Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2j3i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 MET 1.A O no hydrogen 2.668 N/A ASN 5.A N THR 28.A O no hydrogen 2.459 N/A LYS 6.A N GLU 99.A OE2 no hydrogen 3.201 N/A LYS 6.A NZ GLU 311.A OE2 no hydrogen 3.447 N/A GLN 7.A N THR 26.A O no hydrogen 2.773 N/A VAL 8.A N TRP 97.A O no hydrogen 2.968 N/A ILE 9.A N ASP 24.A O no hydrogen 2.756 N/A LYS 11.A N ASP 22.A O no hydrogen 3.403 N/A VAL 14.A N MET 58.A O no hydrogen 3.273 N/A THR 19.A OG1 SER 21.A OG no hydrogen 2.854 N/A THR 19.A OG1 ASP 22.A OD1 no hydrogen 3.376 N/A SER 21.A OG THR 19.A OG1 no hydrogen 2.854 N/A ASP 22.A N THR 19.A O no hydrogen 2.820 N/A PHE 23.A N GLU 20.A O no hydrogen 3.158 N/A ASP 24.A N ILE 9.A O no hydrogen 3.345 N/A THR 26.A N GLN 7.A O no hydrogen 2.824 N/A THR 26.A OG1 GLN 7.A O no hydrogen 3.429 N/A THR 28.A N ASN 5.A O no hydrogen 2.623 N/A THR 28.A OG1 ASN 5.A O no hydrogen 2.822 N/A THR 28.A OG1 GLN 7.A OE1 no hydrogen 3.315 N/A THR 29.A OG1 ALA 3.A O no hydrogen 3.409 N/A LEU 32.A N MET 1.A O no hydrogen 3.043 N/A ARG 33.A N GLU 31.A O no hydrogen 2.632 N/A VAL 41.A N ILE 103.A O no hydrogen 3.107 N/A LEU 42.A N GLU 79.A O no hydrogen 2.690 N/A VAL 43.A N SER 101.A O no hydrogen 2.777 N/A LYS 44.A N ARG 76.A O no hydrogen 2.823 N/A LYS 44.A NZ GLU 336.A OE2 no hydrogen 3.177 N/A ASN 45.A N GLU 99.A O no hydrogen 2.629 N/A ASN 45.A ND2 SER 75.A OG no hydrogen 3.108 N/A LEU 46.A N VAL 74.A O no hydrogen 3.168 N/A TYR 47.A N VAL 74.A O no hydrogen 3.109 N/A LEU 48.A N VAL 331.A O no hydrogen 3.146 N/A SER 49.A N TYR 72.A O no hydrogen 3.006 N/A SER 49.A OG ASP 51.A OD2 no hydrogen 3.114 N/A SER 49.A OG THR 124.A O no hydrogen 3.308 N/A CYS 50.A N GLN 329.A O no hydrogen 2.615 N/A TYR 53.A OH ASP 51.A OD1 no hydrogen 3.352 N/A ARG 55.A NE GLY 16.A O no hydrogen 2.911 N/A ARG 55.A NE ASN 252.A OD1 no hydrogen 3.084 N/A ARG 55.A NH1 ARG 55.A O no hydrogen 2.681 N/A ARG 55.A NH2 GLY 16.A O no hydrogen 3.068 N/A ARG 57.A N TYR 53.A O no hydrogen 2.960 N/A MET 58.A N ARG 55.A O no hydrogen 2.979 N/A GLY 59.A N ILE 56.A O no hydrogen 3.421 N/A TYR 63.A N ARG 57.A O no hydrogen 3.145 N/A GLY 66.A N LEU 10.A O no hydrogen 2.625 N/A GLN 67.A N THR 64.A O no hydrogen 3.094 N/A GLN 67.A NE2 PRO 65.A O no hydrogen 3.495 N/A GLY 71.A N VAL 95.A O no hydrogen 2.932 N/A TYR 72.A N ASP 51.A OD1 no hydrogen 3.226 N/A TYR 72.A OH TYR 281.A OH no hydrogen 3.103 N/A GLY 73.A N GLY 93.A O no hydrogen 3.291 N/A VAL 74.A N TYR 47.A O no hydrogen 3.121 N/A SER 75.A N LEU 91.A O no hydrogen 2.849 N/A ARG 76.A N LYS 44.A O no hydrogen 3.002 N/A ARG 76.A NH1 GLU 336.A OE1 no hydrogen 2.740 N/A ILE 77.A N ASP 89.A O no hydrogen 2.737 N/A ILE 78.A N LEU 42.A O no hydrogen 2.670 N/A SER 80.A OG HIS 82.A O no hydrogen 3.205 N/A SER 80.A OG TYR 85.A O no hydrogen 2.592 N/A HIS 82.A N SER 80.A OG no hydrogen 3.270 N/A HIS 82.A ND1 ASN 39.A O no hydrogen 2.928 N/A HIS 82.A NE2 ASP 84.A OD1 no hydrogen 3.218 N/A TYR 85.A OH PHE 111.A O no hydrogen 2.893 N/A LYS 86.A NZ ASP 89.A OD1 no hydrogen 2.998 N/A LYS 87.A NZ GLU 79.A OE1 no hydrogen 3.120 N/A GLY 88.A N LYS 86.A O no hydrogen 2.553 N/A LEU 91.A N SER 75.A O no hydrogen 2.948 N/A TRP 92.A N PHE 111.A O no hydrogen 3.330 N/A TRP 92.A NE1 TYR 284.A OH no hydrogen 2.806 N/A GLY 93.A N GLY 73.A O no hydrogen 3.241 N/A VAL 95.A N GLY 71.A O no hydrogen 3.096 N/A SER 101.A N VAL 43.A O no hydrogen 2.877 N/A SER 101.A OG GLU 98.A OE1 no hydrogen 3.404 N/A HIS 108.A ND1 THR 107.A O no hydrogen 2.828 N/A ALA 109.A N MET 106.A O no hydrogen 3.323 N/A HIS 110.A N MET 106.A O no hydrogen 3.054 N/A PHE 111.A N TRP 92.A O no hydrogen 3.154 N/A LYS 112.A NZ ASP 84.A O no hydrogen 2.738 N/A LYS 112.A NZ ASP 89.A OD1 no hydrogen 3.355 N/A ILE 113.A N LEU 90.A O no hydrogen 2.764 N/A SER 121.A OG GLU 304.A OE1 no hydrogen 3.191 N/A TYR 123.A OH HIS 115.A O no hydrogen 3.214 N/A THR 124.A N SER 121.A O no hydrogen 2.949 N/A THR 124.A OG1 SER 121.A O no hydrogen 2.727 N/A GLY 125.A N TYR 122.A O no hydrogen 2.909 N/A LEU 127.A N TYR 122.A O no hydrogen 2.737 N/A GLY 131.A N GLY 128.A O no hydrogen 2.818 N/A MET 132.A N GLY 128.A O no hydrogen 3.180 N/A THR 133.A N MET 129.A O no hydrogen 3.188 N/A THR 133.A OG1 MET 129.A O no hydrogen 2.727 N/A ALA 134.A N PRO 130.A O no hydrogen 2.976 N/A TYR 135.A N GLY 131.A O no hydrogen 2.901 N/A ALA 136.A N MET 132.A O no hydrogen 2.738 N/A GLY 137.A N THR 133.A O no hydrogen 3.319 N/A PHE 138.A N ALA 134.A O no hydrogen 3.164 N/A TYR 139.A N TYR 135.A O no hydrogen 2.895 N/A GLU 140.A N ALA 136.A O no hydrogen 2.789 N/A CYS 142.A SG GLY 137.A O no hydrogen 3.274 N/A SER 143.A N GLU 140.A O no hydrogen 3.252 N/A THR 149.A OG1 GLY 216.A O no hydrogen 2.623 N/A THR 149.A OG1 ASP 218.A OD2 no hydrogen 3.255 N/A VAL 150.A N TYR 173.A O no hydrogen 2.772 N/A TYR 151.A N ILE 219.A O no hydrogen 2.785 N/A VAL 152.A N VAL 175.A O no hydrogen 2.971 N/A SER 153.A OG PHE 221.A O no hydrogen 3.084 N/A GLN 161.A N GLY 157.A O no hydrogen 3.092 N/A GLN 161.A NE2 GLY 157.A O no hydrogen 3.687 N/A GLN 161.A NE2 VAL 303.A O no hydrogen 3.418 N/A LEU 166.A N LEU 162.A O no hydrogen 2.590 N/A ALA 167.A N VAL 163.A O no hydrogen 2.694 N/A LYS 168.A N GLY 164.A O no hydrogen 2.886 N/A LYS 168.A NZ ASP 194.A OD1 no hydrogen 3.270 N/A LYS 168.A NZ ASP 194.A OD2 no hydrogen 3.177 N/A MET 169.A N GLN 165.A O no hydrogen 3.198 N/A MET 170.A N LEU 166.A O no hydrogen 3.069 N/A GLY 171.A N ALA 167.A O no hydrogen 3.140 N/A CYS 172.A N ALA 167.A O no hydrogen 3.155 N/A CYS 172.A SG LYS 145.A O no hydrogen 3.910 N/A CYS 172.A SG GLU 148.A O no hydrogen 3.721 N/A CYS 172.A SG ALA 167.A O no hydrogen 3.525 N/A VAL 174.A N ASP 194.A OD1 no hydrogen 3.023 N/A VAL 175.A N VAL 150.A O no hydrogen 3.102 N/A SER 177.A OG TYR 151.A OH no hydrogen 2.873 N/A SER 177.A OG SER 153.A O no hydrogen 2.948 N/A ALA 178.A N PHE 197.A O no hydrogen 3.158 N/A LYS 181.A NZ GLU 201.A OE2 no hydrogen 2.779 N/A LYS 183.A NZ ASN 325.A O no hydrogen 2.662 N/A VAL 184.A N SER 180.A O no hydrogen 3.034 N/A LEU 186.A N GLU 182.A O no hydrogen 3.137 N/A LEU 187.A N LYS 183.A O no hydrogen 3.237 N/A LYS 188.A NZ PHE 193.A O no hydrogen 3.118 N/A THR 189.A N ASP 185.A O no hydrogen 2.871 N/A THR 189.A OG1 ASP 185.A O no hydrogen 2.653 N/A LYS 190.A N LEU 186.A O no hydrogen 2.841 N/A PHE 191.A N LEU 186.A O no hydrogen 3.479 N/A PHE 191.A N LEU 187.A O no hydrogen 3.159 N/A PHE 193.A N LEU 187.A O no hydrogen 3.468 N/A ASP 194.A N VAL 174.A O no hydrogen 2.673 N/A ALA 196.A N ASP 195.A OD2 no hydrogen 3.035 N/A PHE 197.A N GLY 176.A O no hydrogen 3.068 N/A TYR 199.A N ALA 178.A O no hydrogen 3.283 N/A GLU 201.A N ASN 198.A O no hydrogen 2.845 N/A SER 203.A OG ASP 204.A OD2 no hydrogen 3.519 N/A ALA 208.A N LEU 205.A O no hydrogen 3.254 N/A LEU 209.A N LEU 205.A O no hydrogen 2.866 N/A LYS 210.A N THR 206.A O no hydrogen 2.642 N/A ARG 211.A N ALA 207.A O no hydrogen 2.904 N/A ARG 211.A N ALA 208.A O no hydrogen 2.982 N/A ARG 211.A NH1 GLU 202.A OE1 no hydrogen 3.084 N/A ARG 211.A NH2 GLU 202.A OE1 no hydrogen 2.965 N/A CYS 212.A N ALA 208.A O no hydrogen 2.856 N/A CYS 212.A SG ALA 208.A O no hydrogen 3.231 N/A PHE 213.A N LEU 209.A O no hydrogen 2.826 N/A ILE 217.A N ASN 235.A O no hydrogen 3.428 N/A ASP 218.A N THR 149.A OG1 no hydrogen 2.938 N/A ILE 219.A N THR 149.A O no hydrogen 3.103 N/A TYR 220.A N ARG 241.A O no hydrogen 3.260 N/A TYR 220.A OH GLU 222.A OE2 no hydrogen 2.849 N/A PHE 221.A N TYR 151.A O no hydrogen 2.864 N/A GLU 222.A N ALA 243.A O no hydrogen 3.032 N/A ASN 223.A N SER 153.A OG no hydrogen 2.797 N/A MET 228.A N GLY 225.A O no hydrogen 3.144 N/A ASP 230.A N GLY 226.A O no hydrogen 2.871 N/A ALA 231.A N LYS 227.A O no hydrogen 3.244 N/A ALA 231.A N MET 228.A O no hydrogen 3.183 N/A VAL 232.A N MET 228.A O no hydrogen 3.168 N/A LEU 233.A N LEU 229.A O no hydrogen 2.876 N/A ASN 235.A N ALA 231.A O no hydrogen 2.984 N/A MET 236.A N LEU 233.A O no hydrogen 2.983 N/A ASN 237.A ND2 ASN 215.A O no hydrogen 3.613 N/A ASN 237.A ND2 ASP 218.A OD1 no hydrogen 3.011 N/A ASN 237.A ND2 ASP 218.A OD2 no hydrogen 3.532 N/A HIS 239.A N LYS 268.A O no hydrogen 2.785 N/A GLY 240.A N ASN 237.A O no hydrogen 3.181 N/A ARG 241.A NH1 SER 143.A O no hydrogen 3.417 N/A ARG 241.A NH1 GLU 148.A OE1 no hydrogen 2.800 N/A ARG 241.A NH2 GLU 148.A OE1 no hydrogen 3.395 N/A ILE 242.A N ARG 271.A O no hydrogen 3.075 N/A ALA 243.A N TYR 220.A O no hydrogen 3.262 N/A CYS 245.A SG ASN 223.A OD1 no hydrogen 3.457 N/A GLY 246.A N GLU 222.A O no hydrogen 2.740 N/A MET 247.A N TYR 251.A OH no hydrogen 3.144 N/A ILE 248.A N ASN 223.A O no hydrogen 3.272 N/A SER 249.A OG VAL 224.A O no hydrogen 2.966 N/A GLN 250.A N MET 247.A O no hydrogen 3.007 N/A GLN 250.A NE2 SER 249.A OG no hydrogen 3.141 N/A GLN 250.A NE2 GLU 257.A OE2 no hydrogen 3.307 N/A TYR 251.A N MET 247.A O no hydrogen 3.328 N/A TYR 251.A N ILE 248.A O no hydrogen 3.159 N/A LEU 253.A N GLN 250.A O no hydrogen 3.368 N/A GLU 257.A N GLN 250.A OE1 no hydrogen 2.850 N/A HIS 260.A N ASP 230.A OD1 no hydrogen 3.032 N/A HIS 260.A N ASP 230.A OD2 no hydrogen 3.356 N/A LEU 262.A N HIS 260.A O no hydrogen 2.544 N/A ASN 264.A N ASN 261.A O no hydrogen 3.194 N/A ILE 265.A N LEU 262.A O no hydrogen 2.597 N/A ILE 266.A N SER 263.A O no hydrogen 3.340 N/A TYR 267.A OH SER 263.A OG no hydrogen 2.827 N/A LYS 268.A N ASN 264.A O no hydrogen 2.875 N/A LYS 268.A NZ MET 236.A O no hydrogen 3.148 N/A ARG 269.A N ILE 266.A O no hydrogen 3.198 N/A ASN 270.A N ILE 265.A O no hydrogen 3.326 N/A ARG 271.A NH1 SER 143.A OG no hydrogen 3.110 N/A ARG 271.A NH2 VAL 141.A O no hydrogen 3.243 N/A ARG 271.A NH2 SER 143.A OG no hydrogen 2.734 N/A GLN 273.A N ILE 242.A O no hydrogen 2.957 N/A PHE 280.A N VAL 277.A O no hydrogen 2.631 N/A TYR 281.A N SER 278.A O no hydrogen 3.036 N/A TYR 281.A OH TYR 72.A OH no hydrogen 3.103 N/A LYS 283.A N PHE 280.A O no hydrogen 2.724 N/A TYR 284.A N TYR 281.A O no hydrogen 3.057 N/A TYR 284.A OH LEU 127.A O no hydrogen 3.403 N/A LYS 286.A N LYS 283.A O no hydrogen 3.125 N/A LYS 286.A NZ LYS 286.A O no hydrogen 3.160 N/A PHE 287.A N LYS 283.A O no hydrogen 3.008 N/A LEU 288.A N TYR 284.A O no hydrogen 2.918 N/A PHE 290.A N PHE 287.A O no hydrogen 2.754 N/A VAL 291.A N PHE 287.A O no hydrogen 2.893 N/A LEU 292.A N LEU 288.A O no hydrogen 2.990 N/A HIS 294.A N VAL 291.A O no hydrogen 2.593 N/A ILE 295.A N VAL 291.A O no hydrogen 3.013 N/A GLU 297.A N ILE 295.A O no hydrogen 2.663 N/A GLY 298.A N ILE 295.A O no hydrogen 2.987 N/A LYS 299.A N HIS 294.A O no hydrogen 2.704 N/A LYS 299.A NZ GLU 297.A OE1 no hydrogen 3.526 N/A ILE 300.A N HIS 294.A O no hydrogen 2.875 N/A THR 301.A N GLN 165.A OE1 no hydrogen 3.325 N/A ASP 305.A N LYS 328.A O no hydrogen 2.806 N/A GLY 309.A N VAL 332.A O no hydrogen 2.774 N/A LEU 317.A N ALA 313.A O no hydrogen 2.891 N/A VAL 318.A N PRO 314.A O no hydrogen 3.352 N/A LEU 320.A N LEU 317.A O no hydrogen 3.109 N/A PHE 321.A N VAL 318.A O no hydrogen 3.149 N/A GLY 323.A N GLY 319.A O no hydrogen 2.875 N/A LYS 324.A N GLY 319.A O no hydrogen 2.825 N/A ASN 325.A ND2 GLY 327.A O no hydrogen 3.256 N/A VAL 326.A N ASP 305.A OD1 no hydrogen 2.831 N/A LYS 328.A N VAL 303.A O no hydrogen 2.961 N/A LYS 328.A NZ CYS 50.A O no hydrogen 3.044 N/A GLN 329.A NE2 ALA 316.A O no hydrogen 2.984 N/A VAL 330.A N ASP 305.A O no hydrogen 3.212 N/A VAL 331.A N LEU 48.A O no hydrogen 2.868 N/A VAL 332.A N ALA 307.A O no hydrogen 2.934 N/A VAL 333.A N LEU 46.A O no hydrogen 2.851 N/A ALA 334.A N LEU 46.A O no hydrogen 3.105 N/A ARG 335.A NE ASP 308.A OD1 no hydrogen 3.117 N/A ARG 335.A NH2 ASP 308.A OD1 no hydrogen 2.941 N/A