Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6wer_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N GLY 18.A O no hydrogen 2.998 N/A GLY 3.A N GLY 16.A O no hydrogen 2.882 N/A VAL 5.A N LYS 14.A O no hydrogen 2.912 N/A SER 7.A N GLU 12.A O no hydrogen 2.912 N/A LYS 11.A N SER 7.A O no hydrogen 2.965 N/A LYS 14.A N VAL 5.A O no hydrogen 2.875 N/A LYS 14.A NZ CYS 15.A O no hydrogen 3.291 N/A GLY 16.A N GLY 3.A O no hydrogen 2.905 N/A SER 17.A OG ASP 1.A O no hydrogen 2.982 N/A GLY 18.A N ASP 1.A O no hydrogen 2.554 N/A PHE 20.A N ASP 1.A OD2 no hydrogen 3.338 N/A THR 22.A OG1 ASN 24.A OD1 no hydrogen 3.303 N/A VAL 25.A N ASP 23.A OD1 no hydrogen 3.179 N/A HIS 26.A N ASP 23.A OD1 no hydrogen 3.498 N/A THR 27.A OG1 THR 29.A O no hydrogen 3.177 N/A GLN 35.A N ILE 140.A O no hydrogen 3.145 N/A GLU 37.A N LEU 142.A O no hydrogen 2.797 N/A SER 38.A OG SER 40.A OG no hydrogen 2.982 N/A SER 40.A OG SER 38.A OG no hydrogen 2.982 N/A LYS 41.A N SER 38.A OG no hydrogen 3.404 N/A LEU 42.A N SER 38.A O no hydrogen 3.142 N/A ALA 43.A N PRO 39.A O no hydrogen 2.914 N/A SER 44.A N SER 40.A O no hydrogen 2.918 N/A SER 44.A OG SER 40.A O no hydrogen 3.099 N/A ALA 45.A N LYS 41.A O no hydrogen 2.953 N/A ILE 46.A N LEU 42.A O no hydrogen 2.864 N/A GLN 47.A N ALA 43.A O no hydrogen 2.929 N/A LYS 48.A N SER 44.A O no hydrogen 2.924 N/A LYS 48.A NZ PRO 106.A O no hydrogen 3.397 N/A ALA 49.A N ALA 45.A O no hydrogen 2.858 N/A HIS 50.A N ILE 46.A O no hydrogen 2.907 N/A GLU 51.A N GLN 47.A O no hydrogen 3.015 N/A GLU 52.A N LYS 48.A O no hydrogen 3.402 N/A GLY 53.A N HIS 50.A O no hydrogen 3.104 N/A ILE 54.A N ALA 49.A O no hydrogen 3.259 N/A CYS 55.A N ASN 125.A O no hydrogen 3.172 N/A CYS 55.A SG ASN 125.A O no hydrogen 3.616 N/A ILE 57.A N LEU 112.A O no hydrogen 3.142 N/A ARG 58.A N ALA 127.A O no hydrogen 2.731 N/A ARG 58.A NH1 GLY 115.A O no hydrogen 2.302 N/A SER 59.A N ASP 114.A OD1 no hydrogen 3.009 N/A SER 59.A OG ASP 114.A OD2 no hydrogen 2.748 N/A VAL 60.A N GLU 64.A OE1 no hydrogen 2.764 N/A THR 61.A OG1 GLU 192.A OE1 no hydrogen 3.403 N/A THR 61.A OG1 GLU 192.A OE2 no hydrogen 2.897 N/A ARG 62.A N GLU 192.A OE2 no hydrogen 2.701 N/A ARG 62.A NH1 GLU 30.A OE1 no hydrogen 3.436 N/A GLU 64.A N THR 61.A O no hydrogen 3.170 N/A ASN 65.A N THR 61.A O no hydrogen 3.420 N/A ASN 65.A ND2 GLY 91.A O no hydrogen 3.556 N/A ASN 65.A ND2 ASP 114.A OD2 no hydrogen 2.376 N/A LEU 66.A N ARG 62.A O no hydrogen 2.969 N/A MET 67.A N LEU 63.A O no hydrogen 2.865 N/A TRP 68.A N GLU 64.A O no hydrogen 2.902 N/A TRP 68.A NE1 GLU 64.A OE2 no hydrogen 3.275 N/A LYS 69.A N ASN 65.A O no hydrogen 2.921 N/A LYS 69.A NZ ASP 92.A OD2 no hydrogen 2.809 N/A GLN 70.A N LEU 66.A O no hydrogen 2.984 N/A ILE 71.A N MET 67.A O no hydrogen 2.819 N/A ILE 71.A N TRP 68.A O no hydrogen 3.204 N/A THR 72.A N TRP 68.A O no hydrogen 2.902 N/A THR 72.A OG1 TRP 68.A O no hydrogen 2.342 N/A LEU 75.A N ILE 71.A O no hydrogen 3.188 N/A ASN 76.A N THR 72.A O no hydrogen 2.906 N/A ASN 76.A ND2 ILE 88.A O no hydrogen 2.515 N/A HIS 77.A N PRO 73.A O no hydrogen 2.911 N/A ILE 78.A N GLU 74.A O no hydrogen 2.804 N/A LEU 79.A N LEU 75.A O no hydrogen 2.946 N/A SER 80.A N ASN 76.A O no hydrogen 2.869 N/A GLU 81.A N HIS 77.A O no hydrogen 2.849 N/A ASN 82.A N ILE 78.A O no hydrogen 3.246 N/A GLU 83.A N SER 80.A O no hydrogen 2.964 N/A VAL 84.A N LEU 79.A O no hydrogen 3.243 N/A LEU 86.A N VAL 84.A O no hydrogen 2.636 N/A THR 87.A N GLN 109.A O no hydrogen 3.046 N/A ILE 88.A N ASN 76.A OD1 no hydrogen 2.371 N/A MET 89.A N PHE 111.A O no hydrogen 2.940 N/A GLY 91.A N ILE 113.A O no hydrogen 2.945 N/A MET 97.A N VAL 193.A O no hydrogen 2.628 N/A LYS 101.A N ASN 123.A O no hydrogen 3.346 N/A ARG 102.A N ARG 126.A O no hydrogen 3.187 N/A ARG 102.A NH2 GLU 52.A O no hydrogen 2.765 N/A LEU 104.A N SER 130.A OG no hydrogen 3.067 N/A GLN 109.A N LYS 85.A O no hydrogen 3.008 N/A PHE 111.A N THR 87.A O no hydrogen 2.872 N/A LEU 112.A N CYS 55.A O no hydrogen 3.234 N/A ILE 113.A N MET 89.A O no hydrogen 2.907 N/A ASP 114.A N ILE 57.A O no hydrogen 3.206 N/A GLY 115.A N ASP 92.A O no hydrogen 2.934 N/A GLU 120.A N THR 118.A OG1 no hydrogen 3.248 N/A ASN 123.A ND2 GLU 117.A OE2 no hydrogen 2.670 N/A ASN 125.A N PRO 122.A O no hydrogen 3.159 N/A ARG 126.A N ASN 123.A O no hydrogen 3.204 N/A ARG 126.A NE CYS 121.A O no hydrogen 3.349 N/A ARG 126.A NH1 ILE 57.A O no hydrogen 3.520 N/A ARG 126.A NH1 ASP 114.A O no hydrogen 3.054 N/A ALA 127.A N GLY 56.A O no hydrogen 2.924 N/A TRP 128.A N ARG 102.A O no hydrogen 3.245 N/A ASN 129.A ND2 ASP 149.A O no hydrogen 3.065 N/A ASN 129.A ND2 PHE 151.A O no hydrogen 2.971 N/A GLU 132.A N LYS 143.A O no hydrogen 3.208 N/A VAL 133.A N ASP 153.A OD2 no hydrogen 3.016 N/A GLU 134.A N TRP 141.A O no hydrogen 2.986 N/A THR 138.A OG1 GLN 31.A O no hydrogen 3.066 N/A ILE 140.A N LYS 33.A O no hydrogen 3.038 N/A TRP 141.A N ASP 135.A O no hydrogen 2.968 N/A LEU 142.A N GLN 35.A O no hydrogen 2.868 N/A LYS 143.A N GLU 132.A O no hydrogen 3.096 N/A LYS 143.A NZ GLU 134.A OE1 no hydrogen 3.330 N/A LYS 143.A NZ GLU 134.A OE2 no hydrogen 3.507 N/A LYS 145.A N SER 130.A O no hydrogen 2.883 N/A CYS 152.A N HIS 197.A O no hydrogen 3.130 N/A CYS 152.A SG HIS 197.A O no hydrogen 3.220 N/A LYS 155.A N ASP 153.A OD1 no hydrogen 3.338 N/A LEU 156.A N ASP 153.A O no hydrogen 3.196 N/A SER 158.A N ALA 169.A O no hydrogen 2.942 N/A SER 158.A OG ALA 169.A O no hydrogen 3.286 N/A ALA 160.A N VAL 167.A O no hydrogen 2.903 N/A LYS 162.A N ARG 165.A O no hydrogen 2.943 N/A ARG 165.A N LYS 162.A O no hydrogen 2.884 N/A ARG 165.A NH1 GLU 176.A OE2 no hydrogen 2.829 N/A ALA 166.A N SER 177.A O no hydrogen 2.905 N/A VAL 167.A N ALA 160.A O no hydrogen 2.842 N/A HIS 168.A N ILE 175.A O no hydrogen 2.910 N/A ALA 169.A N SER 158.A O no hydrogen 2.860 N/A GLY 172.A N ASP 170.A OD2 no hydrogen 3.095 N/A TYR 173.A OH LEU 220.A O no hydrogen 3.056 N/A TRP 174.A N SER 189.A O no hydrogen 3.024 N/A ILE 175.A N HIS 168.A O no hydrogen 2.900 N/A GLU 176.A N LYS 187.A O no hydrogen 2.903 N/A SER 177.A N ALA 166.A O no hydrogen 2.901 N/A SER 177.A OG HIS 227.A O no hydrogen 3.508 N/A ALA 178.A N LYS 184.A O no hydrogen 2.986 N/A LEU 179.A N ASN 164.A O no hydrogen 3.243 N/A ASN 180.A N THR 182.A O no hydrogen 3.109 N/A LYS 184.A N ALA 178.A O no hydrogen 3.298 N/A LYS 184.A NZ ASN 180.A O no hydrogen 3.007 N/A ILE 185.A N TYR 229.A O no hydrogen 2.756 N/A GLU 186.A N GLU 176.A O no hydrogen 2.855 N/A LYS 187.A N GLU 176.A O no hydrogen 2.969 N/A ALA 188.A N MET 248.A O no hydrogen 2.920 N/A SER 189.A N TRP 174.A O no hydrogen 2.922 N/A SER 189.A OG GLU 247.A OE2 no hydrogen 2.282 N/A PHE 190.A N LEU 246.A O no hydrogen 2.994 N/A ILE 191.A N GLY 172.A O no hydrogen 3.167 N/A LYS 194.A N TYR 173.A OH no hydrogen 3.109 N/A LYS 194.A NZ ASP 170.A OD1 no hydrogen 3.170 N/A LYS 194.A NZ ASP 170.A OD2 no hydrogen 2.807 N/A ASN 195.A ND2 ASN 195.A O no hydrogen 2.511 N/A HIS 197.A N VAL 150.A O no hydrogen 2.778 N/A TRP 198.A NE1 HIS 202.A O no hydrogen 3.058 N/A SER 201.A OG HIS 202.A ND1 no hydrogen 2.604 N/A HIS 202.A N PRO 199.A O no hydrogen 3.015 N/A HIS 202.A ND1 SER 201.A OG no hydrogen 2.604 N/A THR 203.A N LYS 200.A O no hydrogen 3.058 N/A THR 203.A OG1 PRO 199.A O no hydrogen 2.874 N/A LEU 204.A N HIS 168.A NE2 no hydrogen 3.076 N/A GLU 213.A N LEU 210.A O no hydrogen 2.999 N/A MET 214.A N GLU 211.A O no hydrogen 3.108 N/A ILE 215.A N ASN 228.A O no hydrogen 2.985 N/A ILE 216.A N ASN 228.A OD1 no hydrogen 3.041 N/A LYS 218.A NZ GLU 211.A OE2 no hydrogen 3.262 N/A LEU 220.A N PRO 217.A O no hydrogen 3.029 N/A GLY 222.A N PRO 217.A O no hydrogen 2.958 N/A SER 225.A OG LEU 204.A O no hydrogen 2.827 N/A GLN 226.A N TRP 205.A O no hydrogen 3.060 N/A GLN 226.A NE2 ASN 207.A O no hydrogen 2.918 N/A HIS 227.A N SER 225.A OG no hydrogen 2.743 N/A ASN 228.A N SER 225.A O no hydrogen 3.016 N/A ASN 228.A ND2 ILE 216.A O no hydrogen 3.005 N/A ASN 228.A ND2 PRO 223.A O no hydrogen 3.049 N/A ARG 230.A NH1 ILE 185.A O no hydrogen 3.006 N/A ARG 230.A NH1 GLU 186.A OE1 no hydrogen 3.332 N/A TYR 233.A N ARG 230.A O no hydrogen 3.197 N/A TYR 233.A OH THR 290.A O no hydrogen 2.927 N/A TYR 233.A OH PRO 292.A O no hydrogen 3.418 N/A THR 235.A N SER 212.A O no hydrogen 3.193 N/A THR 235.A OG1 GLU 211.A O no hydrogen 2.858 N/A THR 235.A OG1 MET 214.A O no hydrogen 3.206 N/A GLN 236.A N ILE 215.A O no hydrogen 3.124 N/A GLN 236.A NE2 HIS 234.A O no hydrogen 3.171 N/A GLN 236.A NE2 GLU 307.A OE1 no hydrogen 2.643 N/A TRP 241.A N GLY 239.A O no hydrogen 2.648 N/A TRP 241.A NE1 GLN 236.A O no hydrogen 2.756 N/A LEU 243.A N PRO 240.A O no hydrogen 3.060 N/A GLY 244.A N TRP 241.A O no hydrogen 3.128 N/A LEU 246.A N PHE 190.A O no hydrogen 2.932 N/A GLU 247.A N ARG 297.A O no hydrogen 2.950 N/A MET 248.A N ALA 188.A O no hydrogen 2.887 N/A ASP 249.A N ARG 295.A O no hydrogen 2.926 N/A ASP 251.A N PRO 293.A O no hydrogen 3.091 N/A PHE 252.A N ASP 251.A OD1 no hydrogen 2.551 N/A CYS 253.A N TYR 304.A OH no hydrogen 2.869 N/A CYS 253.A SG TRP 303.A O no hydrogen 3.687 N/A THR 256.A N CYS 253.A O no hydrogen 3.006 N/A THR 256.A OG1 CYS 253.A O no hydrogen 2.555 N/A THR 256.A OG1 TYR 304.A OH no hydrogen 2.705 N/A THR 257.A N THR 282.A O no hydrogen 2.884 N/A THR 257.A OG1 THR 282.A O no hydrogen 3.555 N/A VAL 259.A N TRP 284.A O no hydrogen 2.930 N/A THR 261.A N CYS 286.A O no hydrogen 3.140 N/A GLU 262.A N GLU 262.A OE2 no hydrogen 3.048 N/A ASP 263.A N THR 261.A OG1 no hydrogen 3.209 N/A ARG 267.A N ASN 266.A OD1 no hydrogen 2.866 N/A ARG 267.A NH1 THR 235.A O no hydrogen 2.864 N/A ARG 267.A NH2 THR 235.A O no hydrogen 3.569 N/A ARG 267.A NH2 GLU 307.A OE2 no hydrogen 3.380 N/A GLY 268.A N MET 306.A O no hydrogen 3.010 N/A SER 270.A N THR 238.A O no hydrogen 3.037 N/A SER 270.A OG TYR 304.A O no hydrogen 2.284 N/A ARG 272.A N VAL 319.A O no hydrogen 3.186 N/A ARG 272.A NE THR 274.A OG1 no hydrogen 2.628 N/A THR 273.A N CYS 302.A O no hydrogen 2.864 N/A THR 273.A OG1 CYS 302.A O no hydrogen 3.222 N/A THR 275.A N LYS 279.A O no hydrogen 2.838 N/A THR 275.A OG1 SER 277.A OG no hydrogen 3.164 N/A THR 275.A OG1 LYS 279.A O no hydrogen 3.290 N/A SER 277.A OG THR 275.A OG1 no hydrogen 3.164 N/A GLY 278.A N THR 275.A O no hydrogen 3.042 N/A LYS 279.A N THR 275.A OG1 no hydrogen 2.931 N/A ILE 281.A N THR 273.A O no hydrogen 2.877 N/A TRP 284.A N THR 257.A O no hydrogen 2.876 N/A TRP 284.A NE1 ILE 281.A O no hydrogen 2.773 N/A CYS 285.A N ARG 309.A O no hydrogen 2.862 N/A CYS 285.A SG ARG 309.A O no hydrogen 4.026 N/A CYS 286.A N VAL 259.A O no hydrogen 2.886 N/A CYS 289.A SG TYR 233.A OH no hydrogen 3.411 N/A THR 290.A OG1 PRO 231.A O no hydrogen 2.736 N/A LEU 294.A N TYR 233.A OH no hydrogen 3.164 N/A ARG 295.A N ASP 249.A O no hydrogen 2.904 N/A ARG 295.A NE ASP 249.A OD1 no hydrogen 2.876 N/A ARG 295.A NE ASP 249.A OD2 no hydrogen 3.168 N/A ARG 295.A NH2 ASP 249.A OD2 no hydrogen 3.081 N/A TYR 296.A N TRP 303.A O no hydrogen 2.916 N/A TYR 296.A OH GLN 236.A OE1 no hydrogen 2.669 N/A ARG 297.A N GLU 247.A O no hydrogen 2.891 N/A GLY 298.A N GLY 301.A O no hydrogen 2.923 N/A GLY 301.A N GLY 298.A O no hydrogen 2.932 N/A CYS 302.A SG TYR 296.A O no hydrogen 3.683 N/A TRP 303.A N TYR 296.A O no hydrogen 2.858 N/A TRP 303.A NE1 ASP 300.A OD1 no hydrogen 2.997 N/A TYR 304.A N LEU 271.A O no hydrogen 2.926 N/A TYR 304.A OH THR 256.A OG1 no hydrogen 2.705 N/A GLY 305.A N LEU 294.A O no hydrogen 2.815 N/A MET 306.A N GLN 236.A OE1 no hydrogen 3.000 N/A ILE 308.A N GLY 305.A O no hydrogen 3.000 N/A ARG 309.A N CYS 285.A O no hydrogen 2.872 N/A ARG 309.A NE ILE 308.A O no hydrogen 3.155 N/A ARG 309.A NH1 PRO 269.A O no hydrogen 2.386 N/A ARG 309.A NH2 PRO 269.A O no hydrogen 3.340 N/A ARG 309.A NH2 GLU 315.A OE1 no hydrogen 3.384 N/A LEU 311.A N GLU 283.A O no hydrogen 2.948 N/A LYS 312.A NZ GLU 283.A OE1 no hydrogen 3.034 N/A LYS 312.A NZ GLU 283.A OE2 no hydrogen 3.356 N/A ASN 317.A N LYS 314.A O no hydrogen 3.381 N/A ASN 317.A ND2 GLU 313.A OE2 no hydrogen 2.986 N/A LEU 318.A N GLU 315.A O no hydrogen 3.255 N/A SER 321.A OG THR 238.A O no hydrogen 2.993 N/A SER 321.A OG SER 270.A O no hydrogen 2.948 N/A