Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pqw_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 7.A N ARG 313.A O no hydrogen 2.460 N/A ARG 9.A N GLU 311.A O no hydrogen 3.267 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.974 N/A LYS 13.A NZ GLU 50.A O no hydrogen 2.463 N/A TYR 14.A N VAL 309.A O no hydrogen 2.984 N/A LEU 16.A N VAL 307.A O no hydrogen 2.860 N/A HIS 19.A ND1 ASP 41.A OD2 no hydrogen 2.903 N/A HIS 19.A NE2 SER 37.A OG no hydrogen 3.153 N/A ARG 20.A N ASP 41.A OD2 no hydrogen 3.415 N/A VAL 23.A N SER 302.A O no hydrogen 3.208 N/A THR 24.A N ALA 38.A O no hydrogen 2.867 N/A THR 24.A OG1 ALA 38.A O no hydrogen 3.155 N/A THR 24.A OG1 VAL 65.A O no hydrogen 3.384 N/A THR 24.A OG1 GLN 66.A O no hydrogen 2.962 N/A ARG 25.A N ALA 38.A O no hydrogen 3.338 N/A ARG 25.A NH1 SER 288.A OG no hydrogen 2.778 N/A ILE 27.A N VAL 36.A O no hydrogen 3.242 N/A PHE 28.A N ASP 290.A OD2 no hydrogen 2.907 N/A HIS 29.A N VAL 34.A O no hydrogen 2.801 N/A VAL 31.A N HIS 29.A ND1 no hydrogen 3.281 N/A PHE 32.A N HIS 29.A ND1 no hydrogen 3.095 N/A MET 35.A N TRP 47.A O no hydrogen 2.921 N/A VAL 36.A N ILE 27.A O no hydrogen 2.989 N/A SER 37.A N LYS 45.A O no hydrogen 2.855 N/A SER 37.A OG HIS 19.A NE2 no hydrogen 3.153 N/A SER 37.A OG LYS 45.A O no hydrogen 3.373 N/A ALA 38.A N ARG 25.A O no hydrogen 2.855 N/A SER 39.A OG SER 21.A O no hydrogen 2.888 N/A SER 39.A OG PRO 22.A O no hydrogen 2.603 N/A GLU 40.A N PRO 22.A O no hydrogen 2.654 N/A THR 43.A N ASP 41.A OD1 no hydrogen 3.373 N/A THR 43.A OG1 ASP 41.A OD1 no hydrogen 2.712 N/A THR 43.A OG1 ASP 41.A OD2 no hydrogen 3.214 N/A ILE 44.A N LEU 58.A O no hydrogen 2.902 N/A LYS 45.A N SER 37.A O no hydrogen 2.896 N/A LYS 45.A NZ THR 57.A OG1 no hydrogen 3.225 N/A VAL 46.A N ARG 56.A O no hydrogen 2.831 N/A TRP 47.A N MET 35.A O no hydrogen 2.884 N/A ASP 48.A N ASP 53.A O no hydrogen 2.724 N/A GLU 50.A N ASP 48.A OD1 no hydrogen 3.327 N/A ASP 53.A N ASP 48.A O no hydrogen 3.098 N/A GLU 55.A N VAL 46.A O no hydrogen 2.898 N/A ARG 56.A N VAL 46.A O no hydrogen 2.962 N/A LEU 58.A N ILE 44.A O no hydrogen 2.883 N/A HIS 61.A ND1 ASP 83.A OD2 no hydrogen 3.153 N/A HIS 61.A NE2 SER 79.A O no hydrogen 2.919 N/A THR 62.A OG1 THR 62.A O no hydrogen 2.464 N/A SER 64.A N ASP 63.A OD1 no hydrogen 2.873 N/A SER 64.A OG GLU 40.A O no hydrogen 2.313 N/A GLN 66.A N CYS 80.A O no hydrogen 2.891 N/A ILE 68.A N ASP 67.A OD1 no hydrogen 2.955 N/A SER 69.A N ALA 78.A O no hydrogen 2.874 N/A SER 69.A OG PHE 70.A O no hydrogen 2.927 N/A SER 73.A OG ASP 71.A OD2 no hydrogen 2.336 N/A LYS 75.A N SER 73.A OG no hydrogen 3.252 N/A LYS 75.A NZ ASP 90.A OD1 no hydrogen 2.994 N/A LEU 76.A N ASP 71.A OD1 no hydrogen 2.811 N/A LEU 77.A N TRP 89.A O no hydrogen 2.922 N/A ALA 78.A N SER 69.A O no hydrogen 2.700 N/A SER 79.A N LYS 87.A O no hydrogen 2.903 N/A SER 79.A OG HIS 61.A NE2 no hydrogen 2.972 N/A SER 79.A OG LYS 87.A O no hydrogen 2.774 N/A CYS 80.A N ASP 67.A O no hydrogen 3.014 N/A CYS 80.A SG ASP 67.A O no hydrogen 3.398 N/A CYS 80.A SG VAL 107.A O no hydrogen 3.325 N/A SER 81.A OG SER 64.A O no hydrogen 2.582 N/A ALA 82.A N SER 64.A O no hydrogen 2.968 N/A THR 85.A N ASP 83.A OD1 no hydrogen 3.378 N/A THR 85.A OG1 HIS 61.A ND1 no hydrogen 3.236 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 2.772 N/A ILE 86.A N MET 100.A O no hydrogen 2.936 N/A LYS 87.A N SER 79.A O no hydrogen 2.918 N/A LYS 87.A NZ THR 99.A OG1 no hydrogen 2.433 N/A LEU 88.A N ARG 98.A O no hydrogen 2.947 N/A TRP 89.A N LEU 77.A O no hydrogen 2.850 N/A TRP 89.A NE1 SER 79.A OG no hydrogen 2.800 N/A ASP 90.A N GLU 95.A O no hydrogen 2.843 N/A PHE 91.A N LYS 75.A O no hydrogen 2.757 N/A GLY 93.A N ASP 90.A OD2 no hydrogen 3.114 N/A GLU 95.A N ASP 90.A O no hydrogen 3.385 N/A CYS 96.A SG LEU 88.A O no hydrogen 3.424 N/A CYS 96.A SG ARG 98.A O no hydrogen 3.343 N/A ILE 97.A N LEU 88.A O no hydrogen 2.484 N/A ARG 98.A NH1 VAL 133.A O no hydrogen 2.307 N/A MET 100.A N ILE 86.A O no hydrogen 2.814 N/A HIS 103.A NE2 SER 121.A OG no hydrogen 2.697 N/A ASP 104.A N ASP 125.A OD2 no hydrogen 3.335 N/A SER 108.A OG VAL 149.A O no hydrogen 2.547 N/A SER 108.A OG ARG 150.A O no hydrogen 3.125 N/A SER 109.A N ALA 122.A O no hydrogen 2.849 N/A SER 109.A OG ASP 67.A OD2 no hydrogen 3.398 N/A ALA 111.A N VAL 120.A O no hydrogen 2.804 N/A GLY 116.A N MET 113.A O no hydrogen 3.247 N/A ASP 117.A N ASN 115.A OD1 no hydrogen 2.959 N/A ILE 119.A N TRP 131.A O no hydrogen 2.870 N/A VAL 120.A N ALA 111.A O no hydrogen 2.857 N/A SER 121.A N LYS 129.A O no hydrogen 2.957 N/A SER 121.A OG HIS 103.A NE2 no hydrogen 2.697 N/A SER 121.A OG LYS 129.A O no hydrogen 3.082 N/A SER 123.A OG ASN 106.A O no hydrogen 2.719 N/A SER 123.A OG ASP 125.A OD1 no hydrogen 3.257 N/A ARG 124.A N ASN 106.A O no hydrogen 2.591 N/A LYS 126.A NZ ARG 146.A O no hydrogen 3.305 N/A THR 127.A OG1 ASP 125.A O no hydrogen 3.518 N/A THR 127.A OG1 ASP 125.A OD1 no hydrogen 2.739 N/A ILE 128.A N PHE 142.A O no hydrogen 2.932 N/A LYS 129.A N SER 121.A O no hydrogen 2.932 N/A TRP 131.A N ILE 119.A O no hydrogen 2.846 N/A TRP 131.A NE1 SER 121.A OG no hydrogen 2.356 N/A GLU 132.A N TYR 137.A O no hydrogen 2.834 N/A VAL 133.A N ASP 117.A O no hydrogen 3.072 N/A GLN 134.A N GLU 132.A OE2 no hydrogen 2.634 N/A GLY 136.A N GLU 132.A O no hydrogen 3.250 N/A TYR 137.A N THR 135.A OG1 no hydrogen 3.175 N/A CYS 138.A SG MET 130.A O no hydrogen 3.671 N/A CYS 138.A SG LYS 140.A O no hydrogen 3.852 N/A VAL 139.A N MET 130.A O no hydrogen 2.825 N/A LYS 140.A N MET 130.A O no hydrogen 3.465 N/A HIS 145.A NE2 SER 163.A OG no hydrogen 3.034 N/A ARG 146.A N ASP 167.A OD2 no hydrogen 3.231 N/A ARG 146.A NE ASP 167.A OD2 no hydrogen 3.423 N/A VAL 149.A N SER 123.A O no hydrogen 3.384 N/A ARG 150.A N CYS 164.A O no hydrogen 2.855 N/A ARG 150.A NE ASN 166.A OD1 no hydrogen 2.920 N/A VAL 152.A N SER 109.A OG no hydrogen 3.171 N/A ARG 153.A N ALA 162.A O no hydrogen 2.869 N/A ARG 153.A NH1 VAL 110.A O no hydrogen 3.539 N/A ARG 153.A NH2 ASP 67.A OD2 no hydrogen 2.896 N/A ASN 155.A N LEU 160.A O no hydrogen 2.735 N/A GLN 156.A N ASN 155.A OD1 no hydrogen 2.799 N/A GLY 158.A N ASN 155.A O no hydrogen 3.139 N/A ILE 161.A N TRP 173.A O no hydrogen 2.898 N/A ALA 162.A N ARG 153.A O no hydrogen 2.825 N/A SER 163.A N ARG 171.A O no hydrogen 2.918 N/A SER 163.A OG HIS 145.A NE2 no hydrogen 3.034 N/A SER 163.A OG ARG 171.A O no hydrogen 3.260 N/A CYS 164.A N MET 151.A O no hydrogen 3.255 N/A CYS 164.A SG MET 151.A O no hydrogen 3.226 N/A CYS 164.A SG VAL 191.A O no hydrogen 3.294 N/A SER 165.A N THR 169.A O no hydrogen 3.388 N/A SER 165.A OG TRP 148.A O no hydrogen 2.643 N/A SER 165.A OG ASP 167.A OD1 no hydrogen 3.107 N/A ASN 166.A N TRP 148.A O no hydrogen 2.445 N/A THR 169.A OG1 ASP 167.A OD1 no hydrogen 2.425 N/A VAL 170.A N LEU 184.A O no hydrogen 2.953 N/A ARG 171.A N SER 163.A O no hydrogen 2.890 N/A ARG 171.A NH2 GLU 183.A OE2 no hydrogen 3.156 N/A VAL 172.A N ALA 182.A O no hydrogen 2.917 N/A TRP 173.A N ILE 161.A O no hydrogen 2.851 N/A CYS 180.A SG VAL 172.A O no hydrogen 3.869 N/A LYS 181.A N VAL 172.A O no hydrogen 2.803 N/A LEU 184.A N VAL 170.A O no hydrogen 2.836 N/A HIS 187.A NE2 SER 216.A OG no hydrogen 2.456 N/A GLU 188.A N ASP 220.A OD2 no hydrogen 3.215 N/A VAL 191.A N SER 165.A O no hydrogen 3.361 N/A CYS 193.A N GLY 217.A O no hydrogen 3.010 N/A CYS 193.A SG GLY 217.A O no hydrogen 3.542 N/A CYS 193.A SG VAL 244.A O no hydrogen 4.038 N/A CYS 193.A SG ARG 245.A O no hydrogen 3.331 N/A SER 195.A N LEU 215.A O no hydrogen 3.278 N/A TRP 196.A NE1 ARG 153.A O no hydrogen 2.729 N/A ALA 197.A N PHE 213.A O no hydrogen 3.362 N/A SER 201.A OG PRO 198.A O no hydrogen 2.623 N/A TYR 202.A N GLU 199.A O no hydrogen 2.945 N/A SER 203.A OG SER 200.A O no hydrogen 3.333 N/A SER 204.A OG SER 200.A O no hydrogen 3.402 N/A SER 204.A OG GLY 253.A O no hydrogen 3.160 N/A ILE 205.A N SER 201.A O no hydrogen 2.931 N/A SER 206.A N SER 203.A O no hydrogen 2.919 N/A SER 206.A OG TYR 202.A O no hydrogen 2.586 N/A ALA 208.A N ILE 205.A O no hydrogen 2.880 N/A THR 209.A N ILE 205.A O no hydrogen 3.076 N/A LEU 214.A N TRP 226.A O no hydrogen 2.922 N/A LEU 215.A N SER 195.A O no hydrogen 2.764 N/A SER 216.A N LYS 224.A O no hydrogen 2.921 N/A SER 216.A OG HIS 187.A NE2 no hydrogen 2.456 N/A SER 216.A OG LYS 224.A O no hydrogen 3.408 N/A GLY 217.A N CYS 193.A O no hydrogen 2.611 N/A SER 218.A OG VAL 190.A O no hydrogen 2.706 N/A ARG 219.A N VAL 190.A O no hydrogen 3.098 N/A ARG 219.A NH2 GLU 192.A OE2 no hydrogen 3.154 N/A THR 222.A N ASP 220.A OD1 no hydrogen 3.336 N/A THR 222.A OG1 ASP 220.A OD1 no hydrogen 2.689 N/A ILE 223.A N LEU 237.A O no hydrogen 2.899 N/A LYS 224.A N SER 216.A O no hydrogen 2.896 N/A MET 225.A N MET 235.A O no hydrogen 2.881 N/A TRP 226.A N LEU 214.A O no hydrogen 2.880 N/A TRP 226.A NE1 SER 216.A OG no hydrogen 2.444 N/A VAL 228.A N PRO 212.A O no hydrogen 2.958 N/A SER 229.A OG ASP 227.A OD2 no hydrogen 2.804 N/A GLY 231.A N ASP 227.A O no hydrogen 2.781 N/A CYS 233.A SG MET 235.A O no hydrogen 3.336 N/A CYS 233.A SG THR 236.A OG1 no hydrogen 3.073 N/A LEU 234.A N MET 225.A O no hydrogen 2.600 N/A LEU 237.A N ILE 223.A O no hydrogen 2.851 N/A HIS 240.A NE2 SER 258.A OG no hydrogen 3.104 N/A ASP 241.A N ASP 262.A OD2 no hydrogen 2.879 N/A TRP 243.A N ASN 242.A OD1 no hydrogen 2.856 N/A VAL 244.A N SER 218.A O no hydrogen 3.159 N/A ARG 245.A N CYS 259.A O no hydrogen 2.903 N/A GLY 246.A N CYS 259.A O no hydrogen 3.348 N/A LEU 248.A N LEU 257.A O no hydrogen 2.687 N/A HIS 250.A N PHE 255.A O no hydrogen 2.898 N/A HIS 250.A NE2 TRP 6.A O no hydrogen 2.427 N/A SER 251.A OG LYS 293.A O no hydrogen 3.105 N/A GLY 252.A N HIS 250.A ND1 no hydrogen 3.095 N/A GLY 253.A N HIS 250.A O no hydrogen 3.358 N/A ILE 256.A N TRP 268.A O no hydrogen 2.887 N/A LEU 257.A N LEU 248.A O no hydrogen 2.640 N/A SER 258.A N ARG 266.A O no hydrogen 2.925 N/A SER 258.A OG HIS 240.A NE2 no hydrogen 3.104 N/A SER 258.A OG ARG 266.A O no hydrogen 3.134 N/A CYS 259.A N GLY 246.A O no hydrogen 2.758 N/A CYS 259.A SG GLY 246.A O no hydrogen 3.662 N/A CYS 259.A SG VAL 286.A O no hydrogen 3.526 N/A CYS 259.A SG THR 287.A O no hydrogen 3.849 N/A ALA 260.A N THR 264.A O no hydrogen 2.977 N/A ASP 261.A N TRP 243.A O no hydrogen 2.815 N/A THR 264.A OG1 ASP 262.A OD1 no hydrogen 2.360 N/A LEU 265.A N LEU 279.A O no hydrogen 2.914 N/A ARG 266.A N SER 258.A O no hydrogen 2.872 N/A VAL 267.A N LYS 277.A O no hydrogen 2.972 N/A TRP 268.A N ILE 256.A O no hydrogen 2.853 N/A TRP 268.A NE1 SER 258.A OG no hydrogen 3.106 N/A ASP 269.A N ARG 274.A O no hydrogen 3.408 N/A LYS 271.A N ASP 269.A OD1 no hydrogen 3.445 N/A LYS 271.A NZ SER 204.A O no hydrogen 2.905 N/A LYS 273.A N ASP 269.A O no hydrogen 2.876 N/A CYS 275.A SG VAL 267.A O no hydrogen 3.412 N/A CYS 275.A SG LYS 277.A O no hydrogen 3.287 N/A CYS 275.A SG THR 278.A OG1 no hydrogen 3.225 N/A MET 276.A N VAL 267.A O no hydrogen 3.240 N/A LEU 279.A N LEU 265.A O no hydrogen 2.832 N/A HIS 282.A ND1 ASP 304.A OD2 no hydrogen 2.747 N/A PHE 285.A N HIS 284.A ND1 no hydrogen 2.953 N/A THR 287.A OG1 VAL 23.A O no hydrogen 2.300 N/A THR 287.A OG1 THR 24.A O no hydrogen 3.195 N/A THR 287.A OG1 GLY 301.A O no hydrogen 2.816 N/A SER 288.A N GLY 301.A O no hydrogen 2.945 N/A SER 288.A OG LEU 289.A O no hydrogen 3.272 N/A ASP 290.A N VAL 299.A O no hydrogen 2.868 N/A HIS 292.A N TYR 297.A O no hydrogen 3.005 N/A THR 294.A N HIS 292.A ND1 no hydrogen 3.172 N/A ALA 295.A N HIS 292.A ND1 no hydrogen 3.074 N/A TYR 297.A N ALA 295.A O no hydrogen 2.835 N/A VAL 298.A N TRP 310.A O no hydrogen 2.915 N/A VAL 299.A N ASP 290.A O no hydrogen 2.886 N/A THR 300.A N LYS 308.A O no hydrogen 2.869 N/A THR 300.A OG1 LYS 308.A O no hydrogen 2.842 N/A GLY 301.A N SER 288.A O no hydrogen 2.880 N/A SER 302.A OG PHE 285.A O no hydrogen 2.519 N/A SER 302.A OG ASP 304.A OD1 no hydrogen 3.009 N/A VAL 303.A N PHE 285.A O no hydrogen 2.731 N/A ASP 304.A N SER 302.A OG no hydrogen 3.414 N/A THR 306.A OG1 HIS 282.A ND1 no hydrogen 3.174 N/A THR 306.A OG1 ASP 304.A OD1 no hydrogen 3.050 N/A THR 306.A OG1 ASP 304.A OD2 no hydrogen 2.951 N/A VAL 307.A N LEU 16.A O no hydrogen 2.902 N/A LYS 308.A N THR 300.A O no hydrogen 2.952 N/A LYS 308.A NZ ALA 281.A O no hydrogen 2.367 N/A VAL 309.A N TYR 14.A O no hydrogen 2.858 N/A TRP 310.A N VAL 298.A O no hydrogen 2.852 N/A TRP 310.A NE1 THR 300.A OG1 no hydrogen 2.718 N/A CYS 312.A N PRO 296.A O no hydrogen 2.769 N/A ARG 313.A N ILE 7.A O no hydrogen 2.498 N/A ARG 313.A NH2 GLU 311.A OE1 no hydrogen 2.418 N/A