Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3g5w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N ASP 42.A OD2 no hydrogen 3.137 N/A LYS 2.A NZ ASP 43.A OD2 no hydrogen 2.645 N/A ARG 3.A N ASP 43.A O no hydrogen 2.880 N/A ARG 3.A NE ASP 42.A OD1 no hydrogen 2.766 N/A PHE 5.A N THR 45.A O no hydrogen 2.833 N/A LEU 7.A N ASN 47.A O no hydrogen 2.777 N/A SER 8.A N ASN 28.A OD1 no hydrogen 2.979 N/A SER 8.A OG GLU 10.A OE1 no hydrogen 2.576 N/A SER 8.A OG ASN 28.A OD1 no hydrogen 3.472 N/A ILE 9.A N THR 49.A O no hydrogen 2.884 N/A GLU 10.A N ALA 26.A O no hydrogen 2.932 N/A THR 12.A N THR 24.A O no hydrogen 2.806 N/A THR 12.A OG1 GLU 10.A O no hydrogen 2.941 N/A ARG 13.A N GLU 316.A O no hydrogen 2.717 N/A ARG 13.A NH1 ASP 21.A OD2 no hydrogen 3.045 N/A ARG 13.A NH1 ASN 152.A OD1 no hydrogen 2.775 N/A ILE 14.A N PHE 22.A O no hydrogen 3.057 N/A LEU 16.A N ARG 20.A O no hydrogen 2.797 N/A GLY 18.A N GLU 176.A OE2 no hydrogen 2.742 N/A ARG 20.A N VAL 17.A O no hydrogen 2.787 N/A ARG 20.A NH1 ASP 21.A O no hydrogen 2.836 N/A PHE 22.A N ILE 14.A O no hydrogen 2.787 N/A HIS 23.A N ALA 151.A O no hydrogen 2.884 N/A THR 24.A N THR 12.A O no hydrogen 2.781 N/A THR 24.A OG1 THR 12.A O no hydrogen 2.815 N/A PHE 25.A N ARG 115.A O no hydrogen 2.968 N/A ALA 26.A N GLU 10.A O no hydrogen 2.800 N/A ASN 28.A N SER 8.A O no hydrogen 2.732 N/A ASN 28.A ND2 ASP 6.A O no hydrogen 3.699 N/A ASN 28.A ND2 ASN 309.A OD1 no hydrogen 2.889 N/A GLY 29.A N ALA 26.A O no hydrogen 3.205 N/A GLN 30.A N PHE 27.A O no hydrogen 3.173 N/A VAL 31.A N PHE 313.A O no hydrogen 2.984 N/A ALA 33.A N TRP 118.A O no hydrogen 2.816 N/A LEU 35.A N HIS 308.A O no hydrogen 3.080 N/A ILE 36.A N PRO 120.A O no hydrogen 3.152 N/A HIS 37.A N GLY 306.A O no hydrogen 2.857 N/A HIS 37.A ND1 ILE 122.A O no hydrogen 3.254 N/A VAL 38.A N ILE 122.A O no hydrogen 3.069 N/A MET 39.A N ASP 42.A OD1 no hydrogen 2.944 N/A GLU 40.A N GLU 124.A O no hydrogen 2.794 N/A GLY 41.A N ALA 94.A O no hydrogen 2.804 N/A ASP 42.A N MET 39.A O no hydrogen 2.960 N/A ASP 43.A N GLU 1.A O no hydrogen 2.890 N/A VAL 44.A N PHE 92.A O no hydrogen 2.802 N/A THR 45.A N ARG 3.A O no hydrogen 2.827 N/A VAL 46.A N TYR 90.A O no hydrogen 2.782 N/A ASN 47.A N PHE 5.A O no hydrogen 2.915 N/A ASN 47.A ND2 GLU 4.A OE2 no hydrogen 2.783 N/A ASN 47.A ND2 PHE 5.A O no hydrogen 3.626 N/A ASN 47.A ND2 ASP 6.A OD1 no hydrogen 2.903 N/A VAL 48.A N PHE 88.A O no hydrogen 2.815 N/A THR 49.A N LEU 7.A O no hydrogen 2.827 N/A THR 49.A OG1 THR 87.A OG1 no hydrogen 2.781 N/A ASN 50.A N ASP 86.A O no hydrogen 3.011 N/A ASN 50.A ND2 THR 52.A OG1 no hydrogen 2.783 N/A MET 51.A N ILE 9.A O no hydrogen 2.915 N/A THR 52.A OG1 HIS 56.A NE2 no hydrogen 2.849 N/A LEU 54.A N THR 52.A OG1 no hydrogen 3.332 N/A HIS 56.A N ILE 82.A O no hydrogen 3.235 N/A HIS 56.A NE2 THR 52.A OG1 no hydrogen 2.849 N/A THR 57.A OG1 GLY 73.A O no hydrogen 2.803 N/A ILE 58.A N TYR 90.A OH no hydrogen 2.977 N/A HIS 59.A N HIS 103.A O no hydrogen 2.738 N/A HIS 59.A ND1 ASP 72.A O no hydrogen 2.727 N/A HIS 61.A N TRP 101.A O no hydrogen 2.800 N/A MET 63.A N TRP 60.A O no hydrogen 3.058 N/A LEU 64.A N GLU 95.A O no hydrogen 3.172 N/A GLN 65.A NE2 THR 68.A OG1 no hydrogen 2.702 N/A THR 68.A N GLN 65.A O no hydrogen 3.026 N/A SER 71.A N THR 68.A O no hydrogen 2.841 N/A SER 71.A OG LYS 91.A O no hydrogen 3.287 N/A ASP 72.A N TRP 69.A O no hydrogen 3.000 N/A VAL 74.A N THR 78.A OG1 no hydrogen 3.052 N/A HIS 76.A N GLN 79.A O no hydrogen 3.021 N/A ALA 77.A N VAL 74.A O no hydrogen 3.286 N/A THR 78.A N VAL 74.A O no hydrogen 2.897 N/A THR 78.A OG1 VAL 74.A O no hydrogen 3.374 N/A GLN 79.A N VAL 74.A O no hydrogen 3.372 N/A GLN 79.A NE2 TYR 90.A OH no hydrogen 2.765 N/A ILE 82.A N HIS 56.A O no hydrogen 2.776 N/A GLY 85.A N ASN 50.A O no hydrogen 2.628 N/A ASP 86.A N GLU 83.A O no hydrogen 3.020 N/A THR 87.A OG1 THR 49.A OG1 no hydrogen 2.781 N/A PHE 88.A N VAL 48.A O no hydrogen 2.910 N/A THR 89.A OG1 ASN 47.A OD1 no hydrogen 2.640 N/A TYR 90.A N VAL 46.A O no hydrogen 2.821 N/A LYS 91.A N SER 71.A OG no hydrogen 3.052 N/A LYS 91.A NZ THR 45.A OG1 no hydrogen 3.066 N/A PHE 92.A N VAL 44.A O no hydrogen 3.000 N/A LYS 93.A NZ GLY 41.A O no hydrogen 3.314 N/A LYS 93.A NZ ASP 43.A OD1 no hydrogen 2.857 N/A ALA 94.A N ASP 42.A O no hydrogen 2.787 N/A GLY 98.A N VAL 123.A O no hydrogen 2.816 N/A THR 99.A OG1 ASP 237.A OD1 no hydrogen 2.881 N/A THR 99.A OG1 ASP 237.A OD2 no hydrogen 2.834 N/A MET 100.A N LEU 121.A O no hydrogen 2.869 N/A TRP 101.A N HIS 61.A O no hydrogen 3.329 N/A TYR 102.A N GLY 119.A O no hydrogen 2.943 N/A TYR 102.A OH PRO 34.A O no hydrogen 2.562 N/A HIS 103.A N HIS 59.A O no hydrogen 3.104 N/A HIS 103.A ND1 CYS 104.A O no hydrogen 2.797 N/A CYS 104.A N MET 117.A O no hydrogen 3.229 N/A CYS 104.A SG HIS 56.A ND1 no hydrogen 3.827 N/A CYS 104.A SG THR 57.A O no hydrogen 3.527 N/A CYS 104.A SG HIS 111.A ND1 no hydrogen 3.937 N/A HIS 105.A N THR 57.A OG1 no hydrogen 3.089 N/A HIS 105.A ND1 HIS 105.A O no hydrogen 2.953 N/A ASN 109.A ND2 GLY 158.A O no hydrogen 2.867 N/A GLU 110.A N ASN 107.A O no hydrogen 2.897 N/A HIS 111.A N ASN 107.A O no hydrogen 2.908 N/A VAL 112.A N VAL 108.A O no hydrogen 3.112 N/A THR 113.A N VAL 108.A O no hydrogen 3.244 N/A THR 113.A OG1 VAL 108.A O no hydrogen 3.493 N/A THR 113.A OG1 ASN 109.A O no hydrogen 3.487 N/A MET 114.A N GLU 110.A O no hydrogen 2.917 N/A ARG 115.A N HIS 111.A O no hydrogen 3.248 N/A ARG 115.A NE GLU 110.A OE2 no hydrogen 2.802 N/A ARG 115.A NH1 TRP 150.A O no hydrogen 2.797 N/A ARG 115.A NH1 GLU 156.A O no hydrogen 3.046 N/A ARG 115.A NH2 HIS 23.A O no hydrogen 2.942 N/A ARG 115.A NH2 TRP 150.A O no hydrogen 3.173 N/A ARG 115.A NH2 ALA 151.A O no hydrogen 3.240 N/A GLY 119.A N TYR 102.A O no hydrogen 3.000 N/A LEU 121.A N MET 100.A O no hydrogen 2.902 N/A ILE 122.A N ILE 36.A O no hydrogen 2.783 N/A VAL 123.A N GLY 98.A O no hydrogen 3.082 N/A GLU 124.A N VAL 38.A O no hydrogen 2.863 N/A LYS 126.A N GLU 40.A OE1 no hydrogen 3.086 N/A LYS 126.A NZ GLU 40.A O no hydrogen 3.535 N/A LEU 129.A N GLU 132.A OE1 no hydrogen 2.907 N/A LYS 133.A N LEU 129.A O no hydrogen 3.297 N/A LYS 133.A N PRO 130.A O no hydrogen 3.103 N/A THR 134.A N ILE 131.A O no hydrogen 3.193 N/A THR 134.A OG1 ILE 131.A O no hydrogen 2.637 N/A VAL 135.A N GLU 132.A O no hydrogen 3.285 N/A THR 136.A N VAL 187.A O no hydrogen 2.741 N/A THR 136.A OG1 ASP 186.A OD1 no hydrogen 2.708 N/A THR 136.A OG1 VAL 187.A O no hydrogen 3.138 N/A LYS 137.A N VAL 187.A O no hydrogen 3.288 N/A LYS 137.A NZ TYR 139.A OH no hydrogen 3.272 N/A LYS 137.A NZ ARG 181.A O no hydrogen 2.705 N/A TYR 139.A N ARG 189.A O no hydrogen 2.866 N/A ILE 140.A N TYR 296.A O no hydrogen 2.971 N/A LEU 141.A N ARG 191.A O no hydrogen 2.928 N/A MET 142.A N ASN 170.A OD1 no hydrogen 2.760 N/A LEU 143.A N ILE 193.A O no hydrogen 2.927 N/A SER 144.A N THR 168.A O no hydrogen 3.128 N/A TRP 146.A N TYR 166.A O no hydrogen 2.754 N/A TRP 146.A NE1 THR 168.A OG1 no hydrogen 2.810 N/A SER 148.A N ASP 165.A OD1 no hydrogen 2.940 N/A SER 148.A OG ASP 165.A OD1 no hydrogen 3.341 N/A SER 148.A OG ASP 165.A OD2 no hydrogen 2.552 N/A TRP 150.A N VAL 147.A O no hydrogen 3.125 N/A TRP 150.A NE1 ASP 162.A OD1 no hydrogen 2.671 N/A ALA 151.A N SER 148.A O no hydrogen 3.019 N/A ASN 152.A ND2 ASP 21.A OD1 no hydrogen 3.415 N/A LYS 153.A N TRP 150.A O no hydrogen 3.009 N/A GLY 155.A N GLU 110.A OE2 no hydrogen 2.740 N/A GLU 156.A N LYS 153.A O no hydrogen 3.071 N/A GLY 158.A N ASP 162.A OD2 no hydrogen 2.895 N/A ILE 159.A N ASP 162.A OD2 no hydrogen 2.996 N/A ASP 162.A N ILE 159.A O no hydrogen 3.136 N/A ASP 165.A N TRP 146.A O no hydrogen 3.008 N/A TYR 166.A N TRP 146.A O no hydrogen 3.373 N/A THR 168.A N SER 144.A O no hydrogen 2.956 N/A ILE 169.A N LYS 172.A O no hydrogen 2.951 N/A ASN 170.A N MET 142.A O no hydrogen 2.836 N/A ASN 170.A ND2 ILE 140.A O no hydrogen 2.956 N/A ASN 170.A ND2 PHE 295.A O no hydrogen 2.889 N/A LYS 172.A N ILE 169.A O no hydrogen 3.134 N/A LYS 172.A NZ VAL 15.A O no hydrogen 2.845 N/A SER 173.A N LEU 16.A O no hydrogen 3.161 N/A SER 173.A OG TYR 167.A O no hydrogen 2.841 N/A PHE 174.A N GLY 267.A O no hydrogen 2.889 N/A GLU 176.A N SER 173.A O no hydrogen 2.733 N/A THR 177.A OG1 MET 269.A O no hydrogen 2.770 N/A ILE 180.A N THR 271.A O no hydrogen 2.853 N/A ARG 181.A NE GLU 273.A OE2 no hydrogen 2.891 N/A VAL 182.A N GLU 273.A O no hydrogen 2.911 N/A LYS 183.A N ASP 186.A OD2 no hydrogen 2.930 N/A LYS 184.A N GLU 276.A OE1 no hydrogen 2.902 N/A LYS 184.A N GLU 276.A OE2 no hydrogen 3.241 N/A LYS 184.A NZ ASP 243.A O no hydrogen 3.017 N/A GLY 185.A N MET 242.A O no hydrogen 2.939 N/A ASP 186.A N LYS 183.A O no hydrogen 3.103 N/A VAL 187.A N THR 136.A OG1 no hydrogen 2.939 N/A ILE 188.A N LEU 240.A O no hydrogen 2.941 N/A ARG 189.A N LYS 137.A O no hydrogen 2.970 N/A ARG 189.A NE ASP 237.A OD1 no hydrogen 2.834 N/A ARG 189.A NH1 ASP 237.A OD1 no hydrogen 2.762 N/A ARG 189.A NH2 GLU 132.A OE2 no hydrogen 2.977 N/A LEU 190.A N VAL 238.A O no hydrogen 2.756 N/A ARG 191.A N TYR 139.A O no hydrogen 2.708 N/A ARG 191.A NE ASP 138.A OD1 no hydrogen 2.770 N/A ARG 191.A NE ASP 138.A OD2 no hydrogen 3.244 N/A ARG 191.A NH1 THR 99.A OG1 no hydrogen 2.885 N/A ARG 191.A NH2 ASP 138.A OD2 no hydrogen 2.962 N/A LEU 192.A N TYR 236.A O no hydrogen 2.820 N/A ILE 193.A N LEU 141.A O no hydrogen 2.965 N/A GLY 194.A N GLU 234.A O no hydrogen 3.023 N/A ALA 195.A N ILE 193.A O no hydrogen 3.057 N/A HIS 198.A N ASP 145.A OD2 no hydrogen 3.051 N/A HIS 198.A ND1 HIS 257.A NE2 no hydrogen 2.971 N/A HIS 200.A N ILE 230.A O no hydrogen 2.848 N/A HIS 200.A ND1 ASP 252.A OD2 no hydrogen 2.902 N/A ALA 201.A N ASP 252.A OD1 no hydrogen 2.919 N/A ILE 202.A N VAL 228.A O no hydrogen 2.897 N/A HIS 203.A N HIS 251.A O no hydrogen 2.851 N/A HIS 203.A ND1 ASP 226.A O no hydrogen 2.856 N/A THR 204.A N ASP 226.A O no hydrogen 3.170 N/A HIS 205.A N MET 249.A O no hydrogen 2.921 N/A SER 209.A N GLY 225.A O no hydrogen 2.807 N/A GLN 210.A N ILE 239.A O no hydrogen 3.075 N/A ILE 211.A N ILE 223.A O no hydrogen 2.813 N/A ALA 212.A N ASP 237.A O no hydrogen 2.953 N/A PHE 213.A N ASP 237.A O no hydrogen 3.452 N/A LYS 214.A N PHE 217.A O no hydrogen 2.908 N/A LYS 214.A NZ ASP 215.A OD1 no hydrogen 2.994 N/A LYS 214.A NZ ASP 215.A OD2 no hydrogen 3.208 N/A LYS 214.A NZ GLU 234.A OE2 no hydrogen 2.662 N/A ASP 215.A N ARG 235.A O no hydrogen 2.794 N/A PHE 217.A N LYS 214.A O no hydrogen 2.845 N/A LEU 219.A N ALA 212.A O no hydrogen 3.025 N/A ILE 223.A N ILE 211.A O no hydrogen 2.961 N/A GLY 225.A N SER 209.A O no hydrogen 2.985 N/A THR 227.A OG1 HIS 203.A ND1 no hydrogen 3.199 N/A THR 227.A OG1 ASP 226.A OD1 no hydrogen 2.828 N/A VAL 228.A N ILE 202.A O no hydrogen 2.897 N/A ILE 230.A N HIS 200.A O no hydrogen 2.763 N/A GLY 231.A N GLU 234.A OE1 no hydrogen 2.829 N/A GLY 233.A N GLY 194.A O no hydrogen 2.831 N/A GLU 234.A N GLY 231.A O no hydrogen 3.074 N/A ARG 235.A N ASP 215.A OD2 no hydrogen 3.150 N/A ARG 235.A NE THR 99.A O no hydrogen 2.954 N/A ARG 235.A NH1 GLY 233.A O no hydrogen 2.913 N/A TYR 236.A N LEU 192.A O no hydrogen 3.039 N/A TYR 236.A OH GLU 234.A OE2 no hydrogen 3.009 N/A ASP 237.A N PHE 213.A O no hydrogen 3.060 N/A VAL 238.A N LEU 190.A O no hydrogen 2.860 N/A ILE 239.A N GLN 210.A O no hydrogen 2.884 N/A LEU 240.A N ILE 188.A O no hydrogen 2.889 N/A MET 242.A N ASP 186.A O no hydrogen 2.799 N/A ASP 243.A N ASN 241.A O no hydrogen 3.055 N/A ASN 244.A N TYR 274.A OH no hydrogen 3.091 N/A TRP 248.A N ILE 272.A O no hydrogen 2.987 N/A TRP 248.A NE1 ASN 244.A O no hydrogen 2.765 N/A ILE 250.A N THR 270.A O no hydrogen 2.997 N/A HIS 251.A N HIS 203.A O no hydrogen 3.014 N/A HIS 251.A ND1 ASP 252.A O no hydrogen 2.872 N/A ASP 252.A N ILE 268.A O no hydrogen 3.018 N/A HIS 253.A N ALA 201.A O no hydrogen 2.655 N/A VAL 254.A N ASP 252.A OD1 no hydrogen 2.955 N/A HIS 257.A N VAL 254.A O no hydrogen 2.867 N/A HIS 257.A ND1 ASP 252.A OD2 no hydrogen 2.621 N/A HIS 257.A NE2 HIS 198.A ND1 no hydrogen 2.971 N/A THR 258.A N ASP 255.A O no hydrogen 3.222 N/A THR 258.A OG1 ASP 255.A O no hydrogen 2.730 N/A THR 259.A OG1 THR 256.A O no hydrogen 3.257 N/A ASN 260.A N LYS 263.A O no hydrogen 2.888 N/A ASN 260.A ND2 PHE 174.A O no hydrogen 2.864 N/A GLY 261.A N ASP 165.A O no hydrogen 3.063 N/A LYS 263.A N ASN 260.A O no hydrogen 2.967 N/A LYS 263.A NZ ASN 260.A O no hydrogen 3.113 N/A GLY 266.A N THR 258.A O no hydrogen 2.806 N/A GLY 267.A N ASN 260.A OD1 no hydrogen 2.919 N/A ILE 268.A N HIS 257.A O no hydrogen 3.005 N/A THR 270.A N ILE 250.A O no hydrogen 2.842 N/A THR 270.A OG1 GLN 178.A O no hydrogen 2.605 N/A THR 271.A N THR 270.A OG1 no hydrogen 2.753 N/A THR 271.A OG1 TYR 284.A OH no hydrogen 2.773 N/A ILE 272.A N TRP 248.A O no hydrogen 2.661 N/A GLU 273.A N ILE 180.A O no hydrogen 2.879 N/A TYR 274.A N GLY 246.A O no hydrogen 3.350 N/A GLU 275.A N VAL 182.A O no hydrogen 2.932 N/A GLU 276.A N GLU 276.A OE2 no hydrogen 2.915 N/A VAL 277.A N TYR 274.A O no hydrogen 3.305 N/A GLY 278.A N TYR 274.A O no hydrogen 3.396 N/A HIS 281.A N ILE 279.A O no hydrogen 2.910 N/A HIS 281.A NE2 VAL 277.A O no hydrogen 3.145 N/A HIS 281.A NE2 GLY 278.A O no hydrogen 3.131 N/A TYR 284.A N HIS 281.A O no hydrogen 2.999 N/A TYR 284.A OH THR 271.A OG1 no hydrogen 2.773 N/A TYR 284.A OH GLU 273.A OE1 no hydrogen 2.496 N/A LYS 287.A N TYR 284.A O no hydrogen 3.115 N/A LYS 287.A NZ ASP 288.A OD2 no hydrogen 3.126 N/A LYS 289.A N TRP 286.A O no hydrogen 3.329 N/A LYS 289.A NZ PRO 175.A O no hydrogen 3.240 N/A LYS 289.A NZ THR 177.A O no hydrogen 2.961 N/A VAL 292.A N GLN 178.A OE1 no hydrogen 2.891 N/A ASP 294.A N GLU 298.A OE1 no hydrogen 2.822 N/A TYR 296.A N GLU 298.A OE2 no hydrogen 3.015 N/A TYR 296.A OH GLN 178.A O no hydrogen 2.553 N/A TYR 297.A N ASP 294.A O no hydrogen 3.062 N/A TYR 297.A OH GLN 30.A OE1 no hydrogen 2.858 N/A TYR 297.A OH ALA 33.A O no hydrogen 2.788 N/A GLU 298.A N GLU 298.A OE2 no hydrogen 2.891 N/A GLU 299.A N ASP 294.A OD1 no hydrogen 2.892 N/A SER 300.A N ASP 294.A OD1 no hydrogen 2.809 N/A SER 300.A OG ASP 294.A OD2 no hydrogen 2.578 N/A LEU 301.A N TYR 297.A O no hydrogen 2.977 N/A LYS 302.A N GLU 299.A O no hydrogen 3.168 N/A LYS 302.A NZ GLU 299.A OE2 no hydrogen 3.375 N/A LYS 303.A N SER 300.A O no hydrogen 3.054 N/A GLY 306.A N HIS 37.A O no hydrogen 2.644 N/A HIS 308.A N LEU 35.A O no hydrogen 2.755 N/A HIS 308.A NE2 ASP 304.A O no hydrogen 2.934 N/A VAL 312.A N SER 310.A OG no hydrogen 3.040 N/A PHE 313.A N SER 310.A O no hydrogen 3.241 N/A GLY 315.A N GLY 29.A O no hydrogen 2.922 N/A GLU 316.A N ARG 13.A O no hydrogen 2.927 N/A ILE 318.A N ASP 11.A O no hydrogen 3.020 N/A