Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8djj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N GLN 299.A OE1 no hydrogen 2.794 N/A THR 7.A OG1 PHE 8.A O no hydrogen 3.569 N/A PHE 8.A N SER 113.A OG no hydrogen 2.821 N/A SER 10.A OG GLU 14.A OE2 no hydrogen 2.806 N/A VAL 13.A N SER 10.A O no hydrogen 3.201 N/A GLU 14.A N SER 10.A O no hydrogen 3.041 N/A CYS 16.A N VAL 13.A O no hydrogen 2.928 N/A CYS 16.A SG LYS 12.A O no hydrogen 3.290 N/A MET 17.A N GLU 14.A O no hydrogen 3.223 N/A VAL 18.A N GLY 29.A O no hydrogen 2.955 N/A GLN 19.A N GLN 69.A O no hydrogen 2.803 N/A GLN 19.A NE2 ASN 119.A OD1 no hydrogen 3.610 N/A VAL 20.A N LEU 27.A O no hydrogen 2.799 N/A THR 21.A N LEU 67.A O no hydrogen 2.693 N/A THR 21.A OG1 THR 26.A OG1 no hydrogen 3.005 N/A THR 21.A OG1 LEU 67.A O no hydrogen 3.445 N/A CYS 22.A N THR 25.A O no hydrogen 2.993 N/A CYS 22.A SG ASN 65.A O no hydrogen 3.972 N/A THR 25.A N CYS 22.A O no hydrogen 3.484 N/A THR 25.A OG1 CYS 44.A O no hydrogen 2.814 N/A THR 26.A OG1 THR 21.A OG1 no hydrogen 3.005 N/A THR 26.A OG1 THR 25.A O no hydrogen 3.336 N/A LEU 27.A N VAL 20.A O no hydrogen 3.034 N/A ASN 28.A N CYS 145.A O no hydrogen 2.840 N/A ASN 28.A ND2 CYS 117.A O no hydrogen 2.974 N/A ASN 28.A ND2 GLY 143.A O no hydrogen 3.064 N/A ASN 28.A ND2 CYS 145.A O no hydrogen 2.857 N/A GLY 29.A N VAL 18.A O no hydrogen 2.864 N/A LEU 30.A N TYR 37.A O no hydrogen 2.602 N/A TRP 31.A N CYS 16.A O no hydrogen 2.825 N/A LEU 32.A N VAL 35.A O no hydrogen 3.063 N/A ASP 33.A N THR 98.A OG1 no hydrogen 3.079 N/A VAL 35.A N LEU 32.A O no hydrogen 3.176 N/A VAL 36.A N LEU 89.A O no hydrogen 3.000 N/A TYR 37.A N LEU 30.A O no hydrogen 2.673 N/A CYS 38.A N LEU 87.A O no hydrogen 3.411 N/A CYS 38.A SG PRO 39.A O no hydrogen 3.482 N/A ARG 40.A N CYS 85.A O no hydrogen 3.332 N/A ARG 40.A NE ASP 187.A OD2 no hydrogen 2.360 N/A ARG 40.A NH2 ASP 187.A OD1 no hydrogen 3.071 N/A HIS 41.A NE2 HIS 164.A O no hydrogen 3.137 N/A ILE 43.A N ARG 40.A O no hydrogen 3.499 N/A CYS 44.A N HIS 41.A O no hydrogen 3.449 N/A THR 45.A N ASP 48.A OD2 no hydrogen 3.062 N/A THR 45.A OG1 ASP 48.A OD1 no hydrogen 2.847 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 3.071 N/A TYR 54.A OH ASP 187.A O no hydrogen 2.511 N/A LEU 57.A N ASN 53.A O no hydrogen 2.862 N/A LEU 58.A N TYR 54.A O no hydrogen 2.787 N/A ILE 59.A N GLU 55.A O no hydrogen 3.260 N/A ILE 59.A N ASP 56.A O no hydrogen 3.249 N/A LYS 61.A N LEU 58.A O no hydrogen 3.267 N/A SER 62.A N ASN 65.A OD1 no hydrogen 2.512 N/A ASN 65.A N SER 62.A O no hydrogen 3.170 N/A PHE 66.A N ASN 63.A O no hydrogen 3.351 N/A LEU 67.A N THR 21.A O no hydrogen 2.755 N/A GLN 69.A N GLN 19.A O no hydrogen 2.741 N/A GLN 69.A NE2 GLN 19.A OE1 no hydrogen 2.605 N/A ALA 70.A N VAL 73.A O no hydrogen 2.544 N/A VAL 73.A N ALA 70.A O no hydrogen 3.098 N/A GLN 74.A NE2 GLN 69.A OE1 no hydrogen 2.995 N/A LEU 75.A N VAL 68.A O no hydrogen 2.880 N/A ILE 78.A N LYS 90.A O no hydrogen 2.735 N/A HIS 80.A ND1 ASN 63.A OD1 no hydrogen 2.661 N/A SER 81.A N LYS 88.A O no hydrogen 3.096 N/A GLN 83.A N VAL 86.A O no hydrogen 3.141 N/A ASN 84.A ND2 GLU 178.A O no hydrogen 2.621 N/A CYS 85.A N GLY 179.A O no hydrogen 2.902 N/A CYS 85.A SG ASP 187.A OD2 no hydrogen 3.410 N/A VAL 86.A N GLN 83.A O no hydrogen 3.201 N/A LEU 87.A N CYS 38.A O no hydrogen 2.917 N/A LYS 88.A N SER 81.A O no hydrogen 2.685 N/A LEU 89.A N VAL 36.A O no hydrogen 2.962 N/A LYS 90.A N GLY 79.A O no hydrogen 2.577 N/A VAL 91.A N ASP 34.A O no hydrogen 2.928 N/A ASP 92.A N ARG 76.A O no hydrogen 3.237 N/A THR 93.A N ASP 92.A OD1 no hydrogen 2.806 N/A THR 93.A OG1 ASP 92.A OD1 no hydrogen 3.295 N/A ASN 95.A N ASP 33.A O no hydrogen 2.859 N/A ASN 95.A ND2 GLY 15.A O no hydrogen 2.798 N/A ASN 95.A ND2 TRP 31.A O no hydrogen 2.847 N/A LYS 97.A N ASN 95.A OD1 no hydrogen 2.940 N/A THR 98.A N ASN 95.A O no hydrogen 3.321 N/A THR 98.A OG1 ASN 95.A O no hydrogen 2.768 N/A TYR 101.A OH ASP 33.A OD2 no hydrogen 3.071 N/A LYS 102.A N VAL 157.A O no hydrogen 2.971 N/A VAL 104.A N PHE 159.A O no hydrogen 2.856 N/A ARG 105.A NH1 ASP 176.A OD2 no hydrogen 2.549 N/A ARG 105.A NH1 ASN 180.A O no hydrogen 2.965 N/A ARG 105.A NH2 PHE 181.A O no hydrogen 3.080 N/A ILE 106.A N TYR 182.A OH no hydrogen 3.175 N/A GLY 109.A N MET 130.A O no hydrogen 2.642 N/A GLN 110.A N GLN 107.A O no hydrogen 3.335 N/A THR 111.A OG1 ASP 295.A OD1 no hydrogen 3.420 N/A THR 111.A OG1 ASP 295.A OD2 no hydrogen 2.517 N/A PHE 112.A N CYS 128.A O no hydrogen 2.949 N/A SER 113.A N PHE 150.A O no hydrogen 2.865 N/A SER 113.A OG GLN 127.A OE1 no hydrogen 2.916 N/A VAL 114.A N TYR 126.A O no hydrogen 2.937 N/A LEU 115.A N VAL 148.A O no hydrogen 3.203 N/A ALA 116.A N GLY 124.A O no hydrogen 2.743 N/A CYS 117.A N SER 147.A OG no hydrogen 2.974 N/A CYS 117.A SG LEU 115.A O no hydrogen 3.509 N/A TYR 118.A N SER 121.A O no hydrogen 3.064 N/A GLY 120.A N ASN 28.A OD1 no hydrogen 2.646 N/A SER 121.A N TYR 118.A O no hydrogen 3.132 N/A SER 121.A OG PRO 122.A O no hydrogen 3.570 N/A SER 123.A N ALA 116.A O no hydrogen 2.621 N/A TYR 126.A N VAL 114.A O no hydrogen 3.117 N/A TYR 126.A OH SER 139.A O no hydrogen 3.087 N/A CYS 128.A N PHE 112.A O no hydrogen 3.050 N/A CYS 128.A SG.A GLN 127.A O no hydrogen 3.563 N/A MET 130.A N GLN 110.A O no hydrogen 2.960 N/A ARG 131.A N THR 135.A O no hydrogen 2.881 N/A ARG 131.A NE ASP 197.A OD1 no hydrogen 3.360 N/A ARG 131.A NE ASP 197.A OD2 no hydrogen 3.294 N/A ARG 131.A NH1 ASP 289.A OD1 no hydrogen 3.024 N/A ARG 131.A NH1 ASP 289.A OD2 no hydrogen 2.987 N/A ARG 131.A NH1 GLU 290.A OE2 no hydrogen 3.419 N/A ARG 131.A NH2 THR 198.A O no hydrogen 3.089 N/A ARG 131.A NH2 ASP 289.A OD2 no hydrogen 2.486 N/A ASN 133.A ND2 GLY 195.A O no hydrogen 3.472 N/A PHE 134.A N ARG 131.A O no hydrogen 2.806 N/A THR 135.A N ASN 133.A OD1 no hydrogen 3.341 N/A THR 135.A OG1 ASN 133.A OD1 no hydrogen 2.465 N/A ILE 136.A N HIS 172.A O no hydrogen 2.999 N/A SER 139.A N TYR 126.A OH no hydrogen 3.095 N/A LEU 141.A N TYR 118.A OH no hydrogen 3.377 N/A SER 144.A N LEU 141.A O no hydrogen 3.119 N/A SER 144.A OG LEU 141.A O no hydrogen 2.622 N/A CYS 145.A SG HIS 41.A NE2 no hydrogen 3.617 N/A CYS 145.A SG HIS 164.A O no hydrogen 3.394 N/A GLY 146.A N HIS 163.A O no hydrogen 3.318 N/A SER 147.A N SER 144.A O no hydrogen 3.202 N/A SER 147.A OG SER 144.A O no hydrogen 2.733 N/A GLY 149.A N TYR 161.A O no hydrogen 2.922 N/A PHE 150.A N SER 113.A O no hydrogen 2.890 N/A ASN 151.A N SER 158.A O no hydrogen 2.962 N/A ASN 151.A ND2 THR 111.A O no hydrogen 2.973 N/A ASP 153.A N CYS 156.A O no hydrogen 3.280 N/A CYS 156.A N ASP 153.A O no hydrogen 2.812 N/A CYS 156.A SG LYS 100.A O no hydrogen 3.704 N/A VAL 157.A N LYS 100.A O no hydrogen 2.613 N/A SER 158.A N ASN 151.A O no hydrogen 2.786 N/A PHE 159.A N LYS 102.A O no hydrogen 2.940 N/A CYS 160.A N GLY 149.A O no hydrogen 2.987 N/A CYS 160.A SG ASN 151.A OD1 no hydrogen 4.042 N/A TYR 161.A N GLY 149.A O no hydrogen 3.324 N/A MET 162.A N THR 175.A O no hydrogen 2.901 N/A HIS 163.A N SER 147.A O no hydrogen 2.892 N/A HIS 164.A N ALA 173.A O no hydrogen 3.143 N/A HIS 164.A ND1 MET 162.A O no hydrogen 3.063 N/A HIS 164.A NE2 CYS 85.A O no hydrogen 3.020 N/A MET 165.A N ALA 173.A O no hydrogen 3.298 N/A LEU 167.A N VAL 171.A O no hydrogen 2.857 N/A GLY 170.A N LEU 167.A O no hydrogen 2.918 N/A HIS 172.A N ILE 136.A O no hydrogen 3.069 N/A HIS 172.A NE2 GLU 166.A OE2 no hydrogen 3.163 N/A ALA 173.A N MET 165.A O no hydrogen 3.215 N/A THR 175.A N MET 162.A O no hydrogen 3.124 N/A THR 175.A OG1 ASP 176.A O no hydrogen 2.763 N/A ASP 176.A N ASN 180.A O no hydrogen 2.954 N/A GLU 178.A N ASP 176.A OD1 no hydrogen 3.110 N/A GLY 179.A N ASP 176.A O no hydrogen 3.038 N/A ASN 180.A N ASP 176.A OD1 no hydrogen 2.785 N/A TYR 182.A N GLY 174.A O no hydrogen 2.794 N/A TYR 182.A OH CYS 160.A O no hydrogen 2.594 N/A VAL 186.A N GLN 192.A OE1 no hydrogen 2.645 N/A GLN 189.A N MET 49.A O no hydrogen 2.597 N/A GLN 192.A NE2 VAL 186.A O no hydrogen 3.328 N/A THR 198.A OG1 GLU 240.A OE1 no hydrogen 2.483 N/A THR 198.A OG1 GLU 240.A OE2 no hydrogen 3.535 N/A THR 199.A N ASN 238.A O no hydrogen 3.173 N/A ILE 200.A N ASP 289.A OD2 no hydrogen 3.208 N/A THR 201.A OG1 THR 199.A O no hydrogen 3.380 N/A THR 201.A OG1 GLU 240.A O no hydrogen 2.555 N/A ASN 203.A ND2 GLY 109.A O no hydrogen 2.884 N/A ASN 203.A ND2 ASP 289.A O no hydrogen 2.971 N/A VAL 204.A N ILE 200.A O no hydrogen 3.207 N/A LEU 205.A N THR 201.A O no hydrogen 3.134 N/A ALA 206.A N VAL 202.A O no hydrogen 3.174 N/A TRP 207.A N ASN 203.A O no hydrogen 2.872 N/A LEU 208.A N VAL 204.A O no hydrogen 2.831 N/A TYR 209.A N LEU 205.A O no hydrogen 2.889 N/A TYR 209.A OH ILE 259.A O no hydrogen 2.674 N/A ALA 210.A N ALA 206.A O no hydrogen 2.993 N/A ALA 211.A N TRP 207.A O no hydrogen 3.157 N/A VAL 212.A N LEU 208.A O no hydrogen 3.187 N/A ILE 213.A N TYR 209.A O no hydrogen 3.071 N/A ASN 214.A N ALA 210.A O no hydrogen 3.095 N/A ASN 214.A N ALA 211.A O no hydrogen 3.227 N/A ASN 214.A ND2 ALA 210.A O no hydrogen 3.174 N/A GLY 215.A N VAL 212.A O no hydrogen 3.308 N/A ASP 216.A N ALA 211.A O no hydrogen 2.824 N/A ARG 217.A NE GLY 215.A O no hydrogen 3.541 N/A TRP 218.A NE1 THR 280.A O no hydrogen 2.819 N/A LEU 220.A N ARG 217.A O no hydrogen 3.232 N/A ASN 221.A N SER 267.A OG no hydrogen 3.176 N/A THR 224.A OG1 ASP 263.A OD1 no hydrogen 2.569 N/A THR 225.A OG1 THR 226.A O no hydrogen 3.507 N/A THR 225.A OG1 ASP 229.A OD2 no hydrogen 2.256 N/A PHE 230.A N THR 226.A O no hydrogen 3.002 N/A ASN 231.A N LEU 227.A O no hydrogen 3.150 N/A ASN 231.A ND2 LEU 242.A O no hydrogen 3.107 N/A LEU 232.A N ASN 228.A O no hydrogen 3.188 N/A VAL 233.A N ASP 229.A O no hydrogen 3.267 N/A ALA 234.A N PHE 230.A O no hydrogen 2.826 N/A MET 235.A N ASN 231.A O no hydrogen 3.155 N/A TYR 237.A N VAL 233.A O no hydrogen 3.428 N/A ASN 238.A N MET 235.A O no hydrogen 3.310 N/A TYR 239.A N ALA 234.A O no hydrogen 2.718 N/A GLU 240.A N THR 199.A O no hydrogen 2.847 N/A LEU 242.A N ASN 231.A OD1 no hydrogen 2.717 N/A THR 243.A N HIS 246.A ND1 no hydrogen 3.084 N/A THR 243.A OG1 HIS 246.A ND1 no hydrogen 3.264 N/A GLN 244.A NE2 ASP 248.A OD1 no hydrogen 3.216 N/A VAL 247.A N THR 243.A O no hydrogen 3.229 N/A ASP 248.A N GLN 244.A O no hydrogen 2.815 N/A ILE 249.A N ASP 245.A O no hydrogen 2.831 N/A LEU 250.A N HIS 246.A O no hydrogen 3.065 N/A GLY 251.A N ASP 248.A O no hydrogen 3.111 N/A SER 254.A N LEU 250.A O no hydrogen 2.905 N/A SER 254.A OG ILE 259.A O no hydrogen 3.037 N/A ALA 255.A N GLY 251.A O no hydrogen 2.782 N/A GLN 256.A N PRO 252.A O no hydrogen 2.782 N/A THR 257.A OG1 LEU 253.A O no hydrogen 3.017 N/A GLY 258.A N SER 254.A O no hydrogen 2.820 N/A MET 264.A N ALA 260.A O no hydrogen 2.964 N/A CYS 265.A N VAL 261.A O no hydrogen 2.834 N/A CYS 265.A SG VAL 261.A O no hydrogen 3.295 N/A ALA 266.A N LEU 262.A O no hydrogen 3.265 N/A SER 267.A N ASP 263.A O no hydrogen 3.424 N/A SER 267.A OG PHE 219.A O no hydrogen 3.205 N/A LEU 268.A N MET 264.A O no hydrogen 2.886 N/A LYS 269.A N CYS 265.A O no hydrogen 2.803 N/A GLU 270.A N ALA 266.A O no hydrogen 2.842 N/A LEU 271.A N SER 267.A O no hydrogen 3.039 N/A LEU 272.A N LEU 268.A O no hydrogen 2.913 N/A GLN 273.A N LYS 269.A O no hydrogen 3.155 N/A ASN 274.A N GLU 270.A O no hydrogen 2.897 N/A GLY 275.A N LEU 271.A O no hydrogen 2.873 N/A ARG 279.A N MET 276.A O no hydrogen 2.950 N/A ILE 281.A N SER 284.A O no hydrogen 2.847 N/A LEU 282.A N ASP 216.A OD2 no hydrogen 2.893 N/A SER 284.A N ILE 281.A O no hydrogen 3.067 N/A SER 284.A OG LEU 286.A O no hydrogen 3.406 N/A SER 284.A OG GLU 288.A OE2 no hydrogen 2.849 N/A LEU 286.A N SER 284.A OG no hydrogen 3.377 N/A THR 292.A N ASP 295.A OD2 no hydrogen 3.220 N/A ASP 295.A N THR 292.A OG1 no hydrogen 3.036 N/A VAL 296.A N THR 292.A O no hydrogen 3.210 N/A VAL 297.A N PRO 293.A O no hydrogen 3.369 N/A ARG 298.A N PHE 294.A O no hydrogen 2.773 N/A ARG 298.A NH1 ASP 295.A OD1 no hydrogen 2.686 N/A GLN 299.A N ASP 295.A O no hydrogen 3.237 N/A GLN 299.A NE2 ARG 4.A O no hydrogen 2.751 N/A CYS 300.A N VAL 296.A O no hydrogen 2.686 N/A GLY 302.A N ARG 298.A O no hydrogen 3.006 N/A VAL 303.A N ARG 298.A O no hydrogen 3.434 N/A