Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mqw_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N HIS 3.A ND1 no hydrogen 3.188 N/A CYS 6.A N HIS 3.A ND1 no hydrogen 3.142 N/A HIS 7.A N LEU 14.A O no hydrogen 2.752 N/A CYS 8.A SG VAL 12.A O no hydrogen 3.994 N/A SER 9.A N VAL 12.A O no hydrogen 3.059 N/A VAL 12.A N SER 9.A O no hydrogen 3.330 N/A PHE 13.A N GLU 33.A O no hydrogen 2.831 N/A LEU 14.A N HIS 7.A O no hydrogen 2.856 N/A CYS 15.A N ARG 35.A O no hydrogen 2.790 N/A LYS 19.A NZ ILE 5.A O no hydrogen 3.252 N/A VAL 20.A N GLU 17.A O no hydrogen 2.964 N/A ALA 31.A N PRO 28.A O no hydrogen 3.301 N/A ILE 32.A N ARG 11.A O no hydrogen 2.743 N/A GLU 33.A N ARG 11.A O no hydrogen 3.332 N/A LEU 34.A N LYS 57.A O no hydrogen 3.146 N/A ARG 35.A N PHE 13.A O no hydrogen 2.727 N/A ARG 35.A NE GLU 33.A OE2 no hydrogen 3.513 N/A PHE 36.A N GLU 59.A O no hydrogen 2.726 N/A VAL 37.A N CYS 15.A O no hydrogen 3.216 N/A THR 39.A N ASN 63.A OD1 no hydrogen 2.989 N/A THR 39.A OG1 ASN 63.A OD1 no hydrogen 2.788 N/A LYS 40.A N VAL 20.A O no hydrogen 2.801 N/A LYS 40.A NZ ASP 64.A OD1 no hydrogen 2.813 N/A ILE 44.A N VAL 68.A O no hydrogen 3.404 N/A SER 50.A OG SER 75.A O no hydrogen 3.361 N/A SER 50.A OG SER 75.A OG no hydrogen 2.778 N/A GLY 51.A N ASN 76.A O no hydrogen 3.452 N/A GLY 53.A N GLY 51.A O no hydrogen 2.802 N/A LEU 55.A N PHE 52.A O no hydrogen 3.178 N/A GLU 56.A N ILE 32.A O no hydrogen 2.898 N/A LYS 57.A N ILE 32.A O no hydrogen 3.432 N/A LYS 57.A NZ HIS 81.A NE2 no hydrogen 3.246 N/A LYS 57.A NZ GLU 82.A OE1 no hydrogen 2.811 N/A ILE 58.A N GLU 82.A O no hydrogen 2.919 N/A GLU 59.A N LEU 34.A O no hydrogen 3.015 N/A ILE 60.A N ARG 84.A O no hydrogen 2.745 N/A SER 61.A N PHE 36.A O no hydrogen 2.979 N/A SER 61.A OG GLU 59.A OE2 no hydrogen 2.973 N/A GLN 62.A N GLU 86.A O no hydrogen 3.290 N/A ASN 63.A N LYS 87.A O no hydrogen 3.240 N/A ASN 63.A ND2 PHE 36.A O no hydrogen 3.347 N/A GLU 67.A N ARG 42.A O no hydrogen 2.894 N/A ILE 69.A N TYR 93.A O no hydrogen 3.320 N/A ASP 72.A N GLU 97.A O no hydrogen 2.762 N/A PHE 74.A N ALA 98.A O no hydrogen 2.916 N/A SER 75.A OG SER 50.A OG no hydrogen 2.778 N/A SER 75.A OG ASP 72.A O no hydrogen 3.060 N/A LEU 80.A N LEU 77.A O no hydrogen 3.376 N/A HIS 81.A N GLU 56.A O no hydrogen 2.918 N/A GLU 82.A N GLU 56.A O no hydrogen 3.212 N/A ILE 83.A N TYR 107.A O no hydrogen 3.186 N/A ARG 84.A N ILE 58.A O no hydrogen 2.945 N/A ARG 84.A NE GLU 82.A OE2 no hydrogen 2.910 N/A ARG 84.A NH1 GLU 59.A OE1 no hydrogen 3.049 N/A ARG 84.A NH1 GLU 86.A OE2 no hydrogen 2.917 N/A ARG 84.A NH2 GLU 59.A OE1 no hydrogen 2.784 N/A ILE 85.A N LEU 109.A O no hydrogen 2.801 N/A GLU 86.A N ILE 60.A O no hydrogen 3.005 N/A LYS 87.A N SER 111.A O no hydrogen 3.002 N/A LYS 87.A NZ GLU 86.A OE1 no hydrogen 2.830 N/A ALA 88.A N ASN 112.A O no hydrogen 3.167 N/A ASN 90.A ND2 ASP 64.A O no hydrogen 2.815 N/A LEU 91.A N ALA 88.A O no hydrogen 2.973 N/A LEU 92.A N GLU 67.A O no hydrogen 3.267 N/A ASN 95.A N ILE 69.A O no hydrogen 2.953 N/A GLU 97.A N ASN 95.A OD1 no hydrogen 3.179 N/A ALA 98.A N ASN 95.A O no hydrogen 2.837 N/A GLN 100.A N PHE 74.A O no hydrogen 3.401 N/A GLN 100.A NE2 GLU 97.A O no hydrogen 2.978 N/A GLN 100.A NE2 GLU 97.A OE1 no hydrogen 3.245 N/A LEU 102.A N ILE 124.A O no hydrogen 2.912 N/A LEU 105.A N LEU 102.A O no hydrogen 3.459 N/A GLN 106.A N HIS 81.A O no hydrogen 2.796 N/A TYR 107.A N HIS 81.A O no hydrogen 2.981 N/A LEU 108.A N LEU 131.A O no hydrogen 3.035 N/A LEU 109.A N ILE 83.A O no hydrogen 3.029 N/A ILE 110.A N ASP 133.A O no hydrogen 2.973 N/A SER 111.A N ILE 85.A O no hydrogen 2.839 N/A ASN 112.A N GLN 135.A O no hydrogen 3.058 N/A THR 113.A N ASN 137.A OD1 no hydrogen 3.047 N/A THR 113.A OG1 ASN 137.A OD1 no hydrogen 2.717 N/A LYS 116.A N LEU 92.A O no hydrogen 3.149 N/A HIS 122.A ND1 ASP 120.A OD2 no hydrogen 2.846 N/A LYS 123.A NZ HIS 122.A NE2 no hydrogen 3.347 N/A ILE 124.A N VAL 121.A O no hydrogen 3.030 N/A HIS 125.A N GLY 150.A O no hydrogen 2.850 N/A SER 126.A N LEU 151.A O no hydrogen 3.029 N/A SER 126.A OG PRO 103.A O no hydrogen 3.306 N/A SER 126.A OG LEU 105.A O no hydrogen 2.796 N/A LEU 127.A N PRO 103.A O no hydrogen 2.851 N/A GLN 128.A N SER 126.A OG no hydrogen 3.149 N/A LYS 129.A NZ SER 155.A OG no hydrogen 2.863 N/A LEU 131.A N GLN 106.A O no hydrogen 2.924 N/A LEU 132.A N ILE 157.A O no hydrogen 3.000 N/A ASP 133.A N LEU 108.A O no hydrogen 2.925 N/A ILE 134.A N TRP 159.A O no hydrogen 2.774 N/A GLN 135.A N ILE 110.A O no hydrogen 3.114 N/A GLN 135.A NE2 ASP 133.A OD1 no hydrogen 2.731 N/A ASN 137.A N ASN 163.A OD1 no hydrogen 2.971 N/A ASN 137.A ND2 ILE 110.A O no hydrogen 2.973 N/A ASN 137.A ND2 ASN 163.A OD1 no hydrogen 3.083 N/A ASN 139.A ND2 GLY 114.A O no hydrogen 3.028 N/A ILE 140.A N ASN 137.A O no hydrogen 2.812 N/A HIS 141.A ND1 GLY 164.A O no hydrogen 3.037 N/A ILE 143.A N GLU 167.A O no hydrogen 3.116 N/A ASN 146.A N SER 171.A O no hydrogen 3.191 N/A SER 147.A N ALA 172.A O no hydrogen 3.119 N/A SER 147.A OG GLU 144.A O no hydrogen 2.728 N/A LEU 151.A N PHE 148.A O no hydrogen 3.360 N/A SER 152.A OG SER 126.A O no hydrogen 3.318 N/A SER 152.A OG GLN 128.A O no hydrogen 2.704 N/A SER 152.A OG GLU 154.A O no hydrogen 3.522 N/A PHE 153.A N SER 126.A O no hydrogen 3.065 N/A GLU 154.A N SER 152.A OG no hydrogen 3.068 N/A SER 155.A N GLU 154.A OE1 no hydrogen 2.993 N/A SER 155.A OG ASP 179.A OD1 no hydrogen 3.200 N/A SER 155.A OG ASP 179.A OD2 no hydrogen 2.716 N/A VAL 156.A N GLN 177.A O no hydrogen 2.806 N/A ILE 157.A N VAL 130.A O no hydrogen 2.881 N/A LEU 158.A N GLU 180.A O no hydrogen 2.774 N/A TRP 159.A N LEU 132.A O no hydrogen 2.930 N/A TRP 159.A NE1 GLU 180.A OE2 no hydrogen 2.750 N/A LEU 160.A N ASN 182.A O no hydrogen 2.864 N/A LYS 162.A N SER 184.A O no hydrogen 2.992 N/A ASN 163.A ND2 ILE 134.A O no hydrogen 3.053 N/A ASN 163.A ND2 LEU 160.A O no hydrogen 3.043 N/A GLY 164.A N ILE 140.A O no hydrogen 2.903 N/A ILE 165.A N ASN 186.A OD1 no hydrogen 2.920 N/A GLN 166.A N HIS 141.A O no hydrogen 2.909 N/A GLU 167.A N HIS 141.A O no hydrogen 3.296 N/A HIS 169.A N ILE 143.A O no hydrogen 2.911 N/A SER 171.A N ASP 195.A O no hydrogen 2.812 N/A ALA 172.A N HIS 169.A O no hydrogen 3.283 N/A ASN 174.A N SER 171.A O no hydrogen 2.816 N/A ASN 174.A ND2 ASN 146.A OD1 no hydrogen 2.773 N/A GLY 175.A N GLY 199.A O no hydrogen 2.721 N/A GLN 177.A NE2 PHE 153.A O no hydrogen 3.214 N/A LEU 178.A N SER 201.A O no hydrogen 2.951 N/A ASP 179.A N VAL 156.A O no hydrogen 2.811 N/A LEU 181.A N ILE 205.A O no hydrogen 3.000 N/A ASN 182.A N LEU 158.A O no hydrogen 2.865 N/A LEU 183.A N ASP 207.A O no hydrogen 2.833 N/A SER 184.A N ASN 182.A OD1 no hydrogen 2.906 N/A SER 184.A OG ASN 182.A OD1 no hydrogen 2.721 N/A SER 184.A OG ASP 185.A OD2 no hydrogen 3.466 N/A ASP 185.A N SER 209.A O no hydrogen 3.127 N/A ASN 186.A ND2 LEU 160.A O no hydrogen 2.764 N/A ASN 186.A ND2 LEU 183.A O no hydrogen 3.105 N/A ASN 186.A ND2 SER 184.A O no hydrogen 3.273 N/A ASN 187.A ND2 ARG 210.A O no hydrogen 3.345 N/A ASN 188.A ND2 GLN 166.A OE1 no hydrogen 2.816 N/A ASP 195.A N ASN 170.A OD1 no hydrogen 3.045 N/A VAL 196.A N PRO 193.A O no hydrogen 3.325 N/A HIS 198.A N ASP 195.A O no hydrogen 3.305 N/A SER 201.A N THR 176.A O no hydrogen 3.058 N/A VAL 204.A N ASP 179.A O no hydrogen 2.812 N/A ILE 205.A N ASP 179.A O no hydrogen 3.106 N/A LEU 206.A N LYS 226.A O no hydrogen 3.041 N/A ASP 207.A N LEU 181.A O no hydrogen 3.039 N/A ILE 208.A N ARG 228.A O no hydrogen 2.905 N/A SER 209.A N ASP 207.A OD1 no hydrogen 3.012 N/A SER 209.A OG ASP 207.A OD1 no hydrogen 2.683 N/A ARG 210.A N ARG 230.A O no hydrogen 2.782 N/A ARG 210.A NE ASP 185.A OD1 no hydrogen 2.794 N/A ARG 210.A NE ASP 185.A OD2 no hydrogen 3.144 N/A ARG 210.A NH2 ASP 185.A OD2 no hydrogen 2.937 N/A THR 211.A OG1 ILE 208.A O no hydrogen 2.769 N/A ARG 212.A NH1 GLU 190.A OE2 no hydrogen 3.399 N/A HIS 214.A NE2 GLU 190.A OE1 no hydrogen 3.159 N/A SER 218.A N ASN 194.A OD1 no hydrogen 3.137 N/A SER 218.A OG ASN 194.A OD1 no hydrogen 3.233 N/A TYR 219.A OH ASP 195.A OD1 no hydrogen 2.723 N/A GLY 220.A N GLU 222.A OE1 no hydrogen 2.818 N/A LEU 224.A N LEU 221.A O no hydrogen 3.080 N/A LYS 225.A N VAL 204.A O no hydrogen 2.754 N/A LYS 226.A N VAL 204.A O no hydrogen 3.118 N/A LYS 226.A NZ GLU 249.A OE2 no hydrogen 3.293 N/A LEU 227.A N GLU 249.A O no hydrogen 3.209 N/A ARG 228.A N LEU 206.A O no hydrogen 2.845 N/A ARG 228.A NH1 GLU 249.A OE1 no hydrogen 2.909 N/A ALA 229.A N SER 251.A O no hydrogen 2.767 N/A ARG 230.A N SER 209.A OG no hydrogen 2.756 N/A THR 232.A N THR 253.A OG1 no hydrogen 2.955 N/A THR 232.A OG1 ILE 208.A O no hydrogen 2.738 N/A THR 232.A OG1 ARG 230.A O no hydrogen 3.072 N/A LEU 235.A N THR 232.A O no hydrogen 3.295 N/A LYS 243.A N THR 240.A O no hydrogen 2.776 N/A LYS 243.A NZ GLU 242.A OE2 no hydrogen 3.330 N/A LEU 244.A N THR 240.A O no hydrogen 3.152 N/A LEU 247.A N LEU 244.A O no hydrogen 2.786 N/A MET 248.A N LYS 225.A O no hydrogen 2.815 N/A GLU 249.A N LYS 225.A O no hydrogen 3.125 N/A ALA 250.A N THR 277.A O no hydrogen 2.967 N/A SER 251.A N LEU 227.A O no hydrogen 2.958 N/A LEU 252.A N SER 279.A O no hydrogen 2.809 N/A THR 253.A OG1 ALA 229.A O no hydrogen 2.883 N/A TYR 254.A OH TYR 233.A O no hydrogen 2.647 N/A HIS 257.A N TYR 254.A O no hydrogen 3.060 N/A HIS 257.A NE2 LYS 236.A O no hydrogen 2.994 N/A CYS 258.A N PRO 255.A O no hydrogen 3.187 N/A CYS 258.A SG PRO 280.A O no hydrogen 3.095 N/A CYS 259.A N PRO 255.A O no hydrogen 3.304 N/A CYS 259.A SG PRO 255.A O no hydrogen 3.419 N/A ALA 260.A N SER 256.A O no hydrogen 3.378 N/A PHE 261.A N CYS 258.A O no hydrogen 2.949 N/A ALA 262.A N CYS 258.A O no hydrogen 3.119 N/A ALA 262.A N CYS 259.A O no hydrogen 3.308 N/A CYS 267.A SG LEU 272.A O no hydrogen 3.890 N/A CYS 273.A N ASP 271.A O no hydrogen 2.771 N/A THR 277.A N MET 248.A O no hydrogen 3.023 N/A THR 277.A OG1 MET 248.A O no hydrogen 3.484 N/A CYS 278.A SG ALA 250.A O no hydrogen 3.381 N/A SER 279.A N ALA 250.A O no hydrogen 3.206 N/A