Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ula_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 2.A OE1 no hydrogen 2.935 N/A TYR 5.A OH ASN 55.A O no hydrogen 2.755 N/A THR 6.A N ASP 9.A OD2 no hydrogen 2.550 N/A THR 6.A OG1 ASP 9.A OD2 no hydrogen 2.716 N/A ASP 9.A N THR 6.A O no hydrogen 2.423 N/A TYR 10.A N TYR 7.A O no hydrogen 3.025 N/A LYS 11.A N TYR 7.A O no hydrogen 3.268 N/A LYS 11.A NZ GLU 8.A OE1 no hydrogen 3.041 N/A LYS 11.A NZ GLU 8.A OE2 no hydrogen 2.713 N/A ASN 12.A N GLU 8.A O no hydrogen 2.936 N/A ASN 12.A ND2 GLU 8.A O no hydrogen 2.681 N/A THR 13.A N ASP 9.A O no hydrogen 3.150 N/A THR 13.A OG1 ASP 9.A O no hydrogen 2.674 N/A ALA 14.A N TYR 10.A O no hydrogen 2.756 N/A GLU 15.A N LYS 11.A O no hydrogen 3.017 N/A TRP 16.A N ASN 12.A O no hydrogen 3.136 N/A LEU 17.A N THR 13.A O no hydrogen 3.035 N/A LEU 18.A N ALA 14.A O no hydrogen 2.688 N/A SER 19.A N TRP 16.A O no hydrogen 2.827 N/A SER 19.A OG GLU 15.A O no hydrogen 2.544 N/A HIS 20.A N LEU 17.A O no hydrogen 3.196 N/A HIS 20.A ND1 TRP 16.A O no hydrogen 2.936 N/A THR 21.A OG1 LEU 17.A O no hydrogen 2.926 N/A HIS 23.A NE2 GLN 44.A O no hydrogen 2.789 N/A GLN 26.A N ALA 77.A O no hydrogen 2.576 N/A GLN 26.A NE2 PRO 283.A O no hydrogen 2.944 N/A VAL 27.A N ALA 77.A O no hydrogen 3.149 N/A ALA 28.A N THR 110.A O no hydrogen 3.158 N/A ILE 29.A N VAL 79.A O no hydrogen 2.729 N/A ILE 30.A N VAL 112.A O no hydrogen 3.018 N/A CYS 31.A N MET 81.A O no hydrogen 3.013 N/A CYS 31.A SG LEU 35.A O no hydrogen 3.712 N/A LEU 38.A N LEU 35.A O no hydrogen 2.934 N/A THR 39.A N GLY 36.A O no hydrogen 3.020 N/A THR 39.A OG1 GLY 36.A O no hydrogen 3.141 N/A ASP 40.A N GLY 37.A O no hydrogen 3.498 N/A LYS 41.A N LEU 38.A O no hydrogen 3.254 N/A LYS 41.A NZ GLU 272.A OE1 no hydrogen 3.540 N/A GLN 46.A N PHE 70.A O no hydrogen 2.493 N/A GLN 46.A NE2 HIS 20.A O no hydrogen 2.711 N/A PHE 48.A N LEU 68.A O no hydrogen 3.080 N/A ASP 49.A N GLU 52.A OE2 no hydrogen 3.484 N/A TYR 50.A OH GLY 83.A O no hydrogen 2.643 N/A GLU 52.A N ASP 49.A O no hydrogen 3.273 N/A ILE 53.A N TYR 50.A O no hydrogen 2.606 N/A ASN 55.A ND2 THR 13.A OG1 no hydrogen 2.864 N/A PHE 56.A N ILE 53.A O no hydrogen 3.235 N/A ARG 67.A N GLN 82.A O no hydrogen 3.056 N/A ARG 67.A NE GLN 82.A OE1 no hydrogen 2.554 N/A LEU 68.A N PHE 48.A O no hydrogen 3.009 N/A VAL 69.A N MET 80.A O no hydrogen 3.299 N/A PHE 70.A N GLN 46.A O no hydrogen 2.704 N/A GLY 71.A N CYS 78.A O no hydrogen 3.368 N/A LEU 73.A N ARG 76.A O no hydrogen 3.006 N/A ARG 76.A NE ILE 282.A O no hydrogen 2.592 N/A VAL 79.A N VAL 27.A O no hydrogen 2.880 N/A MET 80.A N VAL 69.A O no hydrogen 3.302 N/A MET 81.A N ILE 29.A O no hydrogen 2.752 N/A GLN 82.A N ARG 67.A O no hydrogen 2.873 N/A ARG 84.A NE GLU 224.A OE2 no hydrogen 2.816 N/A ARG 84.A NH1 THR 114.A O no hydrogen 3.052 N/A ARG 84.A NH2 THR 114.A O no hydrogen 2.656 N/A HIS 86.A N GLU 89.A OE2 no hydrogen 2.221 N/A HIS 86.A ND1 GLU 89.A OE2 no hydrogen 2.495 N/A GLU 89.A N HIS 86.A O no hydrogen 3.270 N/A GLY 90.A N MET 87.A O no hydrogen 2.984 N/A TYR 91.A OH ARG 58.A O no hydrogen 2.954 N/A LYS 95.A N PRO 92.A O no hydrogen 3.026 N/A VAL 96.A N PRO 92.A O no hydrogen 3.372 N/A THR 97.A OG1 LEU 93.A O no hydrogen 2.885 N/A PHE 98.A N LYS 95.A O no hydrogen 3.033 N/A VAL 102.A N PHE 98.A O no hydrogen 3.272 N/A PHE 103.A N PRO 99.A O no hydrogen 2.970 N/A HIS 104.A N VAL 100.A O no hydrogen 2.960 N/A LEU 105.A N ARG 101.A O no hydrogen 3.321 N/A LEU 106.A N PHE 103.A O no hydrogen 2.555 N/A GLY 107.A N PHE 103.A O no hydrogen 3.029 N/A ASP 109.A N GLN 26.A O no hydrogen 3.483 N/A THR 110.A OG1 ASP 109.A OD1 no hydrogen 2.624 N/A LEU 111.A N ARG 234.A O no hydrogen 2.797 N/A VAL 112.A N ALA 28.A O no hydrogen 3.336 N/A VAL 113.A N PHE 236.A O no hydrogen 3.304 N/A THR 114.A N ILE 30.A O no hydrogen 2.821 N/A THR 114.A OG1 ILE 30.A O no hydrogen 2.234 N/A ASN 115.A ND2 SER 239.A OG no hydrogen 2.517 N/A GLY 118.A N VAL 217.A O no hydrogen 3.167 N/A LEU 120.A N ASP 215.A O no hydrogen 2.687 N/A ASN 121.A ND2 ASP 215.A OD1 no hydrogen 2.945 N/A LYS 123.A N ASN 121.A OD1 no hydrogen 3.318 N/A GLU 125.A N ASP 128.A OD2 no hydrogen 3.027 N/A GLY 127.A N ILE 241.A O no hydrogen 2.737 N/A ASP 128.A N GLU 125.A O no hydrogen 2.947 N/A MET 130.A N SER 239.A O no hydrogen 3.008 N/A LEU 131.A N GLN 188.A O no hydrogen 2.954 N/A ILE 132.A N GLY 237.A O no hydrogen 2.979 N/A ARG 133.A N GLY 190.A O no hydrogen 2.858 N/A HIS 135.A N ASP 134.A OD1 no hydrogen 2.959 N/A HIS 135.A ND1 TYR 166.A OH no hydrogen 2.912 N/A ILE 136.A N TYR 192.A O no hydrogen 3.210 N/A PHE 141.A N LEU 138.A O no hydrogen 2.730 N/A GLY 143.A N GLY 140.A O no hydrogen 3.306 N/A GLN 144.A N PRO 139.A O no hydrogen 2.935 N/A ASN 145.A N GLY 143.A O no hydrogen 2.704 N/A LEU 147.A N ASN 145.A OD1 no hydrogen 2.907 N/A ASN 151.A ND2 GLY 156.A O no hydrogen 2.647 N/A ARG 154.A N ASP 152.A OD1 no hydrogen 2.657 N/A ARG 154.A NE ASP 152.A OD1 no hydrogen 3.170 N/A ARG 154.A NE ASP 152.A OD2 no hydrogen 3.173 N/A PHE 155.A N ASP 152.A O no hydrogen 2.360 N/A GLY 156.A N ASP 152.A O no hydrogen 2.705 N/A ARG 158.A NE ARG 158.A O no hydrogen 3.435 N/A ARG 158.A NH1 GLY 149.A O no hydrogen 2.473 N/A ARG 158.A NH2 LEU 147.A O no hydrogen 2.620 N/A ARG 158.A NH2 GLY 149.A O no hydrogen 2.248 N/A ALA 165.A N MET 162.A O no hydrogen 3.183 N/A TYR 166.A OH HIS 135.A ND1 no hydrogen 2.912 N/A ASP 167.A N VAL 235.A O no hydrogen 2.864 N/A GLN 172.A N THR 169.A O no hydrogen 3.061 N/A ARG 173.A N THR 169.A O no hydrogen 2.443 N/A LEU 175.A N ARG 171.A O no hydrogen 3.271 N/A SER 176.A N GLN 172.A O no hydrogen 2.823 N/A SER 176.A OG GLN 172.A O no hydrogen 3.047 N/A THR 177.A N ARG 173.A O no hydrogen 3.441 N/A THR 177.A OG1 ARG 173.A O no hydrogen 2.591 N/A THR 177.A OG1 ALA 174.A O no hydrogen 3.472 N/A TRP 178.A N ALA 174.A O no hydrogen 3.261 N/A TRP 178.A N LEU 175.A O no hydrogen 2.970 N/A TRP 178.A NE1 ARG 185.A O no hydrogen 2.878 N/A LYS 179.A N SER 176.A O no hydrogen 2.336 N/A MET 181.A N THR 177.A O no hydrogen 2.964 N/A GLY 182.A N LYS 179.A O no hydrogen 2.296 N/A GLU 183.A N TRP 178.A O no hydrogen 3.469 N/A ARG 185.A NH2 VAL 126.A O no hydrogen 3.528 N/A GLN 188.A NE2 ASP 128.A OD2 no hydrogen 2.792 N/A THR 191.A N ASP 215.A OD2 no hydrogen 3.014 N/A TYR 192.A N ASP 134.A O no hydrogen 2.745 N/A TYR 192.A OH SER 220.A O no hydrogen 3.217 N/A VAL 193.A N ALA 216.A O no hydrogen 3.095 N/A MET 194.A N ILE 136.A O no hydrogen 2.904 N/A VAL 195.A N GLY 218.A O no hydrogen 3.148 N/A THR 202.A N GLU 205.A OE1 no hydrogen 3.516 N/A CYS 206.A N THR 202.A O no hydrogen 3.338 N/A CYS 206.A SG GLU 201.A O no hydrogen 3.863 N/A CYS 206.A SG THR 202.A O no hydrogen 2.902 N/A ARG 207.A N VAL 203.A O no hydrogen 3.054 N/A ARG 207.A NE MET 247.A O no hydrogen 3.195 N/A ARG 207.A NH2 MET 247.A O no hydrogen 3.331 N/A VAL 208.A N GLU 205.A O no hydrogen 2.606 N/A LEU 209.A N GLU 205.A O no hydrogen 2.989 N/A GLN 210.A N CYS 206.A O no hydrogen 2.957 N/A LYS 211.A N ARG 207.A O no hydrogen 3.151 N/A LEU 212.A N VAL 208.A O no hydrogen 2.694 N/A GLY 213.A N GLN 210.A O no hydrogen 2.768 N/A ALA 214.A N LEU 209.A O no hydrogen 3.400 N/A ASP 215.A N THR 191.A O no hydrogen 3.024 N/A ALA 216.A N THR 191.A O no hydrogen 3.444 N/A VAL 217.A N GLY 118.A O no hydrogen 3.110 N/A THR 221.A OG1 ASN 115.A OD1 no hydrogen 2.638 N/A VAL 225.A N THR 221.A O no hydrogen 3.285 N/A ILE 226.A N VAL 222.A O no hydrogen 3.014 N/A VAL 227.A N PRO 223.A O no hydrogen 3.139 N/A ALA 228.A N VAL 225.A O no hydrogen 2.836 N/A ARG 229.A N VAL 225.A O no hydrogen 2.767 N/A HIS 230.A N ILE 226.A O no hydrogen 3.034 N/A HIS 230.A NE2 ASP 157.A O no hydrogen 3.064 N/A CYS 231.A N ALA 228.A O no hydrogen 3.029 N/A CYS 231.A SG VAL 227.A O no hydrogen 3.598 N/A GLY 232.A N ARG 229.A O no hydrogen 2.945 N/A LEU 233.A N ALA 228.A O no hydrogen 3.250 N/A ARG 234.A N ASP 109.A O no hydrogen 2.874 N/A ARG 234.A NE THR 110.A OG1 no hydrogen 2.483 N/A ARG 234.A NH2 THR 110.A OG1 no hydrogen 2.633 N/A PHE 236.A N LEU 111.A O no hydrogen 3.305 N/A PHE 238.A N VAL 113.A O no hydrogen 3.151 N/A SER 239.A N MET 130.A O no hydrogen 2.730 N/A LEU 240.A N ASN 115.A O no hydrogen 2.674 N/A ILE 241.A N ASP 128.A O no hydrogen 2.951 N/A THR 242.A N ALA 117.A O no hydrogen 3.489 N/A THR 242.A OG1 ALA 117.A O no hydrogen 2.997 N/A THR 242.A OG1 ASN 243.A OD1 no hydrogen 2.440 N/A ALA 268.A N GLY 264.A O no hydrogen 2.580 N/A GLN 269.A N LYS 265.A O no hydrogen 2.770 N/A GLN 269.A N GLN 266.A O no hydrogen 2.904 N/A GLU 272.A N ALA 268.A O no hydrogen 3.229 N/A GLN 273.A N GLN 269.A O no hydrogen 3.029 N/A PHE 274.A N LYS 270.A O no hydrogen 2.978 N/A VAL 275.A N LEU 271.A O no hydrogen 2.638 N/A SER 276.A N GLU 272.A O no hydrogen 3.102 N/A SER 276.A OG GLN 273.A O no hydrogen 3.495 N/A ILE 277.A N GLN 273.A O no hydrogen 3.031 N/A LEU 278.A N VAL 275.A O no hydrogen 3.212 N/A SER 281.A N LEU 278.A O no hydrogen 3.066 N/A ILE 282.A N MET 279.A O no hydrogen 3.438 N/A