Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hdw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N THR 34.A OG1 no hydrogen 2.635 N/A MET 2.A N THR 34.A OG1 no hydrogen 2.853 N/A THR 7.A N GLU 91.A OE2 no hydrogen 2.852 N/A GLU 9.A N THR 7.A OG1 no hydrogen 3.126 N/A TRP 10.A NE1 PHE 14.A O no hydrogen 2.829 N/A LYS 12.A NZ ASP 38.A OD1 no hydrogen 2.900 N/A LYS 12.A NZ ASP 38.A OD2 no hydrogen 3.226 N/A THR 13.A N GLU 64.A O no hydrogen 2.951 N/A THR 13.A OG1 GLU 64.A O no hydrogen 2.690 N/A SER 17.A OG GLU 76.A OE2 no hydrogen 2.435 N/A LYS 19.A N SER 17.A OG no hydrogen 3.159 N/A VAL 20.A N SER 17.A O no hydrogen 3.321 N/A GLU 21.A N LEU 41.A O no hydrogen 2.934 N/A HIS 22.A NE2 ASP 38.A OD1 no hydrogen 2.716 N/A ARG 23.A N LEU 39.A O no hydrogen 3.329 N/A LYS 24.A NZ THR 7.A O no hydrogen 3.055 N/A LYS 24.A NZ GLU 91.A OE1 no hydrogen 2.695 N/A VAL 25.A N ALA 37.A O no hydrogen 2.856 N/A PHE 27.A N LEU 35.A O no hydrogen 3.128 N/A ASN 29.A N ILE 33.A O no hydrogen 2.820 N/A ASN 29.A ND2 ASP 108.A OD1 no hydrogen 3.020 N/A ARG 30.A N GLU 107.A OE2 no hydrogen 2.935 N/A ARG 30.A NE GLU 107.A OE1 no hydrogen 2.937 N/A TYR 31.A N ASN 29.A OD1 no hydrogen 2.870 N/A TYR 31.A OH ASP 103.A OD1 no hydrogen 2.694 N/A GLY 32.A N ASN 29.A O no hydrogen 3.059 N/A ILE 33.A N ASN 29.A OD1 no hydrogen 2.948 N/A LEU 35.A N PHE 27.A O no hydrogen 2.670 N/A ALA 36.A N SER 92.A OG no hydrogen 2.860 N/A ALA 37.A N VAL 25.A O no hydrogen 2.887 N/A ASP 38.A N ALA 83.A O no hydrogen 2.753 N/A LEU 39.A N ARG 23.A O no hydrogen 2.979 N/A TYR 40.A N THR 81.A O no hydrogen 2.791 N/A LEU 41.A N GLU 21.A O no hydrogen 3.062 N/A ARG 45.A NH1 GLU 21.A OE2 no hydrogen 3.286 N/A ARG 45.A NH1 PRO 42.A O no hydrogen 2.665 N/A ARG 49.A NH1 VAL 122.A O no hydrogen 2.862 N/A LEU 50.A N GLU 121.A O no hydrogen 2.875 N/A ALA 52.A N ARG 126.A O no hydrogen 2.794 N/A ILE 53.A N VAL 80.A O no hydrogen 2.961 N/A VAL 54.A N GLY 128.A O no hydrogen 2.992 N/A ILE 55.A N LEU 82.A O no hydrogen 2.890 N/A GLY 56.A N ILE 130.A O no hydrogen 3.168 N/A ALA 61.A N PRO 58.A O no hydrogen 3.080 N/A VAL 62.A N GLN 65.A OE1 no hydrogen 2.866 N/A LYS 63.A N ASP 85.A OD1 no hydrogen 2.833 N/A LYS 63.A NZ GLU 64.A OE2 no hydrogen 2.738 N/A LYS 63.A NZ ASP 85.A OD2 no hydrogen 2.664 N/A LYS 63.A NZ GLU 91.A OE1 no hydrogen 2.689 N/A GLU 64.A N GLU 64.A OE1 no hydrogen 2.692 N/A GLN 65.A N VAL 62.A O no hydrogen 2.925 N/A GLN 65.A NE2 GLY 226.A O no hydrogen 2.740 N/A GLN 65.A NE2 SER 234.A OG no hydrogen 3.339 N/A SER 66.A OG TYR 302.A O no hydrogen 2.673 N/A LEU 69.A N GLN 65.A O no hydrogen 3.257 N/A TYR 70.A N SER 66.A O no hydrogen 2.944 N/A TYR 70.A OH SER 155.A OG no hydrogen 2.857 N/A TYR 70.A OH LEU 301.A O no hydrogen 2.592 N/A ALA 71.A N SER 67.A O no hydrogen 2.849 N/A GLN 72.A N GLY 68.A O no hydrogen 2.932 N/A THR 73.A N LEU 69.A O no hydrogen 3.080 N/A THR 73.A OG1 LEU 69.A O no hydrogen 2.649 N/A MET 74.A N TYR 70.A O no hydrogen 2.873 N/A ALA 75.A N ALA 71.A O no hydrogen 2.965 N/A GLU 76.A N GLN 72.A O no hydrogen 3.039 N/A GLU 76.A N THR 73.A O no hydrogen 3.139 N/A ARG 77.A N MET 74.A O no hydrogen 2.919 N/A ARG 77.A NH1 ASP 311.A OD1 no hydrogen 3.017 N/A GLY 78.A N ALA 75.A O no hydrogen 3.218 N/A PHE 79.A N MET 74.A O no hydrogen 3.237 N/A VAL 80.A N PRO 51.A O no hydrogen 3.188 N/A THR 81.A N TYR 40.A O no hydrogen 2.759 N/A THR 81.A OG1 ALA 71.A O no hydrogen 2.596 N/A LEU 82.A N ILE 53.A O no hydrogen 3.235 N/A ALA 83.A N ASP 38.A O no hydrogen 2.929 N/A ASP 85.A N ALA 36.A O no hydrogen 2.886 N/A SER 87.A N ASP 108.A OD2 no hydrogen 2.974 N/A SER 87.A OG ASP 108.A OD1 no hydrogen 2.702 N/A SER 87.A OG ASP 108.A OD2 no hydrogen 3.486 N/A TYR 88.A N GLY 93.A O no hydrogen 2.944 N/A THR 89.A N PRO 86.A O no hydrogen 3.056 N/A THR 89.A OG1 PRO 86.A O no hydrogen 2.781 N/A GLU 91.A N ASP 85.A OD2 no hydrogen 2.935 N/A SER 92.A N THR 89.A O no hydrogen 3.004 N/A SER 92.A OG ASP 85.A O no hydrogen 2.564 N/A GLY 93.A N THR 34.A O no hydrogen 2.806 N/A ARG 97.A NH1 SER 92.A O no hydrogen 2.729 N/A ARG 97.A NH1 GLY 94.A O no hydrogen 2.953 N/A ARG 97.A NH2 SER 92.A O no hydrogen 3.077 N/A ASN 98.A N TYR 88.A O no hydrogen 2.736 N/A ASN 98.A ND2 ALA 237.A O no hydrogen 3.396 N/A ILE 104.A N SER 101.A OG no hydrogen 3.076 N/A ASN 105.A N SER 101.A O no hydrogen 2.874 N/A THR 106.A N PRO 102.A O no hydrogen 3.056 N/A THR 106.A OG1 PRO 102.A O no hydrogen 2.635 N/A THR 106.A OG1 ASN 141.A OD1 no hydrogen 2.852 N/A GLU 107.A N ASP 103.A O no hydrogen 2.979 N/A ASP 108.A N ILE 104.A O no hydrogen 2.896 N/A PHE 109.A N THR 106.A O no hydrogen 3.233 N/A SER 110.A OG ASP 146.A OD2 no hydrogen 2.802 N/A ALA 111.A N GLU 107.A O no hydrogen 2.840 N/A ALA 112.A N ASP 108.A O no hydrogen 2.983 N/A VAL 113.A N PHE 109.A O no hydrogen 3.074 N/A ASP 114.A N SER 110.A O no hydrogen 2.915 N/A PHE 115.A N ALA 111.A O no hydrogen 3.280 N/A ILE 116.A N ALA 112.A O no hydrogen 3.023 N/A SER 117.A N VAL 113.A O no hydrogen 3.012 N/A SER 117.A OG VAL 113.A O no hydrogen 2.552 N/A LEU 118.A N PHE 115.A O no hydrogen 3.105 N/A LEU 119.A N ILE 116.A O no hydrogen 3.366 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.668 N/A VAL 122.A N LEU 119.A O no hydrogen 3.097 N/A ASN 123.A N LEU 50.A O no hydrogen 2.923 N/A GLU 125.A N ASN 123.A OD1 no hydrogen 2.848 N/A ARG 126.A N ASN 123.A O no hydrogen 2.754 N/A ARG 126.A NE LEU 321.A O no hydrogen 2.468 N/A GLY 128.A N ALA 52.A O no hydrogen 2.869 N/A VAL 129.A N ALA 151.A O no hydrogen 3.269 N/A ILE 130.A N VAL 54.A O no hydrogen 2.909 N/A GLY 131.A N VAL 153.A O no hydrogen 2.920 N/A ILE 132.A N GLY 56.A O no hydrogen 2.948 N/A CYS 133.A N SER 155.A O no hydrogen 2.848 N/A CYS 133.A SG HIS 298.A NE2 no hydrogen 3.646 N/A CYS 133.A SG TYR 302.A OH no hydrogen 3.064 N/A TRP 135.A N ILE 132.A O no hydrogen 2.884 N/A GLY 136.A N CYS 133.A O no hydrogen 2.861 N/A ALA 139.A N TRP 135.A O no hydrogen 2.770 N/A LEU 140.A N GLY 136.A O no hydrogen 3.232 N/A ASN 141.A N GLY 137.A O no hydrogen 3.052 N/A ALA 142.A N MET 138.A O no hydrogen 2.852 N/A VAL 143.A N ALA 139.A O no hydrogen 2.977 N/A ALA 144.A N LEU 140.A O no hydrogen 3.234 N/A VAL 145.A N ALA 142.A O no hydrogen 3.330 N/A ASP 146.A N ALA 142.A O no hydrogen 2.895 N/A LYS 147.A NZ ALA 144.A O no hydrogen 2.793 N/A ARG 148.A N ASP 146.A OD1 no hydrogen 3.172 N/A ARG 148.A NE ASP 146.A OD1 no hydrogen 2.865 N/A ARG 148.A NH1 ASP 114.A OD1 no hydrogen 2.662 N/A ARG 148.A NH2 SER 110.A O no hydrogen 3.287 N/A ARG 148.A NH2 ASP 114.A OD1 no hydrogen 2.928 N/A ARG 148.A NH2 ASP 146.A OD2 no hydrogen 2.852 N/A VAL 149.A N ASP 146.A O no hydrogen 3.272 N/A LYS 150.A N ILE 127.A O no hydrogen 2.821 N/A LYS 150.A NZ GLU 125.A O no hydrogen 2.799 N/A LYS 150.A NZ GLU 125.A OE1 no hydrogen 2.739 N/A LYS 150.A NZ ARG 148.A O no hydrogen 3.552 N/A VAL 152.A N PRO 262.A O no hydrogen 3.250 N/A VAL 153.A N VAL 129.A O no hydrogen 3.105 N/A THR 154.A N LEU 264.A O no hydrogen 3.030 N/A SER 155.A N GLY 131.A O no hydrogen 2.805 N/A SER 155.A OG TYR 70.A OH no hydrogen 2.857 N/A THR 156.A N ILE 266.A O no hydrogen 2.816 N/A THR 156.A OG1 HIS 267.A NE2 no hydrogen 3.371 N/A TYR 158.A N CYS 133.A O no hydrogen 2.952 N/A TYR 158.A OH TYR 168.A OH no hydrogen 2.509 N/A TYR 158.A OH TYR 217.A OH no hydrogen 2.719 N/A TYR 158.A OH HIS 272.A NE2 no hydrogen 2.767 N/A THR 161.A N ASP 159.A OD1 no hydrogen 2.956 N/A THR 161.A OG1 ASP 159.A OD1 no hydrogen 2.757 N/A ARG 162.A N ASP 159.A OD1 no hydrogen 3.082 N/A VAL 163.A N ASP 159.A O no hydrogen 3.056 N/A MET 164.A N MET 160.A O no hydrogen 3.123 N/A SER 165.A N THR 161.A O no hydrogen 3.022 N/A SER 165.A OG THR 161.A O no hydrogen 2.756 N/A SER 165.A OG PHE 246.A O no hydrogen 3.502 N/A LYS 166.A N ARG 162.A O no hydrogen 2.750 N/A GLY 167.A N VAL 163.A O no hydrogen 2.805 N/A TYR 168.A OH TYR 158.A OH no hydrogen 2.509 N/A ASN 169.A N TYR 275.A OH no hydrogen 2.799 N/A SER 171.A OG TYR 168.A O no hydrogen 3.271 N/A VAL 172.A N LYS 166.A O no hydrogen 3.058 N/A THR 173.A N GLN 176.A OE1 no hydrogen 2.980 N/A GLN 176.A N THR 173.A OG1 no hydrogen 3.215 N/A ARG 177.A N THR 173.A O no hydrogen 2.772 N/A ARG 177.A NH1 MET 247.A O no hydrogen 3.077 N/A ARG 177.A NH2 MET 247.A O no hydrogen 2.742 N/A THR 178.A N LEU 174.A O no hydrogen 2.743 N/A THR 178.A OG1 LEU 174.A O no hydrogen 2.743 N/A ARG 179.A N GLU 175.A O no hydrogen 2.997 N/A ARG 179.A NE GLU 175.A OE2 no hydrogen 2.960 N/A ARG 179.A NH2 GLU 175.A OE1 no hydrogen 2.719 N/A ARG 179.A NH2 GLU 175.A OE2 no hydrogen 2.736 N/A THR 180.A N GLN 176.A O no hydrogen 2.973 N/A THR 180.A OG1 GLN 176.A O no hydrogen 3.098 N/A LEU 181.A N ARG 177.A O no hydrogen 2.951 N/A GLU 182.A N THR 178.A O no hydrogen 2.884 N/A GLN 183.A N ARG 179.A O no hydrogen 3.059 N/A LEU 184.A N THR 180.A O no hydrogen 2.911 N/A GLY 185.A N LEU 181.A O no hydrogen 2.965 N/A GLN 186.A N GLU 182.A O no hydrogen 3.190 N/A GLN 187.A N GLN 183.A O no hydrogen 2.952 N/A GLN 187.A NE2 ASP 191.A OD1 no hydrogen 2.986 N/A ARG 188.A N LEU 184.A O no hydrogen 2.909 N/A TRP 189.A N GLY 185.A O no hydrogen 3.361 N/A LYS 190.A N GLN 186.A O no hydrogen 3.198 N/A ASP 191.A N GLN 187.A O no hydrogen 2.859 N/A ALA 192.A N ARG 188.A O no hydrogen 2.837 N/A GLU 193.A N TRP 189.A O no hydrogen 2.842 N/A SER 194.A N LYS 190.A O no hydrogen 3.227 N/A SER 194.A N ASP 191.A O no hydrogen 3.238 N/A SER 194.A OG LYS 190.A O no hydrogen 3.547 N/A SER 194.A OG ASP 191.A O no hydrogen 3.247 N/A GLY 195.A N ASP 191.A O no hydrogen 2.652 N/A GLY 195.A N ALA 192.A O no hydrogen 3.248 N/A THR 196.A N SER 194.A OG no hydrogen 3.409 N/A ALA 198.A N ASP 191.A OD1 no hydrogen 2.945 N/A TYR 199.A OH ARG 97.A O no hydrogen 2.565 N/A GLN 200.A N TRP 238.A O no hydrogen 3.050 N/A TYR 203.A N ASN 236.A O no hydrogen 2.763 N/A LYS 207.A N GLU 210.A OE2 no hydrogen 2.561 N/A GLY 208.A N GLU 210.A OE1 no hydrogen 2.734 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 2.911 N/A GLN 212.A NE2 ASP 216.A OD1 no hydrogen 2.945 N/A LEU 214.A N ALA 211.A O no hydrogen 2.929 N/A VAL 215.A N ALA 211.A O no hydrogen 3.200 N/A ASP 216.A N GLN 212.A O no hydrogen 2.772 N/A TYR 217.A N PHE 213.A O no hydrogen 3.139 N/A TYR 217.A OH TYR 158.A OH no hydrogen 2.719 N/A HIS 218.A N LEU 214.A O no hydrogen 3.050 N/A HIS 218.A ND1 ASP 219.A OD1 no hydrogen 3.221 N/A ASP 219.A N VAL 215.A O no hydrogen 2.902 N/A TYR 220.A N ASP 216.A O no hydrogen 3.122 N/A TYR 220.A N TYR 217.A O no hydrogen 3.151 N/A TYR 221.A N TYR 217.A O no hydrogen 2.816 N/A MET 222.A N HIS 218.A O no hydrogen 2.720 N/A THR 223.A OG1 ASP 219.A O no hydrogen 2.561 N/A ARG 225.A N THR 223.A OG1 no hydrogen 3.081 N/A ARG 225.A NE ASP 303.A OD2 no hydrogen 2.862 N/A ARG 225.A NH2 ASP 303.A OD1 no hydrogen 2.684 N/A TYR 227.A N THR 223.A O no hydrogen 3.009 N/A HIS 228.A N SER 234.A OG no hydrogen 3.318 N/A HIS 228.A NE2 ASP 11.A OD2 no hydrogen 2.606 N/A ARG 230.A N HIS 228.A ND1 no hydrogen 3.159 N/A ARG 230.A NH2 ASP 11.A OD2 no hydrogen 3.199 N/A ARG 230.A NH2 GLU 64.A OE2 no hydrogen 2.808 N/A ALA 231.A N HIS 228.A O no hydrogen 3.065 N/A ASN 233.A N GLY 60.A O no hydrogen 2.906 N/A ASN 233.A ND2 PHE 59.A O no hydrogen 2.976 N/A ASN 233.A ND2 TYR 221.A OH no hydrogen 3.144 N/A SER 234.A N ALA 231.A O no hydrogen 3.118 N/A SER 234.A OG TYR 221.A O no hydrogen 2.842 N/A ASN 236.A N VAL 232.A O no hydrogen 3.038 N/A THR 239.A N ASN 98.A O no hydrogen 3.084 N/A THR 239.A OG1 THR 242.A OG1 no hydrogen 2.729 N/A MET 240.A N ALA 198.A O no hydrogen 2.862 N/A THR 242.A N THR 239.A O no hydrogen 3.214 N/A THR 242.A OG1 THR 239.A O no hydrogen 3.541 N/A THR 242.A OG1 THR 239.A OG1 no hydrogen 2.729 N/A LEU 244.A N THR 241.A O no hydrogen 3.217 N/A SER 245.A OG ALA 100.A O no hydrogen 3.564 N/A SER 245.A OG THR 242.A O no hydrogen 3.503 N/A MET 247.A N PRO 243.A O no hydrogen 2.828 N/A ASN 248.A N SER 245.A O no hydrogen 3.034 N/A ILE 255.A N LEU 252.A O no hydrogen 3.185 N/A GLU 257.A N TYR 254.A O no hydrogen 2.854 N/A ILE 258.A N ILE 255.A O no hydrogen 3.254 N/A SER 259.A OG GLU 286.A O no hydrogen 2.654 N/A ARG 261.A N ILE 258.A O no hydrogen 2.869 N/A ARG 261.A NE ILE 258.A O no hydrogen 3.011 N/A ARG 261.A NH1 VAL 143.A O no hydrogen 2.894 N/A ARG 261.A NH1 ASP 146.A O no hydrogen 3.101 N/A ARG 261.A NH1 VAL 149.A O no hydrogen 2.899 N/A ARG 261.A NH2 VAL 143.A O no hydrogen 2.812 N/A ARG 261.A NH2 GLU 257.A O no hydrogen 3.165 N/A ILE 263.A N PRO 287.A O no hydrogen 3.111 N/A LEU 264.A N VAL 152.A O no hydrogen 3.037 N/A LEU 265.A N GLU 289.A O no hydrogen 2.811 N/A ILE 266.A N THR 154.A O no hydrogen 2.825 N/A HIS 267.A N LEU 291.A O no hydrogen 2.939 N/A HIS 267.A ND1 SER 277.A OG no hydrogen 2.677 N/A HIS 267.A NE2 SER 273.A OG no hydrogen 2.898 N/A GLU 269.A N VAL 293.A O no hydrogen 2.849 N/A ARG 270.A N ALA 296.A O no hydrogen 2.826 N/A ALA 271.A N GLY 268.A O no hydrogen 3.215 N/A HIS 272.A NE2 TYR 158.A OH no hydrogen 2.767 N/A SER 273.A OG HIS 267.A NE2 no hydrogen 2.898 N/A ARG 274.A N ALA 271.A O no hydrogen 3.122 N/A PHE 276.A N SER 273.A O no hydrogen 2.970 N/A SER 277.A N ARG 274.A O no hydrogen 3.162 N/A SER 277.A OG HIS 267.A ND1 no hydrogen 2.677 N/A GLU 278.A N ARG 274.A O no hydrogen 3.323 N/A THR 279.A N TYR 275.A O no hydrogen 2.916 N/A THR 279.A OG1 TYR 275.A O no hydrogen 3.275 N/A ALA 280.A N PHE 276.A O no hydrogen 3.009 N/A TYR 281.A N SER 277.A O no hydrogen 2.734 N/A ALA 282.A N GLU 278.A O no hydrogen 3.111 N/A ALA 283.A N THR 279.A O no hydrogen 2.983 N/A ALA 284.A N ALA 280.A O no hydrogen 2.865 N/A LYS 288.A N GLU 286.A OE2 no hydrogen 2.896 N/A LYS 288.A NZ TYR 281.A O no hydrogen 2.674 N/A LYS 288.A NZ ALA 284.A O no hydrogen 2.802 N/A GLU 289.A N ILE 263.A O no hydrogen 2.949 N/A LEU 291.A N LEU 265.A O no hydrogen 2.758 N/A VAL 293.A N HIS 267.A O no hydrogen 2.809 N/A GLY 295.A N GLU 269.A OE1 no hydrogen 2.500 N/A ALA 296.A N VAL 293.A O no hydrogen 3.260 N/A SER 297.A N ASP 300.A OD2 no hydrogen 2.753 N/A ASP 300.A N SER 297.A OG no hydrogen 3.174 N/A LEU 301.A N HIS 298.A O no hydrogen 3.164 N/A TYR 302.A N VAL 299.A O no hydrogen 2.944 N/A ARG 304.A N ASP 300.A O no hydrogen 3.084 N/A ARG 307.A N ARG 304.A O no hydrogen 2.905 N/A ILE 308.A N ARG 304.A O no hydrogen 2.774 N/A PHE 310.A N ILE 308.A O no hydrogen 2.909 N/A ARG 312.A NE ARG 312.A O no hydrogen 3.254 N/A ILE 313.A N PRO 309.A O no hydrogen 2.955 N/A ALA 314.A N PHE 310.A O no hydrogen 2.782 N/A GLY 315.A N ASP 311.A O no hydrogen 2.764 N/A PHE 316.A N ARG 312.A O no hydrogen 2.848 N/A PHE 317.A N ILE 313.A O no hydrogen 3.076 N/A ASP 318.A N ALA 314.A O no hydrogen 2.750 N/A GLU 319.A N GLY 315.A O no hydrogen 3.204 N/A HIS 320.A N PHE 316.A O no hydrogen 3.078 N/A LEU 321.A N PHE 317.A O no hydrogen 2.742 N/A