N ALA 41.A O no hydrogen 3.147 N/A ALA 46.A N LYS 42.A O no hydrogen 3.141 N/A LEU 47.A N ILE 43.A O no hydrogen 3.060 N/A GLU 48.A N PHE 44.A O no hydrogen 2.972 N/A ASP 49.A N LYS 45.A O no hydrogen 2.890 N/A LYS 50.A N ALA 46.A O no hydrogen 3.141 N/A LYS 50.A N LEU 47.A O no hydrogen 3.045 N/A GLY 51.A N GLU 48.A O no hydrogen 2.893 N/A ALA 52.A N LEU 47.A O no hydrogen 2.960 N/A ILE 53.A N THR 27.A O no hydrogen 3.006 N/A VAL 55.A N ILE 29.A O no hydrogen 2.966 N/A GLY 57.A N ALA 31.A O no hydrogen 2.975 N/A GLU 61.A N LEU 58.A O no hydrogen 3.181 N/A GLN 62.A NE2 GLU 66.A OE2 no hydrogen 2.904 N/A MET 65.A N GLU 61.A O no hydrogen 2.978 N/A GLU 66.A N GLN 62.A O no hydrogen 2.855 N/A LYS 67.A N GLU 63.A O no hydrogen 3.105 N/A ILE 68.A N ALA 64.A O no hydrogen 3.125 N/A LEU 69.A N MET 65.A O no hydrogen 2.983 N/A LYS 70.A N GLU 66.A O no hydrogen 3.040 N/A GLU 71.A N LYS 67.A O no hydrogen 2.780 N/A HIS 72.A N ILE 68.A O no hydrogen 2.977 N/A GLU 73.A N LYS 70.A O no hydrogen 3.270 N/A ILE 74.A N LEU 69.A O no hydrogen 3.067 N/A ASP 75.A N ARG 2.A O no hydrogen 2.906 N/A ILE 76.A N.A ARG 2.A O no hydrogen 3.011 N/A ILE 76.A N.B ARG 2.A O no hydrogen 3.000 N/A VAL 77.A N ARG 104.A O no hydrogen 2.927 N/A VAL 78.A N LEU 4.A O no hydrogen 2.779 N/A SER 79.A N LEU 106.A O no hydrogen 2.876 N/A SER 79.A OG GLN 89.A OE1 no hydrogen 2.846 N/A THR 80.A N ALA 6.A O no hydrogen 2.800 N/A THR 80.A OG1 ALA 6.A O no hydrogen 3.018 N/A THR 80.A OG1 GLY 7.A O no hydrogen 2.836 N/A SER 85.A N GLY 82.A O no hydrogen 2.818 N/A SER 85.A OG GLU 84.A OE2 no hydrogen 2.639 N/A ASP 88.A N SER 85.A O no hydrogen 3.051 N/A GLN 89.A N ILE 86.A O no hydrogen 3.075 N/A GLN 89.A NE2 ILE 86.A O no hydrogen 2.976 N/A ILE 90.A N LEU 87.A O no hydrogen 3.025 N/A VAL 93.A N GLN 89.A O no hydrogen 2.885 N/A LYS 94.A N ILE 90.A O no hydrogen 2.973 N/A ALA 95.A N ALA 91.A O no hydrogen 2.907 N/A MET 96.A N LEU 92.A O no hydrogen 2.897 N/A LYS 97.A N VAL 93.A O no hydrogen 2.905 N/A ALA 98.A N LYS 94.A O no hydrogen 2.904 N/A VAL 99.A N ALA 95.A O no hydrogen 3.011 N/A GLY 100.A N MET 96.A O no hydrogen 2.988 N/A LYS 103.A N ASP 75.A O no hydrogen 2.736 N/A LYS 103.A NZ ASP 75.A OD1 no hydrogen 3.265 N/A LYS 103.A NZ THR 101.A O no hydrogen 2.714 N/A ARG 104.A N ASP 75.A O no hydrogen 3.374 N/A ARG 104.A NH1 THR 145.A OG1 no hydrogen 2.826 N/A ARG 104.A NH1 THR 199.A OG1 no hydrogen 2.878 N/A ARG 104.A NH2 ASP 196.A O no hydrogen 2.944 N/A PHE 105.A N PRO 143.A O no hydrogen 2.872 N/A LEU 106.A N VAL 77.A O no hydrogen 2.859 N/A SER 108.A N GLN 89.A OE1 no hydrogen 2.919 N/A SER 108.A OG VAL 81.A O no hydrogen 2.637 N/A PHE 110.A N ILE 147.A O no hydrogen 2.788 N/A HIS 112.A NE2 GLN 267.A OE1 no hydrogen 2.988 N/A ASN 115.A N ASP 113.A OD1 no hydrogen 2.922 N/A ARG 116.A N ASP 113.A O no hydrogen 3.019 N/A ARG 116.A NH1 ASP 113.A OD2 no hydrogen 2.696 N/A ARG 116.A NH1 ASP 277.A OD1 no hydrogen 3.040 N/A ARG 116.A NH1 ASP 277.A OD2 no hydrogen 3.549 N/A ARG 116.A NH2 ASP 277.A OD2 no hydrogen 2.951 N/A ALA 117.A N ASP 113.A O no hydrogen 2.955 N/A LEU 124.A N VAL 120.A O no hydrogen 3.058 N/A ASN 125.A N GLU 121.A OE1 no hydrogen 3.189 N/A TYR 127.A N GLY 123.A O no hydrogen 3.110 N/A TYR 127.A OH HIS 112.A ND1 no hydrogen 2.836 N/A ARG 128.A N LEU 124.A O no hydrogen 2.754 N/A ARG 128.A NH1 GLU 121.A OE2 no hydrogen 2.666 N/A ARG 128.A NH2 GLU 121.A OE1 no hydrogen 3.453 N/A ARG 128.A NH2 GLU 121.A OE2 no hydrogen 2.764 N/A ARG 128.A NH2 ASN 125.A OD1 no hydrogen 2.840 N/A GLU 129.A N ASN 125.A O no hydrogen 3.022 N/A LYS 130.A N MET 126.A O no hydrogen 2.974 N/A LYS 130.A NZ SER 108.A O no hydrogen 3.281 N/A LYS 130.A NZ GLU 109.A O no hydrogen 2.883 N/A ARG 131.A N TYR 127.A O no hydrogen 2.791 N/A ARG 131.A NE VAL 114.A O no hydrogen 2.746 N/A ARG 131.A NH2 VAL 114.A O no hydrogen 3.069 N/A ARG 131.A NH2 ALA 117.A O no hydrogen 3.003 N/A ARG 132.A N ARG 128.A O no hydrogen 3.016 N/A VAL 133.A N GLU 129.A O no hydrogen 3.024 N/A ARG 134.A N LYS 130.A O no hydrogen 2.962 N/A ARG 134.A NE GLU 109.A OE2 no hydrogen 2.844 N/A ARG 134.A NH1 ASN 115.A OD1 no hydrogen 3.537 N/A ARG 134.A NH2 GLU 109.A OE1 no hydrogen 2.890 N/A GLN 135.A N ARG 131.A O no hydrogen 2.900 N/A GLN 135.A NE2 GLU 139.A OE1 no hydrogen 2.972 N/A LEU 136.A N ARG 132.A O no hydrogen 2.965 N/A VAL 137.A N VAL 133.A O no hydrogen 2.878 N/A GLU 138.A N ARG 134.A O no hydrogen 2.899 N/A GLU 139.A N GLN 135.A O no hydrogen 2.945 N/A SER 140.A N LEU 136.A O no hydrogen 2.890 N/A SER 140.A OG LEU 136.A O no hydrogen 2.720 N/A GLY 141.A N GLU 138.A O no hydrogen 3.129 N/A ILE 142.A N VAL 137.A O no hydrogen 3.267 N/A PHE 144.A N ASN 201.A OD1 no hydrogen 3.030 N/A THR 145.A N PHE 105.A O no hydrogen 3.054 N/A THR 145.A OG1 THR 199.A O no hydrogen 2.819 N/A TYR 146.A N LYS 202.A O no hydrogen 3.036 N/A TYR 146.A OH GLU 138.A OE2 no hydrogen 2.668 N/A CYS 148.A N VAL 204.A O no hydrogen 2.735 N/A CYS 148.A SG HIS 112.A O no hydrogen 3.742 N/A CYS 148.A SG TYR 146.A O no hydrogen 3.919 N/A ASN 150.A N GLY 111.A O no hydrogen 2.999 N/A ASN 150.A ND2 PHE 206.A O no hydrogen 2.960 N/A SER 151.A N TYR 179.A O no hydrogen 3.014 N/A SER 151.A OG GLN 267.A OE1 no hydrogen 2.991 N/A ALA 153.A N VAL 181.A O no hydrogen 2.897 N/A SER 154.A N.A ILE 152.A O no hydrogen 2.761 N/A SER 154.A N.B ILE 152.A O no hydrogen 2.749 N/A SER 154.A OG.B TYR 299.A OH no hydrogen 2.674 N/A TRP 155.A N VAL 161.A O no hydrogen 3.341 N/A TYR 157.A N TRP 155.A O no hydrogen 3.137 N/A TYR 157.A OH LEU 162.A O no hydrogen 2.753 N/A PHE 167.A N ASP 166.A OD1 no hydrogen 2.848 N/A PHE 168.A N PRO 231.A O no hydrogen 2.917 N/A ILE 170.A N VAL 233.A O no hydrogen 2.849 N/A TYR 171.A OH PRO 156.A O no hydrogen 2.611 N/A GLY 172.A N VAL 235.A O no hydrogen 2.805 N/A GLY 174.A N TYR 171.A O no hydrogen 2.990 N/A ASN 175.A N ASP 173.A OD1.A no hydrogen 2.648 N/A LYS 177.A NZ CYS 212.A O no hydrogen 3.070 N/A LYS 177.A NZ GLU 217.A OE1 no hydrogen 2.810 N/A LYS 177.A NZ GLU 217.A OE2 no hydrogen 3.444 N/A ALA 178.A N LEU 213.A O.A no hydrogen 2.939 N/A ALA 178.A N LEU 213.A O.B no hydrogen 2.924 N/A PHE 180.A N ASN 211.A O no hydrogen 3.137 N/A VAL 181.A N SER 151.A O no hydrogen 2.815 N/A ILE 186.A N ALA 182.A O no hydrogen 2.919 N/A GLY 187.A N GLY 183.A O no hydrogen 3.037 N/A LYS 188.A N THR 184.A O no hydrogen 2.943 N/A LYS 188.A NZ ASP 287.A OD1 no hydrogen 2.883 N/A PHE 189.A N ASP 185.A O no hydrogen 3.007 N/A THR 190.A N ILE 186.A O no hydrogen 3.036 N/A THR 190.A OG1 ILE 186.A O no hydrogen 2.663 N/A MET 191.A N GLY 187.A O no hydrogen 3.076 N/A LYS 192.A N LYS 188.A O no hydrogen 3.268 N/A THR 193.A N PHE 189.A O no hydrogen 3.384 N/A THR 193.A N THR 190.A O no hydrogen 3.110 N/A THR 193.A OG1 THR 190.A O no hydrogen 2.734 N/A VAL 194.A N MET 191.A O no hydrogen 3.479 N/A ASP 196.A N THR 193.A O no hydrogen 3.301 N/A ARG 198.A N ASP 196.A OD1 no hydrogen 2.942 N/A ARG 198.A NE ASP 196.A OD1 no hydrogen 2.961 N/A ARG 198.A NH1 LEU 283.A O no hydrogen 2.852 N/A ARG 198.A NH2 ASP 196.A OD2 no hydrogen 2.819 N/A ARG 198.A NH2 LEU 283.A O no hydrogen 2.980 N/A THR 199.A N ASP 196.A O no hydrogen 3.238 N/A THR 199.A OG1 THR 193.A O no hydrogen 2.574 N/A THR 199.A OG1 ASP 196.A O no hydrogen 3.074 N/A ASN 201.A N PHE 144.A O no hydrogen 2.696 N/A LYS 202.A N THR 199.A O no hydrogen 3.273 N/A LYS 202.A NZ LEU 200.A O no hydrogen 3.335 N/A SER 203.A N GLU 276.A O no hydrogen 3.025 N/A VAL 204.A N TYR 146.A O no hydrogen 2.762 N/A HIS 205.A N VAL 278.A O no hydrogen 2.852 N/A HIS 205.A NE2 ASP 277.A OD1 no hydrogen 2.861 N/A PHE 206.A N CYS 148.A O no hydrogen 3.114 N/A ARG 207.A N GLU 279.A OE2 no hydrogen 2.896 N/A ARG 207.A NH1 PHE 270.A O no hydrogen 3.130 N/A ARG 207.A NH2 GLN 267.A O no hydrogen 3.301 N/A ARG 207.A NH2 PHE 270.A O no hydrogen 2.845 N/A ASN 211.A N PRO 208.A O no hydrogen 3.004 N/A ASN 211.A ND2 PHE 180.A O no hydrogen 2.919 N/A ASN 211.A ND2 ARG 290.A O no hydrogen 2.825 N/A CYS 212.A N SER 209.A O no hydrogen 3.445 N/A LEU 213.A N.A ALA 178.A O no hydrogen 3.020 N/A LEU 213.A N.B ALA 178.A O no hydrogen 2.965 N/A ASN 214.A N GLU 217.A OE1 no hydrogen 2.960 N/A ASN 216.A N GLY 174.A O no hydrogen 3.312 N/A ASN 216.A ND2 GLY 174.A O no hydrogen 3.130 N/A GLU 217.A N ASN 214.A OD1 no hydrogen 2.874 N/A LEU 218.A N ASN 214.A O no hydrogen 2.952 N/A ALA 219.A N ILE 215.A O no hydrogen 2.890 N/A SER 220.A N ASN 216.A O no hydrogen 3.062 N/A SER 220.A OG ASN 216.A O no hydrogen 3.134 N/A VAL 221.A N GLU 217.A O no hydrogen 2.951 N/A TRP 222.A N LEU 218.A O no hydrogen 3.160 N/A TRP 222.A NE1 PRO 164.A O no hydrogen 2.879 N/A GLU 223.A N ALA 219.A O no hydrogen 2.981 N/A LYS 224.A N SER 220.A O no hydrogen 3.034 N/A LYS 225.A N VAL 221.A O no hydrogen 3.181 N/A ILE 226.A N TRP 222.A O no hydrogen 2.905 N/A GLY 227.A N GLU 223.A O no hydrogen 2.817 N/A ARG 228.A N GLU 223.A O no hydrogen 3.328 N/A ARG 228.A NH1 THR 165.A O no hydrogen 3.512 N/A ARG 228.A NH2 THR 165.A O no hydrogen 3.338 N/A LEU 230.A N GLU 223.A OE2 no hydrogen 2.952 N/A ARG 232.A NH1 ASN 216.A O no hydrogen 3.088 N/A ARG 232.A NH1 ASN 216.A OD1 no hydrogen 3.089 N/A ARG 232.A NH2 SER 220.A OG no hydrogen 2.980 N/A ARG 232.A NH2 GLU 223.A OE1 no hydrogen 2.878 N/A VAL 233.A N PHE 168.A O no hydrogen 2.910 N/A VAL 235.A N ILE 170.A O no hydrogen 2.759 N/A THR 236.A N ASP 239.A OD2 no hydrogen 3.027 N/A ASP 239.A N THR 236.A OG1 no hydrogen 3.012 N/A LEU 240.A N THR 236.A O no hydrogen 3.243 N/A LEU 241.A N GLU 237.A O no hydrogen 2.920 N/A ALA 242.A N ASP 238.A O no hydrogen 2.816 N/A ALA 243.A N ASP 239.A O no hydrogen 3.126 N/A ALA 244.A N LEU 240.A O no hydrogen 2.926 N/A GLY 245.A N LEU 241.A O no hydrogen 2.891 N/A GLU 246.A N ALA 243.A O no hydrogen 3.292 N/A ASN 247.A N ALA 244.A O no hydrogen 3.211 N/A ILE 248.A N SER 252.A OG no hydrogen 2.940 N/A GLN 251.A N GLN 251.A OE1 no hydrogen 2.782 N/A SER 252.A N ILE 248.A O no hydrogen 2.784 N/A SER 252.A OG ALA 243.A O no hydrogen 2.687 N/A SER 252.A OG ALA 244.A O no hydrogen 3.564 N/A SER 252.A OG ILE 248.A O no hydrogen 3.352 N/A VAL 254.A N PRO 250.A O no hydrogen 3.107 N/A ALA 255.A N GLN 251.A O no hydrogen 2.991 N/A ALA 256.A N SER 252.A O no hydrogen 2.997 N/A PHE 257.A N VAL 253.A O no hydrogen 3.006 N/A THR 258.A N VAL 254.A O no hydrogen 2.914 N/A THR 258.A OG1 VAL 254.A O no hydrogen 2.815 N/A HIS 259.A N ALA 255.A O no hydrogen 3.013 N/A HIS 259.A NE2 GLU 237.A OE2 no hydrogen 2.857 N/A ASP 260.A N ALA 256.A O no hydrogen 3.050 N/A ILE 261.A N PHE 257.A O no hydrogen 2.958 N/A PHE 262.A N THR 258.A O no hydrogen 2.848 N/A ILE 263.A N HIS 259.A O no hydrogen 2.920 N/A LYS 264.A N HIS 259.A O no hydrogen 3.123 N/A LYS 264.A NZ ASP 118.A O no hydrogen 2.894 N/A GLY 265.A N ILE 261.A O no hydrogen 3.211 N/A CYS 266.A N ASP 260.A O no hydrogen 2.988 N/A GLN 267.A NE2 TYR 179.A O no hydrogen 3.578 N/A VAL 268.A N GLY 265.A O no hydrogen 3.143 N/A ASP 273.A N SER 271.A OG no hydrogen 3.132 N/A ASP 277.A N GLY 274.A O no hydrogen 3.287 N/A VAL 278.A N SER 203.A O no hydrogen 2.904 N/A VAL 280.A N.A HIS 205.A O no hydrogen 2.936 N/A VAL 280.A N.B HIS 205.A O no hydrogen 2.958 N/A THR 281.A N GLU 279.A OE2 no hydrogen 3.027 N/A THR 281.A OG1 GLU 279.A OE1 no hydrogen 2.508 N/A THR 281.A OG1 GLU 279.A OE2 no hydrogen 3.457 N/A THR 282.A N GLU 279.A O no hydrogen 3.144 N/A THR 282.A N GLU 279.A OE1 no hydrogen 3.267 N/A THR 282.A OG1 GLU 279.A O no hydrogen 3.074 N/A LEU 283.A N GLU 279.A O no hydrogen 3.025 N/A TYR 284.A N VAL 280.A O.A no hydrogen 3.039 N/A TYR 284.A N VAL 280.A O.B no hydrogen 2.968 N/A TYR 284.A OH ASP 196.A OD2 no hydrogen 2.691 N/A ARG 290.A N ASP 185.A OD2 no hydrogen 2.741 N/A ARG 290.A NH1 THR 184.A OG1 no hydrogen 3.080 N/A ARG 290.A NH2 GLU 298.A OE2 no hydrogen 3.222 N/A GLU 294.A N THR 291.A OG1 no hydrogen 3.141 N/A CYS 295.A N THR 291.A O no hydrogen 2.969 N/A CYS 295.A SG THR 291.A O no hydrogen 3.451 N/A PHE 296.A N VAL 292.A O no hydrogen 2.693 N/A GLY 297.A N GLU 293.A O no hydrogen 2.903 N/A GLU 298.A N GLU 294.A O no hydrogen 3.362 N/A GLU 298.A N CYS 295.A O no hydrogen 3.154 N/A TYR 299.A N CYS 295.A O no hydrogen 3.378 N/A TYR 299.A OH ALA 153.A O no hydrogen 2.672 N/A ILE 300.A N PHE 296.A O no hydrogen 3.014 N/A VAL 301.A N GLY 297.A O no hydrogen 3.214 N/A LYS 302.A N ILE 300.A O no hydrogen 2.987 N/A