Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qj4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N ASP 152.A OD2 no hydrogen 2.733 N/A GLN 3.A NE2 MET 1.A O no hydrogen 2.809 N/A VAL 4.A N TYR 28.A O no hydrogen 2.939 N/A LEU 5.A N LEU 153.A O no hydrogen 2.863 N/A ILE 6.A N ALA 30.A O no hydrogen 2.826 N/A VAL 7.A N VAL 155.A O no hydrogen 2.936 N/A GLY 8.A N TRP 32.A O no hydrogen 2.761 N/A ALA 9.A N ASP 33.A OD1 no hydrogen 2.619 N/A SER 14.A N GLY 10.A O no hydrogen 3.173 N/A SER 14.A OG GLY 10.A O no hydrogen 2.713 N/A SER 14.A OG MET 11.A O no hydrogen 3.270 N/A LEU 15.A N MET 11.A O no hydrogen 3.335 N/A CYS 16.A N THR 12.A O no hydrogen 2.960 N/A CYS 16.A SG THR 12.A O no hydrogen 3.354 N/A ALA 17.A N GLY 13.A O no hydrogen 3.091 N/A ALA 18.A N SER 14.A O no hydrogen 3.048 N/A LEU 19.A N LEU 15.A O no hydrogen 2.814 N/A LEU 20.A N CYS 16.A O no hydrogen 2.867 N/A ARG 21.A N ALA 17.A O no hydrogen 3.278 N/A THR 24.A OG1 LEU 20.A O no hydrogen 3.348 N/A THR 24.A OG1 ARG 21.A O no hydrogen 3.108 N/A TYR 28.A N ALA 2.A O no hydrogen 2.815 N/A ALA 30.A N VAL 4.A O no hydrogen 2.993 N/A VAL 31.A N GLU 122.A O no hydrogen 2.897 N/A TRP 32.A N ILE 6.A O no hydrogen 2.975 N/A ASP 33.A N TYR 124.A O no hydrogen 3.054 N/A ALA 35.A N ASP 33.A OD2 no hydrogen 3.000 N/A GLY 39.A N ALA 9.A O no hydrogen 2.812 N/A ARG 41.A NH2 SER 285.A O no hydrogen 3.031 N/A ARG 41.A NH2 ASP 311.A OD2 no hydrogen 2.722 N/A MET 42.A N GLY 39.A O no hydrogen 3.113 N/A THR 44.A OG1 ASP 56.A OD1 no hydrogen 2.560 N/A ALA 45.A N ALA 55.A O no hydrogen 2.752 N/A CYS 46.A SG SER 47.A O no hydrogen 3.507 N/A SER 47.A N CYS 53.A O no hydrogen 2.901 N/A ASN 50.A N SER 47.A O no hydrogen 3.288 N/A CYS 53.A N ASN 50.A O no hydrogen 3.301 N/A CYS 53.A SG GLY 233.A O no hydrogen 3.545 N/A CYS 53.A SG PRO 234.A O no hydrogen 4.005 N/A ALA 55.A N ALA 45.A O no hydrogen 2.957 N/A ASP 56.A N ASP 222.A OD1 no hydrogen 3.213 N/A ALA 59.A N ARG 41.A O no hydrogen 2.934 N/A GLN 60.A NE2 ASP 56.A O no hydrogen 2.687 N/A GLN 60.A NE2 GLY 58.A O no hydrogen 2.979 N/A TYR 61.A OH TYR 209.A OH no hydrogen 2.583 N/A ILE 62.A N PHE 102.A O no hydrogen 2.990 N/A CYS 64.A N CYS 100.A O no hydrogen 2.873 N/A CYS 64.A SG THR 65.A O no hydrogen 3.977 N/A HIS 72.A N TYR 68.A O no hydrogen 2.908 N/A HIS 72.A ND1 ASP 319.A OD1 no hydrogen 3.022 N/A PHE 75.A N HIS 72.A O no hydrogen 2.978 N/A TYR 76.A N HIS 72.A O no hydrogen 3.284 N/A TYR 76.A OH ASP 319.A OD1 no hydrogen 3.386 N/A TYR 76.A OH ASP 319.A OD2 no hydrogen 2.738 N/A ASP 77.A N GLN 73.A O no hydrogen 2.956 N/A GLU 78.A N ARG 74.A O no hydrogen 3.330 N/A LEU 79.A N PHE 75.A O no hydrogen 3.199 N/A LEU 80.A N TYR 76.A O no hydrogen 3.015 N/A ALA 81.A N ASP 77.A O no hydrogen 3.067 N/A TYR 82.A N GLU 78.A O no hydrogen 3.241 N/A GLY 83.A N LEU 80.A O no hydrogen 3.146 N/A LEU 85.A N LEU 79.A O no hydrogen 2.944 N/A ARG 86.A N VAL 103.A O no hydrogen 2.872 N/A LEU 88.A N ASN 101.A O no hydrogen 3.013 N/A SER 90.A OG LYS 224.A O no hydrogen 3.101 N/A GLU 93.A N GLY 207.A O no hydrogen 3.070 N/A CYS 100.A N CYS 64.A O no hydrogen 3.054 N/A PHE 102.A N ILE 62.A O no hydrogen 2.970 N/A VAL 103.A N ARG 86.A O no hydrogen 2.758 N/A GLY 107.A N ALA 104.A O no hydrogen 3.031 N/A ILE 108.A N ASP 56.A OD1 no hydrogen 2.796 N/A SER 110.A N GLY 107.A O no hydrogen 2.952 N/A SER 110.A OG GLY 107.A O no hydrogen 2.717 N/A ILE 111.A N ILE 108.A O no hydrogen 3.464 N/A LYS 113.A N SER 109.A O no hydrogen 3.210 N/A LYS 113.A NZ ASP 37.A OD2 no hydrogen 3.127 N/A HIS 114.A N SER 110.A O no hydrogen 3.015 N/A TYR 115.A N ILE 111.A O no hydrogen 3.132 N/A LEU 116.A N ILE 112.A O no hydrogen 2.899 N/A LYS 117.A N LYS 113.A O no hydrogen 3.183 N/A GLU 118.A N HIS 114.A O no hydrogen 3.137 N/A SER 119.A N TYR 115.A O no hydrogen 3.141 N/A SER 119.A OG LEU 116.A O no hydrogen 2.657 N/A GLY 120.A N LYS 117.A O no hydrogen 3.085 N/A GLU 122.A N LEU 29.A O no hydrogen 2.804 N/A TYR 124.A N VAL 31.A O no hydrogen 2.743 N/A ARG 126.A N ALA 35.A O no hydrogen 2.912 N/A ARG 126.A NE ASP 36.A OD1 no hydrogen 2.666 N/A HIS 127.A N ASP 33.A O no hydrogen 2.938 N/A THR 130.A N SER 142.A O no hydrogen 3.136 N/A ILE 132.A N GLN 167.A O no hydrogen 3.385 N/A ASN 133.A N GLU 140.A O no hydrogen 2.949 N/A LEU 134.A N ASP 169.A OD2 no hydrogen 2.725 N/A ARG 135.A N LYS 138.A O no hydrogen 2.991 N/A TRP 139.A N PHE 151.A O no hydrogen 3.087 N/A TRP 139.A NE1 PHE 305.A O no hydrogen 2.999 N/A GLU 140.A N ASN 133.A O no hydrogen 2.738 N/A VAL 141.A N GLU 149.A O no hydrogen 2.835 N/A SER 142.A N GLN 131.A O no hydrogen 2.984 N/A LYS 143.A NZ SER 147.A O no hydrogen 3.339 N/A GLU 149.A N VAL 141.A O no hydrogen 2.897 N/A GLN 150.A NE2 GLU 140.A OE1 no hydrogen 3.337 N/A PHE 151.A N TRP 139.A O no hydrogen 3.124 N/A ASP 152.A N GLN 3.A O no hydrogen 2.740 N/A LEU 153.A N GLN 3.A O no hydrogen 3.115 N/A ILE 154.A N PHE 305.A O no hydrogen 3.028 N/A VAL 155.A N LEU 5.A O no hydrogen 2.979 N/A LEU 156.A N ALA 307.A O no hydrogen 2.828 N/A THR 157.A N VAL 7.A O no hydrogen 3.077 N/A THR 157.A OG1 VAL 7.A O no hydrogen 2.677 N/A THR 157.A OG1 GLY 8.A O no hydrogen 3.527 N/A VAL 160.A N TYR 187.A OH no hydrogen 3.130 N/A GLU 162.A N PRO 159.A O no hydrogen 2.830 N/A ILE 163.A N VAL 160.A O no hydrogen 2.958 N/A LEU 164.A N VAL 160.A O no hydrogen 3.182 N/A GLN 165.A N GLU 162.A O no hydrogen 3.387 N/A LEU 166.A N ILE 163.A O no hydrogen 3.342 N/A GLN 167.A N THR 130.A O no hydrogen 3.176 N/A ASP 169.A N ASN 133.A OD1 no hydrogen 3.293 N/A ILE 170.A N ILE 132.A O no hydrogen 3.355 N/A THR 171.A N GLY 168.A O no hydrogen 3.081 N/A THR 171.A OG1 GLY 168.A O no hydrogen 2.898 N/A THR 172.A N ASP 169.A O no hydrogen 2.941 N/A THR 172.A OG1 ASP 169.A O no hydrogen 2.947 N/A LEU 173.A N ILE 170.A O no hydrogen 3.034 N/A CYS 177.A SG SER 175.A OG no hydrogen 2.998 N/A GLN 178.A N SER 175.A OG no hydrogen 3.372 N/A GLN 178.A NE2 SER 175.A OG no hydrogen 3.026 N/A ARG 179.A N SER 175.A O no hydrogen 2.873 N/A ARG 179.A NH2 THR 171.A O no hydrogen 2.956 N/A GLN 180.A N GLU 176.A O no hydrogen 3.047 N/A GLN 181.A N CYS 177.A O no hydrogen 3.147 N/A GLN 181.A NE2 CYS 177.A O no hydrogen 3.415 N/A LEU 182.A N GLN 178.A O no hydrogen 3.020 N/A GLU 183.A N ARG 179.A O no hydrogen 2.984 N/A ALA 184.A N GLN 180.A O no hydrogen 3.298 N/A ALA 184.A N GLN 181.A O no hydrogen 3.294 N/A VAL 185.A N LEU 182.A O no hydrogen 3.265 N/A SER 186.A OG THR 288.A OG1 no hydrogen 3.159 N/A SER 186.A OG ASN 289.A O no hydrogen 3.285 N/A SER 186.A OG ASN 289.A OD1 no hydrogen 2.711 N/A SER 188.A N GLN 286.A O no hydrogen 2.853 N/A SER 188.A OG SER 285.A OG no hydrogen 2.713 N/A SER 188.A OG GLN 286.A O no hydrogen 3.526 N/A SER 189.A OG ARG 283.A O no hydrogen 2.824 N/A ARG 190.A N TRP 282.A O no hydrogen 3.079 N/A ARG 190.A NE THR 240.A O no hydrogen 3.147 N/A ARG 190.A NH1 GLN 286.A OE1 no hydrogen 3.080 N/A TYR 191.A N THR 240.A OG1 no hydrogen 2.761 N/A TYR 191.A OH TYR 248.A O no hydrogen 2.658 N/A ALA 192.A N GLN 280.A O no hydrogen 2.776 N/A LEU 193.A N ILE 238.A O no hydrogen 2.935 N/A GLY 194.A N LYS 278.A O no hydrogen 2.825 N/A LEU 195.A N LEU 236.A O no hydrogen 2.762 N/A PHE 196.A N ALA 276.A O no hydrogen 2.829 N/A TYR 197.A N PRO 234.A O no hydrogen 3.067 N/A THR 201.A OG1 GLY 200.A O no hydrogen 2.719 N/A ALA 206.A N PRO 91.A O no hydrogen 2.758 N/A GLY 207.A N PRO 91.A O no hydrogen 3.442 N/A GLN 208.A N VAL 219.A O no hydrogen 2.867 N/A TYR 209.A N GLU 93.A O no hydrogen 2.925 N/A TYR 209.A OH TYR 61.A OH no hydrogen 2.583 N/A ILE 210.A N ARG 217.A O no hydrogen 2.723 N/A ARG 217.A N HIS 239.A O no hydrogen 2.917 N/A ARG 217.A NH1 ILE 210.A O no hydrogen 3.444 N/A PHE 218.A N HIS 239.A O no hydrogen 3.215 N/A VAL 219.A N GLN 208.A O no hydrogen 3.061 N/A SER 220.A N VAL 237.A O no hydrogen 2.794 N/A ILE 221.A N ALA 206.A O no hydrogen 2.603 N/A ASP 222.A N SER 235.A O no hydrogen 2.994 N/A LYS 225.A N ILE 221.A O no hydrogen 2.990 N/A LYS 225.A NZ ASP 56.A OD2 no hydrogen 3.412 N/A LYS 225.A NZ GLN 60.A O no hydrogen 2.897 N/A LYS 225.A NZ GLN 60.A OE1 no hydrogen 3.062 N/A LYS 225.A NZ ASP 222.A OD1 no hydrogen 3.362 N/A ARG 226.A N ASP 222.A O no hydrogen 3.136 N/A ARG 226.A NE ASP 222.A O no hydrogen 3.267 N/A ARG 226.A NH1 PRO 105.A O no hydrogen 3.155 N/A ASN 227.A N LYS 224.A O no hydrogen 3.230 N/A ILE 228.A N ASN 223.A O no hydrogen 2.914 N/A SER 235.A N ASN 223.A OD1 no hydrogen 2.720 N/A SER 235.A OG THR 54.A O no hydrogen 3.435 N/A SER 235.A OG LEU 195.A O no hydrogen 3.446 N/A LEU 236.A N LEU 195.A O no hydrogen 2.894 N/A VAL 237.A N SER 220.A O no hydrogen 2.856 N/A ILE 238.A N LEU 193.A O no hydrogen 2.886 N/A HIS 239.A N PHE 218.A O no hydrogen 2.857 N/A HIS 239.A NE2 LEU 57.A O no hydrogen 2.829 N/A THR 240.A N TYR 191.A O no hydrogen 2.992 N/A THR 240.A OG1 TYR 191.A O no hydrogen 3.244 N/A THR 240.A OG1 THR 241.A O no hydrogen 3.373 N/A THR 241.A N CYS 215.A O no hydrogen 3.174 N/A GLY 245.A N THR 241.A O no hydrogen 3.178 N/A VAL 246.A N VAL 242.A O no hydrogen 2.892 N/A THR 247.A N PRO 243.A O no hydrogen 3.090 N/A THR 247.A OG1 PRO 243.A O no hydrogen 2.834 N/A TYR 248.A N PHE 244.A O no hydrogen 3.139 N/A HIS 251.A N TYR 248.A O no hydrogen 3.239 N/A ASP 255.A N SER 252.A O no hydrogen 3.028 N/A ASP 255.A N SER 252.A OG no hydrogen 3.191 N/A VAL 256.A N SER 252.A O no hydrogen 2.939 N/A GLN 257.A N ILE 253.A O no hydrogen 2.950 N/A LEU 259.A N ASP 255.A O no hydrogen 3.260 N/A LEU 259.A N VAL 256.A O no hydrogen 3.121 N/A VAL 260.A N VAL 256.A O no hydrogen 3.191 N/A PHE 261.A N GLN 257.A O no hydrogen 3.004 N/A GLN 262.A N GLU 258.A O no hydrogen 3.261 N/A GLN 263.A N LEU 259.A O no hydrogen 3.237 N/A GLN 263.A N VAL 260.A O no hydrogen 3.098 N/A LEU 264.A N VAL 260.A O no hydrogen 2.870 N/A ASN 266.A N GLN 263.A O no hydrogen 3.347 N/A ILE 267.A N GLN 263.A O no hydrogen 3.497 N/A LEU 268.A N LEU 264.A O no hydrogen 2.799 N/A ILE 275.A N PHE 196.A O no hydrogen 2.917 N/A ALA 276.A N PHE 196.A O no hydrogen 3.427 N/A THR 277.A OG1 GLN 257.A OE1 no hydrogen 3.238 N/A LYS 278.A N GLY 194.A O no hydrogen 2.809 N/A CYS 279.A SG ALA 192.A O no hydrogen 3.672 N/A GLN 280.A N ALA 192.A O no hydrogen 2.887 N/A LYS 281.A NZ LEU 249.A O no hydrogen 2.776 N/A TRP 282.A N ARG 190.A O no hydrogen 2.873 N/A TRP 282.A NE1 LEU 57.A O no hydrogen 3.252 N/A SER 285.A N SER 188.A O no hydrogen 2.718 N/A SER 285.A OG SER 188.A O no hydrogen 3.008 N/A SER 285.A OG GLN 286.A OE1 no hydrogen 3.413 N/A VAL 287.A N SER 316.A OG no hydrogen 2.733 N/A THR 288.A N SER 186.A O no hydrogen 2.943 N/A THR 288.A OG1 SER 186.A O no hydrogen 3.217 N/A THR 288.A OG1 SER 186.A OG no hydrogen 3.159 N/A MET 298.A N CYS 308.A O no hydrogen 3.213 N/A LEU 300.A N LEU 306.A O no hydrogen 2.919 N/A LEU 306.A N HIS 301.A O no hydrogen 3.035 N/A ALA 307.A N ILE 154.A O no hydrogen 3.202 N/A CYS 308.A N MET 298.A O no hydrogen 2.981 N/A GLY 309.A N LEU 156.A O no hydrogen 2.595 N/A GLY 310.A N SER 324.A OG no hydrogen 2.757 N/A PHE 313.A N GLY 310.A O no hydrogen 3.430 N/A THR 314.A N ASP 311.A O no hydrogen 3.200 N/A THR 314.A OG1 GLY 310.A O no hydrogen 3.472 N/A THR 314.A OG1 GLY 320.A O no hydrogen 2.793 N/A ASN 317.A N GLN 315.A O no hydrogen 3.007 N/A GLY 320.A N ASN 317.A O no hydrogen 3.086 N/A GLY 320.A N ASN 317.A OD1 no hydrogen 3.121 N/A CYS 321.A N ASN 317.A O no hydrogen 3.227 N/A CYS 321.A SG ASN 317.A O no hydrogen 3.396 N/A ILE 322.A N PHE 318.A O no hydrogen 3.244 N/A THR 323.A N ASP 319.A O no hydrogen 3.042 N/A THR 323.A OG1 ASP 319.A O no hydrogen 2.633 N/A THR 323.A OG1 GLY 320.A O no hydrogen 2.999 N/A SER 324.A N GLY 320.A O no hydrogen 2.961 N/A SER 324.A OG GLY 296.A O no hydrogen 2.849 N/A SER 324.A OG GLY 310.A O no hydrogen 3.034 N/A ALA 325.A N CYS 321.A O no hydrogen 2.920 N/A LEU 326.A N ILE 322.A O no hydrogen 2.939 N/A CYS 327.A N THR 323.A O no hydrogen 3.042 N/A CYS 327.A SG THR 323.A O no hydrogen 3.419 N/A VAL 328.A N SER 324.A O no hydrogen 3.190 N/A LEU 329.A N ALA 325.A O no hydrogen 3.148 N/A GLU 330.A N LEU 326.A O no hydrogen 3.169 N/A ALA 331.A N CYS 327.A O no hydrogen 3.302 N/A ALA 331.A N VAL 328.A O no hydrogen 3.157 N/A LEU 332.A N VAL 328.A O no hydrogen 3.243 N/A TYR 335.A N LEU 332.A O no hydrogen 2.777 N/A