Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3faa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.965 N/A THR 5.A N SER 2.A O no hydrogen 3.021 N/A THR 5.A OG1 SER 2.A O no hydrogen 2.862 N/A THR 6.A OG1 ASP 9.A OD2 no hydrogen 2.582 N/A LEU 7.A N GLU 57.A OE1 no hydrogen 2.619 N/A LYS 8.A N GLU 57.A OE2 no hydrogen 3.081 N/A LEU 10.A N THR 6.A O no hydrogen 3.113 N/A ILE 11.A N LEU 7.A O no hydrogen 3.058 N/A TYR 12.A N LYS 8.A O no hydrogen 2.788 N/A ASP 13.A N ASP 9.A O no hydrogen 2.826 N/A MET 14.A N LEU 10.A O no hydrogen 2.831 N/A THR 15.A N ILE 11.A O no hydrogen 2.855 N/A THR 15.A OG1 TYR 12.A O no hydrogen 3.180 N/A THR 16.A N TYR 12.A O no hydrogen 3.119 N/A THR 16.A OG1 TYR 12.A O no hydrogen 3.095 N/A SER 17.A N MET 14.A O no hydrogen 2.559 N/A SER 19.A OG SER 21.A OG no hydrogen 2.555 N/A SER 21.A OG SER 19.A OG no hydrogen 2.555 N/A GLN 28.A N PRO 24.A O no hydrogen 2.864 N/A GLN 28.A NE2 LEU 23.A O no hydrogen 2.728 N/A ARG 29.A N LEU 25.A O no hydrogen 2.813 N/A ARG 29.A NH1 ASP 96.A OD2 no hydrogen 3.244 N/A THR 30.A N LEU 26.A O no hydrogen 2.984 N/A THR 30.A OG1 LEU 26.A O no hydrogen 2.746 N/A ILE 31.A N VAL 27.A O no hydrogen 2.946 N/A ALA 32.A N GLN 28.A O no hydrogen 3.010 N/A ARG 33.A N ARG 29.A O no hydrogen 3.050 N/A ARG 33.A NE ASP 96.A OD1 no hydrogen 2.869 N/A ARG 33.A NH2 ASN 97.A O no hydrogen 3.111 N/A THR 34.A N ILE 31.A O no hydrogen 2.853 N/A THR 34.A OG1 THR 30.A O no hydrogen 2.555 N/A THR 34.A OG1 ILE 31.A O no hydrogen 3.109 N/A ILE 35.A N ALA 32.A O no hydrogen 3.379 N/A VAL 36.A N LYS 53.A O no hydrogen 2.807 N/A GLN 38.A N ARG 51.A O no hydrogen 2.828 N/A GLN 38.A NE2 VAL 36.A O no hydrogen 2.693 N/A ILE 41.A N VAL 49.A O no hydrogen 3.056 N/A GLY 44.A N GLY 47.A O no hydrogen 3.064 N/A GLY 47.A N GLY 44.A O no hydrogen 3.388 N/A VAL 49.A N GLY 42.A O no hydrogen 2.729 N/A TRP 50.A N VAL 61.A O no hydrogen 2.708 N/A ARG 51.A NE GLU 58.A OE2 no hydrogen 2.970 N/A ARG 51.A NH1 GLU 39.A OE2 no hydrogen 2.312 N/A GLY 52.A N VAL 59.A O no hydrogen 2.989 N/A LYS 53.A N VAL 36.A O no hydrogen 3.180 N/A LYS 53.A NZ GLN 38.A OE1 no hydrogen 3.157 N/A TRP 54.A N GLU 57.A O no hydrogen 2.749 N/A TRP 54.A NE1 THR 34.A OG1 no hydrogen 2.925 N/A ARG 55.A NH1 SER 2.A O no hydrogen 3.180 N/A ARG 55.A NH1 THR 5.A O no hydrogen 3.474 N/A GLU 57.A N TRP 54.A O no hydrogen 3.105 N/A ALA 60.A N SER 110.A O no hydrogen 3.484 N/A VAL 61.A N TRP 50.A O no hydrogen 3.014 N/A LYS 62.A N LEU 108.A O no hydrogen 3.012 N/A LYS 62.A NZ GLU 75.A OE1 no hydrogen 2.936 N/A LYS 62.A NZ ASP 181.A OD2 no hydrogen 3.493 N/A ILE 63.A N GLU 48.A O no hydrogen 2.631 N/A PHE 64.A N LEU 106.A O no hydrogen 2.934 N/A SER 66.A OG THR 102.A O no hydrogen 3.195 N/A GLU 68.A N SER 65.A O no hydrogen 2.409 N/A TRP 72.A NE1 TRP 107.A O no hydrogen 2.901 N/A PHE 73.A N GLU 69.A O no hydrogen 2.997 N/A ARG 74.A N ARG 70.A O no hydrogen 3.009 N/A ARG 74.A NH1 ASP 196.A OD1 no hydrogen 3.294 N/A ARG 74.A NH2 ALA 185.A O no hydrogen 3.186 N/A ARG 74.A NH2 ASP 196.A OD1 no hydrogen 3.273 N/A ARG 74.A NH2 ASP 196.A OD2 no hydrogen 3.429 N/A GLU 75.A N SER 71.A O no hydrogen 3.452 N/A ALA 76.A N TRP 72.A O no hydrogen 3.106 N/A GLU 77.A N PHE 73.A O no hydrogen 2.656 N/A ILE 78.A N ARG 74.A O no hydrogen 2.792 N/A TYR 79.A N GLU 75.A O no hydrogen 2.818 N/A THR 81.A N ILE 78.A O no hydrogen 2.650 N/A THR 81.A OG1 ILE 78.A O no hydrogen 3.139 N/A LEU 84.A N THR 81.A O no hydrogen 3.012 N/A ASN 88.A ND2 GLU 87.A OE2 no hydrogen 3.471 N/A ILE 89.A N HIS 86.A O no hydrogen 3.401 N/A LEU 90.A N ILE 179.A O no hydrogen 3.041 N/A ILE 93.A N VAL 109.A O no hydrogen 2.780 N/A ALA 94.A N VAL 109.A O no hydrogen 2.939 N/A ALA 95.A N GLN 28.A OE1 no hydrogen 2.943 N/A ASP 96.A N TRP 107.A O no hydrogen 2.972 N/A ASN 97.A ND2 ASP 96.A OD2 no hydrogen 3.025 N/A TRP 103.A N ASN 100.A O no hydrogen 3.171 N/A THR 104.A N GLY 101.A O no hydrogen 2.946 N/A THR 104.A OG1 GLY 101.A O no hydrogen 2.786 N/A GLN 105.A NE2 ASP 99.A OD2 no hydrogen 3.407 N/A TRP 107.A N ASP 96.A O no hydrogen 2.974 N/A LEU 108.A N LYS 62.A O no hydrogen 3.134 N/A VAL 109.A N ALA 94.A O no hydrogen 2.570 N/A SER 110.A N ALA 60.A O no hydrogen 2.836 N/A SER 110.A OG ASP 111.A O no hydrogen 3.095 N/A GLY 116.A N HIS 113.A O no hydrogen 2.921 N/A SER 117.A OG ASP 120.A OD2 no hydrogen 2.451 N/A LEU 118.A N ILE 169.A O no hydrogen 2.888 N/A PHE 119.A N SER 166.A O no hydrogen 2.677 N/A ASP 120.A N SER 117.A O no hydrogen 3.013 N/A TYR 121.A N SER 117.A O no hydrogen 2.917 N/A LEU 122.A N LEU 118.A O no hydrogen 2.573 N/A ASN 123.A N ASP 120.A O no hydrogen 3.240 N/A ASN 123.A ND2 PHE 119.A O no hydrogen 2.652 N/A ARG 124.A N ASP 120.A O no hydrogen 2.932 N/A TYR 125.A N TYR 121.A O no hydrogen 2.920 N/A THR 126.A OG1 ARG 242.A O no hydrogen 3.237 N/A MET 132.A N THR 128.A O no hydrogen 2.692 N/A ILE 133.A N GLU 130.A O no hydrogen 3.247 N/A LEU 135.A N GLY 131.A O no hydrogen 2.961 N/A ALA 136.A N MET 132.A O no hydrogen 2.994 N/A LEU 137.A N ILE 133.A O no hydrogen 2.555 N/A SER 138.A N LYS 134.A O no hydrogen 2.956 N/A SER 138.A OG LYS 134.A O no hydrogen 2.894 N/A SER 138.A OG LEU 135.A O no hydrogen 2.866 N/A THR 139.A N LEU 135.A O no hydrogen 3.274 N/A THR 139.A OG1 LEU 135.A O no hydrogen 2.817 N/A ALA 140.A N ALA 136.A O no hydrogen 3.326 N/A SER 141.A N LEU 137.A O no hydrogen 2.625 N/A SER 141.A OG LEU 137.A O no hydrogen 2.908 N/A GLY 142.A N SER 138.A O no hydrogen 2.724 N/A LEU 143.A N THR 139.A O no hydrogen 2.859 N/A ALA 144.A N ALA 140.A O no hydrogen 3.082 N/A HIS 145.A N SER 141.A O no hydrogen 3.272 N/A HIS 145.A ND1 HIS 145.A O no hydrogen 2.525 N/A LEU 146.A N GLY 142.A O no hydrogen 2.912 N/A HIS 147.A N LEU 143.A O no hydrogen 3.321 N/A HIS 147.A N ALA 144.A O no hydrogen 2.745 N/A HIS 147.A NE2 ASP 228.A OD2 no hydrogen 2.429 N/A MET 148.A N ALA 144.A O no hydrogen 2.686 N/A ILE 150.A N LYS 156.A O no hydrogen 3.278 N/A LYS 156.A NZ HIS 145.A O no hydrogen 2.481 N/A LYS 156.A NZ LEU 146.A O no hydrogen 2.848 N/A ILE 159.A N LEU 146.A O no hydrogen 2.709 N/A ALA 160.A N VAL 186.A O no hydrogen 3.111 N/A ARG 162.A N ASP 228.A OD1 no hydrogen 3.381 N/A ARG 162.A NE LEU 184.A O no hydrogen 3.186 N/A LYS 165.A NZ THR 203.A OG1 no hydrogen 2.780 N/A SER 166.A OG TYR 206.A OH no hydrogen 2.641 N/A ASN 168.A N LYS 165.A O no hydrogen 2.932 N/A ASN 168.A ND2 ASP 163.A O no hydrogen 3.020 N/A LEU 170.A N CYS 178.A O no hydrogen 3.004 N/A VAL 171.A N GLY 116.A O no hydrogen 3.178 N/A LYS 172.A N THR 176.A O no hydrogen 2.831 N/A LYS 172.A NZ GLU 87.A O no hydrogen 2.992 N/A THR 176.A OG1 ASN 174.A O no hydrogen 3.311 N/A THR 176.A OG1 ASN 174.A OD1 no hydrogen 2.313 N/A CYS 177.A N SER 138.A OG no hydrogen 3.084 N/A CYS 177.A SG LEU 135.A O no hydrogen 3.598 N/A CYS 178.A N LEU 170.A O no hydrogen 2.721 N/A CYS 178.A SG HIS 113.A NE2 no hydrogen 3.997 N/A CYS 178.A SG LEU 170.A O no hydrogen 3.613 N/A ILE 179.A N ASN 88.A O no hydrogen 2.577 N/A ASP 181.A N TYR 79.A OH no hydrogen 2.907 N/A ALA 185.A N LEU 182.A O no hydrogen 3.187 N/A VAL 186.A N ALA 160.A O no hydrogen 3.409 N/A ARG 187.A N ASP 196.A OD2 no hydrogen 3.081 N/A ARG 187.A NE ASP 196.A OD1 no hydrogen 2.900 N/A ARG 187.A NH2 ASP 196.A OD1 no hydrogen 3.088 N/A ASP 189.A N THR 194.A O no hydrogen 3.295 N/A THR 192.A OG1 ASP 189.A OD2 no hydrogen 2.579 N/A THR 192.A OG1 THR 194.A OG1 no hydrogen 3.343 N/A THR 194.A N ASP 189.A O no hydrogen 3.150 N/A THR 194.A OG1 THR 192.A OG1 no hydrogen 3.343 N/A THR 203.A N ASP 163.A OD1 no hydrogen 3.066 N/A THR 203.A OG1 ASP 163.A OD1 no hydrogen 3.107 N/A ARG 205.A NE PRO 255.A O no hydrogen 2.894 N/A TYR 206.A OH GLU 238.A OE1 no hydrogen 2.580 N/A GLU 210.A N GLU 210.A OE2 no hydrogen 2.674 N/A LEU 212.A N ALA 208.A O no hydrogen 3.150 N/A ASP 213.A N PRO 209.A O no hydrogen 3.249 N/A ASP 214.A N VAL 211.A O no hydrogen 2.784 N/A SER 215.A OG ASP 213.A OD1 no hydrogen 2.847 N/A ILE 216.A N ASP 214.A O no hydrogen 2.557 N/A HIS 220.A N ASN 217.A OD1 no hydrogen 2.839 N/A GLU 222.A N HIS 220.A O no hydrogen 2.511 N/A SER 223.A N HIS 220.A O no hydrogen 3.280 N/A SER 223.A OG ASN 217.A O no hydrogen 2.442 N/A LYS 225.A NZ HIS 147.A O no hydrogen 3.402 N/A ARG 226.A N GLU 222.A O no hydrogen 2.639 N/A ALA 227.A N SER 223.A O no hydrogen 3.398 N/A ASP 228.A N PHE 224.A O no hydrogen 3.185 N/A ILE 229.A N ARG 226.A O no hydrogen 2.839 N/A TYR 230.A OH TYR 256.A OH no hydrogen 2.996 N/A ALA 231.A N ALA 227.A O no hydrogen 3.289 N/A MET 232.A N ASP 228.A O no hydrogen 2.914 N/A GLY 233.A N TYR 230.A O no hydrogen 2.718 N/A LEU 234.A N TYR 230.A O no hydrogen 2.984 N/A VAL 235.A N ALA 231.A O no hydrogen 3.072 N/A PHE 236.A N MET 232.A O no hydrogen 3.305 N/A PHE 236.A N GLY 233.A O no hydrogen 2.772 N/A TRP 237.A N GLY 233.A O no hydrogen 3.205 N/A GLU 238.A N LEU 234.A O no hydrogen 3.376 N/A ILE 239.A N VAL 235.A O no hydrogen 3.256 N/A ALA 240.A N PHE 236.A O no hydrogen 3.183 N/A ARG 241.A N TRP 237.A O no hydrogen 2.778 N/A ARG 241.A NH2 TYR 257.A OH no hydrogen 2.972 N/A ARG 242.A N ILE 239.A O no hydrogen 3.309 N/A CYS 243.A N ALA 240.A O no hydrogen 2.609 N/A CYS 243.A SG SER 244.A O no hydrogen 3.834 N/A SER 244.A N VAL 127.A O no hydrogen 3.304 N/A HIS 249.A ND1 GLY 247.A O no hydrogen 2.971 N/A TYR 252.A OH GLU 238.A OE2 no hydrogen 2.622 N/A VAL 260.A N TYR 256.A O no hydrogen 3.500 N/A MET 269.A N SER 265.A O no hydrogen 3.131 N/A ARG 270.A N VAL 266.A O no hydrogen 2.881 N/A LYS 271.A N GLU 267.A O no hydrogen 3.256 N/A CYS 274.A N ARG 270.A O no hydrogen 3.244 N/A CYS 274.A SG ASP 213.A OD2 no hydrogen 2.952 N/A CYS 274.A SG ARG 270.A O no hydrogen 3.184 N/A GLU 275.A N ARG 270.A O no hydrogen 3.491 N/A GLN 276.A N LYS 271.A O no hydrogen 3.134 N/A GLN 276.A NE2 LYS 271.A O no hydrogen 3.439 N/A LEU 278.A N VAL 272.A O no hydrogen 3.018 N/A ARG 279.A NE TRP 303.A O no hydrogen 2.961 N/A ARG 279.A NH1 VAL 273.A O no hydrogen 2.917 N/A ARG 279.A NH2 TRP 303.A O no hydrogen 2.930 N/A TRP 286.A N PRO 283.A O no hydrogen 3.092 N/A GLN 287.A N ASN 284.A O no hydrogen 3.416 N/A SER 288.A N TRP 286.A O no hydrogen 2.576 N/A SER 288.A OG ARG 285.A O no hydrogen 3.036 N/A CYS 289.A SG GLU 327.A OE1 no hydrogen 3.462 N/A ARG 293.A N CYS 289.A O no hydrogen 3.292 N/A MET 295.A N ALA 291.A O no hydrogen 3.349 N/A ALA 296.A N LEU 292.A O no hydrogen 3.311 N/A LYS 297.A N ARG 293.A O no hydrogen 2.749 N/A ILE 298.A N VAL 294.A O no hydrogen 3.086 N/A MET 299.A N MET 295.A O no hydrogen 2.612 N/A ARG 300.A N LYS 297.A O no hydrogen 2.886 N/A GLU 301.A N LYS 297.A O no hydrogen 2.704 N/A CYS 302.A SG ILE 298.A O no hydrogen 3.049 N/A TRP 303.A N MET 299.A O no hydrogen 3.227 N/A TYR 304.A OH GLU 301.A OE1 no hydrogen 3.238 N/A ALA 309.A N ASN 306.A OD1 no hydrogen 2.860 N/A ARG 310.A N GLY 307.A O no hydrogen 3.025 N/A ARG 310.A NE CYS 302.A O no hydrogen 2.989 N/A ARG 310.A NH2 GLU 210.A OE2 no hydrogen 2.443 N/A LEU 311.A N GLU 301.A O no hydrogen 3.255 N/A ARG 315.A N THR 312.A OG1 no hydrogen 3.088 N/A ILE 316.A N THR 312.A O no hydrogen 3.496 N/A LYS 317.A N ALA 313.A O no hydrogen 3.235 N/A LYS 318.A N LEU 314.A O no hydrogen 3.147 N/A THR 319.A N ARG 315.A O no hydrogen 2.917 N/A THR 319.A OG1 ILE 316.A O no hydrogen 3.203 N/A LEU 320.A N ILE 316.A O no hydrogen 3.076 N/A SER 321.A N LYS 318.A O no hydrogen 3.119 N/A GLN 322.A N LYS 318.A O no hydrogen 3.001 N/A GLN 322.A N THR 319.A O no hydrogen 3.246 N/A LEU 323.A N THR 319.A O no hydrogen 2.976 N/A GLN 325.A N GLN 322.A O no hydrogen 2.658 N/A GLN 326.A N GLN 322.A O no hydrogen 3.282 N/A