Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qku_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ILE 293.A O no hydrogen 2.726 N/A LYS 2.A N GLU 76.A O no hydrogen 3.136 N/A LYS 2.A NZ LEU 3.A O no hydrogen 3.499 N/A LYS 2.A NZ PHE 21.A O no hydrogen 3.526 N/A LEU 3.A N GLN 326.A OE1 no hydrogen 2.630 N/A GLU 4.A N ILE 74.A O no hydrogen 3.030 N/A ARG 5.A N ILE 74.A O no hydrogen 3.325 N/A VAL 6.A N VAL 19.A O no hydrogen 3.016 N/A THR 7.A N ASP 72.A O no hydrogen 2.711 N/A VAL 8.A N THR 17.A O no hydrogen 2.736 N/A LYS 9.A N TYR 70.A O no hydrogen 2.664 N/A ASN 10.A N SER 15.A O no hydrogen 3.111 N/A ASN 10.A ND2 ASP 68.A O no hydrogen 2.799 N/A ARG 12.A N PHE 61.A O no hydrogen 2.869 N/A ARG 12.A NE SER 38.A OG no hydrogen 2.670 N/A SER 13.A OG SER 34.A O no hydrogen 3.117 N/A SER 13.A OG SER 353.A OG no hydrogen 2.636 N/A HIS 14.A NE2 GLY 35.A O no hydrogen 3.051 N/A THR 17.A N VAL 8.A O no hydrogen 2.877 N/A THR 17.A OG1 HIS 14.A ND1 no hydrogen 3.293 N/A VAL 19.A N VAL 6.A O no hydrogen 2.915 N/A PHE 21.A N GLU 4.A O no hydrogen 2.789 N/A LYS 22.A N ASN 26.A OD1 no hydrogen 2.958 N/A GLY 24.A N PRO 325.A O no hydrogen 2.684 N/A ILE 25.A N ASP 341.A OD2 no hydrogen 3.005 N/A ASN 26.A N VAL 327.A O no hydrogen 2.659 N/A ASN 26.A ND2 LYS 22.A O no hydrogen 2.771 N/A ASN 26.A ND2 VAL 327.A O no hydrogen 3.410 N/A LEU 27.A N HIS 342.A O no hydrogen 3.262 N/A ILE 28.A N LEU 329.A O no hydrogen 2.969 N/A GLY 30.A N SER 331.A O no hydrogen 3.232 N/A SER 34.A OG GLN 31.A O no hydrogen 3.352 N/A LYS 36.A NZ GLY 30.A O no hydrogen 3.167 N/A LYS 36.A NZ GLU 300.A OE2 no hydrogen 2.907 N/A LYS 36.A NZ SER 331.A O no hydrogen 3.547 N/A SER 37.A OG GLN 140.A OE1 no hydrogen 2.414 N/A SER 37.A OG ASP 299.A OD2 no hydrogen 3.392 N/A LEU 39.A N GLY 35.A O no hydrogen 2.864 N/A LEU 40.A N LYS 36.A O no hydrogen 3.502 N/A ASP 41.A N SER 37.A O no hydrogen 3.016 N/A ALA 42.A N SER 38.A O no hydrogen 2.945 N/A ILE 43.A N LEU 39.A O no hydrogen 3.120 N/A LEU 44.A N LEU 40.A O no hydrogen 3.193 N/A VAL 45.A N ASP 41.A O no hydrogen 2.797 N/A GLY 46.A N ALA 42.A O no hydrogen 2.759 N/A LEU 47.A N ILE 43.A O no hydrogen 3.058 N/A TYR 48.A N LEU 44.A O no hydrogen 3.007 N/A TYR 48.A OH ILE 127.A O no hydrogen 2.282 N/A TRP 49.A N VAL 45.A O no hydrogen 2.799 N/A LYS 54.A NZ ARG 52.A O no hydrogen 3.183 N/A ILE 56.A N ILE 53.A O no hydrogen 3.225 N/A LYS 57.A NZ GLU 60.A OE2 no hydrogen 3.447 N/A LYS 58.A NZ LEU 89.A O no hydrogen 3.329 N/A LYS 58.A NZ GLU 96.A OE2 no hydrogen 2.936 N/A ASP 59.A N ASP 59.A OD2 no hydrogen 2.534 N/A GLU 60.A N LYS 57.A O no hydrogen 2.903 N/A PHE 61.A N LYS 57.A O no hydrogen 2.899 N/A THR 62.A OG1 LYS 58.A O no hydrogen 3.073 N/A THR 62.A OG1 THR 69.A OG1 no hydrogen 3.239 N/A LYS 63.A N ASN 10.A O no hydrogen 2.687 N/A LYS 63.A NZ GLY 351.A O no hydrogen 3.568 N/A ALA 66.A N LYS 63.A O no hydrogen 3.028 N/A THR 69.A N PHE 88.A O no hydrogen 2.947 N/A THR 69.A OG1 ASN 10.A O no hydrogen 3.213 N/A THR 69.A OG1 THR 62.A OG1 no hydrogen 3.239 N/A TYR 70.A N LYS 9.A O no hydrogen 2.809 N/A ILE 71.A N ARG 86.A O no hydrogen 2.916 N/A ASP 72.A N THR 7.A O no hydrogen 2.803 N/A LEU 73.A N ILE 84.A O no hydrogen 2.997 N/A ILE 74.A N ARG 5.A O no hydrogen 2.839 N/A PHE 75.A N TYR 82.A O no hydrogen 3.196 N/A GLU 76.A N LYS 2.A O no hydrogen 3.037 N/A LYS 77.A N THR 80.A O no hydrogen 2.877 N/A LYS 81.A NZ GLU 4.A OE1 no hydrogen 3.265 N/A TYR 82.A N PHE 75.A O no hydrogen 2.699 N/A ARG 83.A NE ASP 72.A OD1 no hydrogen 2.801 N/A ARG 83.A NE ASP 72.A OD2 no hydrogen 3.294 N/A ARG 83.A NH2 ASP 72.A OD2 no hydrogen 3.087 N/A ILE 84.A N LEU 73.A O no hydrogen 3.216 N/A THR 85.A N ALA 99.A O no hydrogen 2.937 N/A THR 85.A OG1 ASP 72.A OD1 no hydrogen 2.982 N/A ARG 86.A N ILE 71.A O no hydrogen 2.820 N/A ARG 86.A NE GLY 46.A O no hydrogen 2.686 N/A ARG 87.A N ILE 97.A O no hydrogen 2.905 N/A PHE 88.A N THR 69.A O no hydrogen 2.683 N/A LYS 90.A N ARG 67.A O no hydrogen 2.717 N/A LYS 90.A NZ ALA 66.A O no hydrogen 3.550 N/A TYR 92.A N LYS 90.A O no hydrogen 2.611 N/A ILE 97.A N ARG 87.A O no hydrogen 3.300 N/A ALA 99.A N THR 85.A O no hydrogen 3.058 N/A LYS 101.A N ARG 83.A O no hydrogen 2.800 N/A LEU 103.A N LYS 81.A O no hydrogen 3.296 N/A VAL 104.A N GLU 107.A O no hydrogen 3.292 N/A GLU 107.A N VAL 104.A O no hydrogen 2.968 N/A VAL 111.A N MET 100.A O no hydrogen 2.782 N/A SER 115.A N GLU 113.A O no hydrogen 2.679 N/A ALA 118.A N SER 115.A O no hydrogen 3.018 N/A ILE 119.A N SER 115.A O no hydrogen 3.133 N/A SER 120.A N SER 116.A O no hydrogen 2.626 N/A ALA 121.A N LYS 117.A O no hydrogen 3.122 N/A PHE 122.A N ALA 118.A O no hydrogen 2.801 N/A MET 123.A N ILE 119.A O no hydrogen 2.636 N/A GLU 124.A N SER 120.A O no hydrogen 2.984 N/A LYS 125.A N PHE 122.A O no hydrogen 3.157 N/A LEU 126.A N PHE 122.A O no hydrogen 3.191 N/A ILE 127.A N MET 123.A O no hydrogen 2.857 N/A TYR 129.A N GLU 124.A OE1 no hydrogen 3.264 N/A TYR 129.A N GLU 124.A OE2 no hydrogen 3.189 N/A PHE 132.A N PRO 128.A O no hydrogen 3.153 N/A LEU 133.A N TYR 129.A O no hydrogen 2.871 N/A ASN 134.A N ASN 130.A O no hydrogen 3.291 N/A ALA 135.A N ILE 131.A O no hydrogen 3.025 N/A ILE 136.A N PHE 132.A O no hydrogen 3.273 N/A TYR 137.A N PHE 132.A O no hydrogen 2.875 N/A TYR 137.A OH ASP 41.A OD1 no hydrogen 2.742 N/A ILE 138.A N ILE 297.A O no hydrogen 2.777 N/A ARG 139.A NH1 ASP 55.A OD1 no hydrogen 3.256 N/A ALA 145.A N GLN 142.A O no hydrogen 3.170 N/A LEU 147.A N ASP 144.A O no hydrogen 2.716 N/A GLU 148.A N ALA 145.A O no hydrogen 3.231 N/A ARG 153.A N SER 149.A O no hydrogen 2.745 N/A ARG 153.A NE VAL 253.A O no hydrogen 2.949 N/A ARG 153.A NH1 ILE 146.A O no hydrogen 2.815 N/A ARG 153.A NH2 VAL 253.A O no hydrogen 3.213 N/A GLU 154.A N ASP 150.A O no hydrogen 3.304 N/A LYS 155.A N GLU 151.A O no hydrogen 3.308 N/A LYS 155.A NZ GLU 159.A OE1 no hydrogen 3.047 N/A LYS 155.A NZ GLU 159.A OE2 no hydrogen 3.144 N/A VAL 156.A N ALA 152.A O no hydrogen 3.379 N/A VAL 157.A N ARG 153.A O no hydrogen 3.086 N/A ARG 158.A N GLU 154.A O no hydrogen 2.927 N/A ARG 158.A NE GLU 154.A OE1 no hydrogen 3.432 N/A GLU 159.A N LYS 155.A O no hydrogen 2.816 N/A VAL 160.A N VAL 156.A O no hydrogen 3.093 N/A LEU 161.A N VAL 157.A O no hydrogen 2.889 N/A ASN 162.A N GLU 159.A O no hydrogen 3.009 N/A GLU 167.A N LEU 163.A O no hydrogen 2.781 N/A THR 168.A N ASP 164.A O no hydrogen 3.252 N/A THR 168.A OG1 LYS 165.A O no hydrogen 2.979 N/A TYR 170.A N PHE 166.A O no hydrogen 2.833 N/A LYS 171.A N GLU 167.A O no hydrogen 3.041 N/A LYS 172.A N THR 168.A O no hydrogen 3.186 N/A LEU 173.A N ALA 169.A O no hydrogen 2.742 N/A SER 174.A N TYR 170.A O no hydrogen 3.207 N/A SER 174.A OG TYR 170.A O no hydrogen 3.210 N/A LEU 176.A N LYS 172.A O no hydrogen 3.196 N/A LEU 176.A N LEU 173.A O no hydrogen 3.185 N/A LYS 177.A N LEU 173.A O no hydrogen 3.033 N/A THR 179.A N GLU 175.A O no hydrogen 3.121 N/A ILE 180.A N LEU 176.A O no hydrogen 3.327 N/A ARG 183.A N ILE 180.A O no hydrogen 2.975 N/A ILE 184.A N ILE 180.A O no hydrogen 2.865 N/A GLY 189.A N TYR 187.A O no hydrogen 2.846 N/A GLY 191.A N GLY 189.A O no hydrogen 2.740 N/A GLU 197.A N ILE 193.A O no hydrogen 2.632 N/A LYS 200.A N LEU 196.A O no hydrogen 3.316 N/A LYS 200.A NZ ASN 181.A OD1 no hydrogen 2.743 N/A THR 203.A N ALA 199.A O no hydrogen 3.192 N/A THR 203.A OG1 ALA 199.A O no hydrogen 3.074 N/A GLU 204.A N LYS 200.A O no hydrogen 3.105 N/A GLU 205.A N ASP 201.A O no hydrogen 3.177 N/A LEU 206.A N PHE 202.A O no hydrogen 2.933 N/A ILE 207.A N THR 203.A O no hydrogen 2.801 N/A GLU 208.A N GLU 204.A O no hydrogen 3.022 N/A LYS 209.A N GLU 205.A O no hydrogen 3.011 N/A VAL 210.A N LEU 206.A O no hydrogen 2.644 N/A LYS 211.A N ILE 207.A O no hydrogen 3.212 N/A LYS 212.A N GLU 208.A O no hydrogen 2.925 N/A TYR 213.A N VAL 210.A O no hydrogen 2.877 N/A LYS 214.A N VAL 210.A O no hydrogen 3.117 N/A LYS 214.A NZ GLU 167.A OE2 no hydrogen 3.003 N/A ALA 215.A N LYS 211.A O no hydrogen 3.485 N/A LEU 216.A N LYS 212.A O no hydrogen 3.268 N/A ALA 217.A N TYR 213.A O no hydrogen 2.716 N/A ARG 218.A N LYS 214.A O no hydrogen 3.442 N/A GLU 219.A N ALA 215.A O no hydrogen 2.970 N/A ALA 220.A N LEU 216.A O no hydrogen 2.727 N/A ALA 221.A N ALA 217.A O no hydrogen 2.723 N/A LEU 222.A N ARG 218.A O no hydrogen 3.042 N/A SER 223.A N GLU 219.A O no hydrogen 2.940 N/A LYS 224.A N ALA 220.A O no hydrogen 3.292 N/A ILE 225.A N ALA 221.A O no hydrogen 2.997 N/A GLY 226.A N LEU 222.A O no hydrogen 2.784 N/A GLU 227.A N SER 223.A O no hydrogen 3.503 N/A LEU 228.A N LYS 224.A O no hydrogen 3.022 N/A ALA 229.A N ILE 225.A O no hydrogen 2.906 N/A ALA 229.A N GLY 226.A O no hydrogen 2.837 N/A SER 230.A N GLY 226.A O no hydrogen 2.841 N/A SER 230.A OG GLY 226.A O no hydrogen 2.855 N/A SER 230.A OG VAL 244.A O no hydrogen 2.848 N/A GLU 231.A N GLU 227.A O no hydrogen 3.071 N/A ILE 232.A N LEU 228.A O no hydrogen 3.367 N/A PHE 233.A N ALA 229.A O no hydrogen 2.722 N/A PHE 233.A N SER 230.A O no hydrogen 3.206 N/A ALA 234.A N SER 230.A O no hydrogen 2.736 N/A GLU 235.A N GLU 231.A O no hydrogen 3.080 N/A PHE 236.A N ILE 232.A O no hydrogen 2.906 N/A THR 237.A N PHE 233.A O no hydrogen 2.770 N/A THR 237.A OG1 PHE 233.A O no hydrogen 2.911 N/A GLU 238.A N GLU 235.A O no hydrogen 3.300 N/A GLY 239.A N ALA 234.A O no hydrogen 2.637 N/A LYS 240.A N THR 237.A O no hydrogen 3.129 N/A LYS 240.A NZ GLU 273.A OE2 no hydrogen 3.234 N/A TYR 241.A OH GLU 273.A OE1 no hydrogen 2.895 N/A TYR 241.A OH GLU 273.A OE2 no hydrogen 2.622 N/A SER 242.A N VAL 258.A O no hydrogen 3.137 N/A VAL 244.A N SER 230.A OG no hydrogen 2.851 N/A VAL 245.A N PHE 256.A O no hydrogen 2.591 N/A ARG 247.A N ARG 254.A O no hydrogen 2.913 N/A ARG 247.A NH1 GLU 263.A OE2 no hydrogen 2.797 N/A ARG 247.A NH2 GLU 263.A OE1 no hydrogen 2.757 N/A GLU 249.A N LYS 252.A O no hydrogen 2.760 N/A LYS 252.A N GLU 249.A O no hydrogen 2.889 N/A VAL 253.A N ASP 150.A O no hydrogen 3.193 N/A ARG 254.A N ARG 247.A O no hydrogen 2.720 N/A ARG 254.A NH1 ASP 150.A OD1 no hydrogen 2.817 N/A PHE 256.A N VAL 245.A O no hydrogen 2.965 N/A VAL 257.A N ARG 264.A O no hydrogen 3.113 N/A VAL 258.A N GLU 243.A O no hydrogen 3.229 N/A TRP 259.A N LYS 262.A O no hydrogen 3.077 N/A LYS 262.A N TRP 259.A O no hydrogen 3.518 N/A ARG 264.A N VAL 257.A O no hydrogen 2.617 N/A ARG 264.A NE LYS 262.A O no hydrogen 2.999 N/A PHE 268.A N PRO 265.A O no hydrogen 2.785 N/A LEU 269.A N LEU 266.A O no hydrogen 3.275 N/A SER 270.A N GLU 273.A OE1 no hydrogen 2.598 N/A GLU 273.A N SER 270.A OG no hydrogen 3.419 N/A ARG 274.A N SER 270.A O no hydrogen 2.977 N/A ARG 274.A N GLY 271.A O no hydrogen 3.162 N/A ARG 274.A NH2 ASP 144.A OD2 no hydrogen 2.756 N/A ILE 275.A N GLY 271.A O no hydrogen 3.426 N/A ALA 276.A N GLY 272.A O no hydrogen 2.971 N/A LEU 277.A N GLU 273.A O no hydrogen 3.030 N/A GLY 278.A N ARG 274.A O no hydrogen 2.793 N/A LEU 279.A N ILE 275.A O no hydrogen 2.838 N/A ALA 280.A N ALA 276.A O no hydrogen 2.859 N/A PHE 281.A N LEU 277.A O no hydrogen 2.918 N/A PHE 281.A N GLY 278.A O no hydrogen 3.032 N/A ARG 282.A N GLY 278.A O no hydrogen 2.900 N/A ARG 282.A NE ILE 143.A O no hydrogen 3.017 N/A ARG 282.A NH2 GLN 142.A O no hydrogen 2.378 N/A ARG 282.A NH2 ILE 143.A O no hydrogen 3.173 N/A LEU 283.A N LEU 279.A O no hydrogen 2.866 N/A ALA 284.A N ALA 280.A O no hydrogen 2.994 N/A MET 285.A N PHE 281.A O no hydrogen 3.003 N/A SER 286.A N ARG 282.A O no hydrogen 3.070 N/A LEU 287.A N LEU 283.A O no hydrogen 2.744 N/A TYR 288.A N ALA 284.A O no hydrogen 3.156 N/A LEU 289.A N MET 285.A O no hydrogen 2.828 N/A ILE 293.A N LEU 289.A O no hydrogen 3.258 N/A SER 294.A N LEU 289.A O no hydrogen 3.499 N/A SER 294.A OG ALA 290.A O no hydrogen 3.162 N/A LEU 296.A N GLN 326.A O no hydrogen 3.167 N/A ILE 297.A N ILE 136.A O no hydrogen 2.877 N/A LEU 298.A N ILE 328.A O no hydrogen 2.995 N/A ASP 299.A N ILE 138.A O no hydrogen 3.200 N/A GLU 300.A N VAL 330.A O no hydrogen 3.169 N/A GLU 308.A N ASP 306.A OD2 no hydrogen 3.422 N/A ARG 310.A N ASP 306.A O no hydrogen 3.353 N/A ARG 310.A NH1 GLU 307.A OE2 no hydrogen 3.556 N/A ARG 311.A N GLU 307.A O no hydrogen 3.317 N/A LYS 312.A N GLU 308.A O no hydrogen 3.004 N/A LYS 312.A NZ GLU 235.A O no hydrogen 3.471 N/A LEU 313.A N ARG 309.A O no hydrogen 2.683 N/A ILE 314.A N ARG 310.A O no hydrogen 2.879 N/A THR 315.A N ARG 311.A O no hydrogen 3.060 N/A THR 315.A OG1 ARG 311.A O no hydrogen 3.187 N/A ILE 316.A N LYS 312.A O no hydrogen 2.977 N/A MET 317.A N LEU 313.A O no hydrogen 2.686 N/A GLU 318.A N ILE 314.A O no hydrogen 2.812 N/A ARG 319.A N THR 315.A O no hydrogen 3.218 N/A TYR 320.A N ILE 316.A O no hydrogen 2.783 N/A TYR 320.A OH GLU 231.A OE2 no hydrogen 2.859 N/A LEU 321.A N MET 317.A O no hydrogen 2.609 N/A LYS 322.A NZ GLU 318.A OE2 no hydrogen 3.248 N/A LYS 323.A N TYR 320.A O no hydrogen 2.873 N/A LYS 323.A NZ ARG 319.A O no hydrogen 2.677 N/A GLN 326.A N SER 294.A O no hydrogen 2.957 N/A GLN 326.A NE2 LEU 3.A O no hydrogen 2.922 N/A GLN 326.A NE2 LYS 22.A O no hydrogen 3.058 N/A VAL 327.A N GLY 24.A O no hydrogen 2.842 N/A ILE 328.A N LEU 296.A O no hydrogen 2.867 N/A LEU 329.A N ASN 26.A O no hydrogen 2.806 N/A VAL 330.A N LEU 298.A O no hydrogen 3.255 N/A ASP 333.A N SER 331.A OG no hydrogen 3.255 N/A LEU 336.A N ASP 333.A O no hydrogen 3.267 N/A LYS 337.A N GLU 334.A O no hydrogen 2.897 N/A ALA 339.A N LEU 336.A O no hydrogen 2.798 N/A HIS 342.A N ILE 25.A O no hydrogen 3.188 N/A HIS 342.A NE2 GLU 23.A O no hydrogen 2.793 N/A VAL 343.A N SER 359.A O no hydrogen 3.194 N/A ILE 344.A N LEU 27.A O no hydrogen 2.961 N/A ARG 345.A N GLU 356.A O no hydrogen 3.280 N/A ARG 345.A NH1 GLU 334.A OE1 no hydrogen 3.520 N/A ILE 346.A N ILE 29.A O no hydrogen 3.127 N/A SER 347.A N LYS 354.A O no hydrogen 3.280 N/A GLU 349.A N SER 352.A O no hydrogen 2.844 N/A SER 352.A N GLU 349.A O no hydrogen 2.836 N/A SER 352.A OG GLY 351.A O no hydrogen 2.748 N/A SER 353.A N SER 13.A O no hydrogen 3.351 N/A SER 353.A OG SER 13.A OG no hydrogen 2.636 N/A SER 353.A OG SER 34.A O no hydrogen 2.819 N/A SER 359.A N VAL 343.A O no hydrogen 3.052 N/A SER 359.A OG VAL 358.A O no hydrogen 2.731 N/A