Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ula_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N THR 11.A O no hydrogen 3.119 N/A VAL 7.A N THR 11.A O no hydrogen 3.350 N/A ASN 9.A N TYR 12.A OH no hydrogen 2.920 N/A ILE 10.A N VAL 7.A O no hydrogen 3.136 N/A THR 11.A N VAL 7.A O no hydrogen 2.907 N/A TYR 12.A N ASN 32.A O no hydrogen 3.049 N/A TYR 12.A OH GLU 5.A OE1 no hydrogen 2.800 N/A GLN 13.A N VAL 4.A O no hydrogen 3.184 N/A GLU 16.A N SER 36.A O no hydrogen 3.301 N/A ASN 18.A ND2 ASN 18.A O no hydrogen 2.518 N/A SER 29.A OG ASN 9.A O no hydrogen 2.934 N/A THR 30.A OG1 PRO 27.A O no hydrogen 3.353 N/A LYS 31.A N ILE 10.A O no hydrogen 2.871 N/A ASN 32.A N ILE 10.A O no hydrogen 3.005 N/A ASN 32.A ND2 THR 11.A OG1 no hydrogen 3.314 N/A LEU 33.A N VAL 56.A O no hydrogen 3.121 N/A ASP 34.A N TYR 12.A O no hydrogen 3.204 N/A LEU 35.A N ASP 58.A O no hydrogen 2.930 N/A SER 36.A N ASP 34.A OD1 no hydrogen 3.080 N/A SER 36.A OG ASP 34.A OD1 no hydrogen 3.095 N/A SER 36.A OG ASP 34.A OD2 no hydrogen 3.567 N/A TRP 37.A N SER 60.A O no hydrogen 2.984 N/A ASN 38.A ND2 CYS 14.A O no hydrogen 3.083 N/A ASN 38.A ND2 LEU 35.A O no hydrogen 3.312 N/A LEU 40.A N ASN 38.A O no hydrogen 2.301 N/A HIS 42.A N LEU 40.A O no hydrogen 2.305 N/A LEU 43.A N THR 66.A O no hydrogen 3.178 N/A TYR 46.A N GLY 70.A O no hydrogen 3.043 N/A SER 47.A N GLY 44.A O no hydrogen 2.811 N/A SER 47.A OG GLY 44.A O no hydrogen 2.487 N/A PHE 49.A N TYR 46.A O no hydrogen 2.949 N/A PHE 51.A N PHE 48.A O no hydrogen 2.925 N/A LEU 54.A N PHE 51.A O no hydrogen 2.966 N/A GLN 55.A N LYS 31.A O no hydrogen 2.613 N/A VAL 56.A N LYS 31.A O no hydrogen 3.187 N/A LEU 57.A N THR 80.A O no hydrogen 3.364 N/A ASP 58.A N LEU 33.A O no hydrogen 3.174 N/A LEU 59.A N ILE 82.A O no hydrogen 2.897 N/A SER 60.A N ASP 58.A OD1 no hydrogen 2.835 N/A SER 60.A OG ASP 58.A OD1 no hydrogen 2.740 N/A ARG 61.A N THR 84.A O no hydrogen 2.774 N/A CYS 62.A N ASN 86.A OD1 no hydrogen 2.562 N/A CYS 62.A SG LEU 35.A O no hydrogen 2.948 N/A CYS 62.A SG SER 60.A O no hydrogen 3.255 N/A GLN 65.A N ARG 41.A O no hydrogen 2.842 N/A GLU 68.A N LEU 43.A O no hydrogen 3.482 N/A GLN 73.A N GLY 70.A O no hydrogen 2.947 N/A LEU 75.A N TYR 72.A O no hydrogen 2.784 N/A LEU 78.A N LEU 75.A O no hydrogen 3.044 N/A SER 79.A N GLN 55.A O no hydrogen 2.894 N/A SER 79.A OG GLN 55.A O no hydrogen 3.228 N/A THR 80.A N GLN 55.A O no hydrogen 3.239 N/A ILE 82.A N LEU 57.A O no hydrogen 3.025 N/A LEU 83.A N VAL 106.A O no hydrogen 3.232 N/A GLY 85.A N VAL 108.A O no hydrogen 2.830 N/A ASN 86.A ND2 LEU 59.A O no hydrogen 2.946 N/A ILE 88.A N ASN 86.A O no hydrogen 2.318 N/A SER 90.A OG GLN 65.A O no hydrogen 3.261 N/A ALA 92.A N ILE 67.A O no hydrogen 2.867 N/A ALA 95.A N ALA 92.A O no hydrogen 2.741 N/A SER 97.A N GLY 94.A O no hydrogen 2.770 N/A LEU 99.A N PHE 96.A O no hydrogen 3.063 N/A SER 100.A OG SER 76.A O no hydrogen 3.390 N/A LEU 102.A N LEU 99.A O no hydrogen 3.173 N/A GLN 103.A N SER 79.A O no hydrogen 2.653 N/A LYS 104.A N SER 79.A O no hydrogen 2.718 N/A LEU 105.A N GLU 128.A O no hydrogen 2.957 N/A ALA 107.A N ASN 130.A O no hydrogen 2.906 N/A GLU 109.A N ALA 132.A O no hydrogen 3.005 N/A THR 110.A N ASN 134.A OD1 no hydrogen 3.285 N/A THR 110.A OG1 ALA 107.A O no hydrogen 3.288 N/A LEU 112.A N ASN 134.A OD1 no hydrogen 2.699 N/A GLU 116.A N SER 114.A OG no hydrogen 2.942 N/A PHE 118.A N LEU 115.A O no hydrogen 3.298 N/A ILE 120.A N PHE 118.A O no hydrogen 2.573 N/A LEU 123.A N ILE 120.A O no hydrogen 2.459 N/A LYS 124.A N HIS 122.A O no hydrogen 2.856 N/A THR 125.A OG1 SER 100.A O no hydrogen 2.752 N/A THR 125.A OG1 LEU 102.A O no hydrogen 2.900 N/A LEU 126.A N LEU 123.A O no hydrogen 3.448 N/A LYS 127.A N GLN 103.A O no hydrogen 2.630 N/A LYS 127.A NZ GLU 152.A OE1 no hydrogen 3.129 N/A LYS 127.A NZ GLU 152.A OE2 no hydrogen 3.084 N/A GLU 128.A N GLN 103.A O no hydrogen 3.039 N/A LEU 129.A N HIS 153.A O no hydrogen 3.446 N/A ASN 130.A N LEU 105.A O no hydrogen 3.182 N/A VAL 131.A N ASP 155.A O no hydrogen 3.325 N/A HIS 133.A N SER 157.A O no hydrogen 2.949 N/A ASN 134.A N ASN 159.A OD1 no hydrogen 3.403 N/A ASN 134.A ND2 ALA 107.A O no hydrogen 3.480 N/A ASN 134.A ND2 VAL 131.A O no hydrogen 3.100 N/A ASN 134.A ND2 ALA 132.A O no hydrogen 2.653 N/A LEU 135.A N LEU 112.A O no hydrogen 2.511 N/A TYR 144.A OH LEU 115.A O no hydrogen 2.374 N/A PHE 145.A N PRO 142.A O no hydrogen 2.865 N/A SER 146.A N GLU 143.A O no hydrogen 2.855 N/A SER 146.A OG GLU 143.A O no hydrogen 2.632 N/A LEU 148.A N PHE 145.A O no hydrogen 2.671 N/A THR 149.A OG1 THR 149.A O no hydrogen 2.548 N/A ASN 150.A N LEU 148.A O no hydrogen 2.636 N/A LEU 151.A N LEU 148.A O no hydrogen 2.880 N/A GLU 152.A N LYS 127.A O no hydrogen 2.913 N/A LEU 154.A N SER 181.A O no hydrogen 3.039 N/A ASP 155.A N LEU 129.A O no hydrogen 3.403 N/A LEU 156.A N ASP 183.A O no hydrogen 3.067 N/A SER 157.A N ASP 155.A OD1 no hydrogen 2.781 N/A SER 157.A OG ASP 155.A OD1 no hydrogen 2.443 N/A SER 157.A OG ASP 155.A OD2 no hydrogen 3.460 N/A SER 158.A N SER 185.A O no hydrogen 2.893 N/A ASN 159.A N ASN 187.A OD1 no hydrogen 2.902 N/A LYS 160.A N ILE 136.A O no hydrogen 2.645 N/A ILE 161.A N ASN 187.A OD1 no hydrogen 3.429 N/A ILE 164.A N PHE 191.A O no hydrogen 3.034 N/A CYS 166.A N GLN 193.A OE1 no hydrogen 2.517 N/A CYS 166.A SG PRO 194.A O no hydrogen 3.360 N/A LEU 169.A N CYS 166.A O no hydrogen 3.109 N/A ARG 170.A N THR 167.A O no hydrogen 2.659 N/A LEU 172.A N LEU 169.A O no hydrogen 2.896 N/A HIS 173.A N ARG 170.A O no hydrogen 2.706 N/A HIS 173.A ND1 GLU 199.A O no hydrogen 3.155 N/A GLN 174.A N VAL 171.A O no hydrogen 3.122 N/A MET 175.A N LEU 172.A O no hydrogen 2.579 N/A SER 181.A N GLU 152.A O no hydrogen 2.878 N/A LEU 182.A N GLU 204.A O no hydrogen 2.848 N/A ASP 183.A N LEU 154.A O no hydrogen 3.208 N/A LEU 184.A N ALA 206.A O no hydrogen 2.898 N/A SER 185.A N ASP 183.A OD1 no hydrogen 2.796 N/A SER 185.A OG ASP 183.A OD1 no hydrogen 2.524 N/A SER 185.A OG ASP 208.A OD1 no hydrogen 2.808 N/A LEU 186.A N ASP 208.A O no hydrogen 3.161 N/A ASN 187.A N ASN 210.A OD1 no hydrogen 3.402 N/A ASN 187.A ND2 LEU 156.A O no hydrogen 2.961 N/A ASN 190.A N GLN 162.A O no hydrogen 3.231 N/A GLN 193.A N ILE 164.A O no hydrogen 2.933 N/A ALA 196.A N GLN 193.A O no hydrogen 3.243 N/A GLU 199.A N ARG 222.A O no hydrogen 3.328 N/A ARG 201.A NE ASN 179.A OD1 no hydrogen 3.210 N/A ARG 201.A NH2 ASN 179.A OD1 no hydrogen 3.136 N/A LYS 203.A N LEU 180.A O no hydrogen 2.885 N/A LEU 205.A N LYS 228.A O no hydrogen 3.154 N/A ALA 206.A N LEU 182.A O no hydrogen 3.113 N/A LEU 207.A N TRP 230.A O no hydrogen 3.051 N/A THR 209.A N HIS 232.A O no hydrogen 3.127 N/A THR 209.A OG1 ASP 208.A OD2 no hydrogen 2.951 N/A ASN 210.A ND2 LEU 184.A O no hydrogen 2.921 N/A GLN 211.A N MET 189.A O no hydrogen 2.501 N/A ASP 217.A N ASP 217.A OD1 no hydrogen 2.536 N/A ILE 219.A N PRO 216.A O no hydrogen 2.753 N/A ASP 221.A N TYR 245.A OH no hydrogen 3.338 N/A GLN 227.A N LYS 203.A O no hydrogen 2.734 N/A LYS 228.A N LYS 203.A O no hydrogen 3.428 N/A ILE 229.A N LYS 256.A O no hydrogen 2.986 N/A TRP 230.A N LEU 205.A O no hydrogen 3.118 N/A HIS 232.A ND1 THR 233.A OG1 no hydrogen 3.212 N/A THR 233.A OG1 HIS 232.A ND1 no hydrogen 3.212 N/A TRP 236.A NE1 LEU 231.A O no hydrogen 3.010 N/A ASP 237.A N LYS 213.A O no hydrogen 2.805 N/A SER 239.A OG ASP 237.A OD1 no hydrogen 3.454 N/A SER 239.A OG ASP 237.A OD2 no hydrogen 2.970 N/A ARG 242.A NH1 ASP 237.A OD2 no hydrogen 2.762 N/A ILE 243.A N SER 239.A O no hydrogen 3.015 N/A ASP 244.A N PRO 241.A O no hydrogen 2.985 N/A TYR 245.A OH ASP 221.A OD1 no hydrogen 2.562 N/A SER 247.A N ILE 243.A O no hydrogen 3.232 N/A SER 247.A OG ILE 243.A O no hydrogen 3.297 N/A SER 247.A OG ASP 244.A O no hydrogen 2.458 N/A SER 247.A OG ILE 273.A O no hydrogen 3.445 N/A ARG 248.A N ASP 244.A O no hydrogen 3.136 N/A ARG 248.A NE ASP 244.A OD1 no hydrogen 3.248 N/A ARG 248.A NE ASP 244.A OD2 no hydrogen 3.034 N/A TRP 249.A N TYR 245.A O no hydrogen 3.013 N/A LEU 250.A N LEU 246.A O no hydrogen 2.857 N/A ASN 251.A N SER 247.A O no hydrogen 3.272 N/A ASN 251.A ND2 SER 247.A O no hydrogen 2.893 N/A ASN 251.A ND2 ARG 271.A O no hydrogen 3.054 N/A LYS 252.A N ARG 248.A O no hydrogen 2.966 N/A ASN 253.A N TRP 249.A O no hydrogen 2.787 N/A ASN 253.A ND2 TRP 249.A O no hydrogen 2.590 N/A GLN 255.A NE2 LYS 252.A O no hydrogen 3.370 N/A LYS 256.A N ASN 253.A O no hydrogen 2.712 N/A GLU 257.A N ASN 253.A O no hydrogen 3.350 N/A GLN 258.A N ILE 229.A O no hydrogen 3.024 N/A ALA 261.A N GLU 257.A OE1 no hydrogen 2.916 N/A CYS 263.A SG LYS 268.A O no hydrogen 2.832 N/A SER 264.A N TRP 236.A O no hydrogen 2.932 N/A SER 264.A OG TRP 236.A O no hydrogen 2.400 N/A GLY 267.A N CYS 263.A O no hydrogen 2.501 N/A LYS 268.A N SER 266.A OG no hydrogen 3.280 N/A VAL 270.A N ALA 261.A O no hydrogen 2.973 N/A ARG 271.A NH2 SER 260.A OG no hydrogen 2.867 N/A SER 272.A N PRO 269.A O no hydrogen 3.205 N/A SER 272.A OG PRO 269.A O no hydrogen 3.346 N/A ILE 273.A N VAL 270.A O no hydrogen 3.071 N/A