Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fkl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 PRO 89.A O no hydrogen 2.656 N/A TYR 6.A N VAL 17.A O no hydrogen 3.011 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.604 N/A GLN 8.A N TRP 15.A O no hydrogen 3.001 N/A LEU 10.A N THR 13.A O no hydrogen 3.040 N/A THR 13.A OG1 ASN 11.A O no hydrogen 3.317 N/A TRP 15.A N GLN 8.A O no hydrogen 2.662 N/A GLU 16.A N TYR 100.A OH no hydrogen 2.941 N/A VAL 17.A N TYR 6.A O no hydrogen 3.213 N/A GLU 19.A N THR 4.A O no hydrogen 2.939 N/A ARG 20.A NE ASP 40.A OD1 no hydrogen 2.810 N/A ARG 20.A NH2 ASP 40.A OD1 no hydrogen 3.275 N/A ARG 20.A NH2 ASP 40.A OD2 no hydrogen 2.620 N/A TYR 21.A N PRO 18.A O no hydrogen 3.038 N/A TYR 21.A OH ASP 85.A OD1 no hydrogen 2.699 N/A GLN 22.A N PHE 39.A O no hydrogen 2.949 N/A GLN 22.A NE2 GLU 19.A O no hydrogen 2.649 N/A SER 25.A N ALA 37.A O no hydrogen 2.895 N/A VAL 27.A N VAL 35.A O no hydrogen 2.898 N/A GLY 30.A N GLY 33.A O no hydrogen 2.752 N/A SER 34.A OG ASN 11.A OD1 no hydrogen 2.937 N/A VAL 35.A N GLY 28.A O no hydrogen 2.760 N/A CYS 36.A N VAL 49.A O no hydrogen 2.768 N/A ALA 37.A N SER 25.A O no hydrogen 2.671 N/A ALA 38.A N VAL 47.A O no hydrogen 2.935 N/A PHE 39.A N GLN 22.A O no hydrogen 2.897 N/A ASP 40.A N LEU 45.A O no hydrogen 2.886 N/A THR 41.A N ARG 20.A O no hydrogen 2.813 N/A THR 41.A OG1 ARG 20.A O no hydrogen 2.740 N/A LYS 42.A N ASP 40.A OD1 no hydrogen 3.081 N/A THR 43.A N ASP 40.A O no hydrogen 3.334 N/A THR 43.A OG1 ASP 40.A OD2 no hydrogen 2.702 N/A GLY 44.A N ASP 40.A O no hydrogen 2.771 N/A VAL 47.A N ALA 38.A O no hydrogen 2.852 N/A ALA 48.A N THR 103.A O no hydrogen 2.819 N/A VAL 49.A N CYS 36.A O no hydrogen 2.691 N/A LYS 50.A N LEU 101.A O no hydrogen 2.780 N/A LYS 50.A NZ ALA 31.A O no hydrogen 2.713 N/A LYS 50.A NZ GLU 68.A OE1 no hydrogen 3.470 N/A LYS 50.A NZ GLU 68.A OE2 no hydrogen 2.536 N/A LYS 51.A N SER 34.A O no hydrogen 3.208 N/A LYS 51.A NZ ILE 14.A O no hydrogen 2.758 N/A LEU 52.A N VAL 99.A O no hydrogen 2.969 N/A SER 53.A N TYR 32.A O no hydrogen 3.049 N/A SER 53.A OG TYR 32.A O no hydrogen 3.265 N/A SER 58.A OG HIS 61.A ND1 no hydrogen 2.796 N/A HIS 61.A N SER 58.A OG no hydrogen 3.120 N/A HIS 61.A ND1 SER 58.A OG no hydrogen 2.796 N/A ALA 62.A N SER 58.A O no hydrogen 2.797 N/A LYS 63.A N ILE 59.A O no hydrogen 2.909 N/A LYS 63.A NZ GLU 320.A O no hydrogen 2.754 N/A LYS 63.A NZ ARG 322.A O no hydrogen 3.461 N/A ARG 64.A N ILE 60.A O no hydrogen 3.117 N/A THR 65.A N HIS 61.A O no hydrogen 2.926 N/A THR 65.A OG1 PRO 55.A O no hydrogen 2.834 N/A THR 65.A OG1 HIS 61.A O no hydrogen 2.796 N/A TYR 66.A N ALA 62.A O no hydrogen 3.091 N/A ARG 67.A N LYS 63.A O no hydrogen 2.802 N/A ARG 67.A NE GLU 320.A OE1 no hydrogen 3.430 N/A ARG 67.A NE GLU 320.A OE2 no hydrogen 2.782 N/A ARG 67.A NH1 GLU 320.A OE1 no hydrogen 2.755 N/A GLU 68.A N ARG 64.A O no hydrogen 2.926 N/A LEU 69.A N THR 65.A O no hydrogen 3.113 N/A ARG 70.A N TYR 66.A O no hydrogen 2.943 N/A ARG 70.A NH1 TYR 66.A OH no hydrogen 3.281 N/A ARG 70.A NH1 ASP 316.A O no hydrogen 3.196 N/A ARG 70.A NH2 ASP 316.A O no hydrogen 2.724 N/A LEU 71.A N ARG 67.A O no hydrogen 2.996 N/A LEU 72.A N GLU 68.A O no hydrogen 2.851 N/A LYS 73.A N LEU 69.A O no hydrogen 2.875 N/A LYS 73.A NZ GLU 336.A O no hydrogen 2.674 N/A LYS 73.A NZ GLU 336.A OE1 no hydrogen 2.788 N/A HIS 74.A N ARG 70.A O no hydrogen 3.148 N/A HIS 74.A N LEU 71.A O no hydrogen 3.208 N/A HIS 74.A NE2 PRO 314.A O no hydrogen 3.121 N/A MET 75.A N LEU 71.A O no hydrogen 3.154 N/A LYS 76.A N TYR 137.A OH no hydrogen 2.904 N/A ASN 79.A ND2 GLN 130.A OE1 no hydrogen 3.218 N/A ASN 79.A ND2 LEU 161.A O no hydrogen 2.946 N/A VAL 80.A N HIS 77.A O no hydrogen 3.240 N/A ILE 81.A N ILE 163.A O no hydrogen 2.979 N/A LEU 84.A N VAL 102.A O no hydrogen 2.822 N/A ASP 85.A N VAL 102.A O no hydrogen 3.348 N/A PHE 87.A N TYR 100.A O no hydrogen 3.107 N/A THR 88.A OG1 ASP 98.A O no hydrogen 2.870 N/A ALA 90.A N THR 88.A OG1 no hydrogen 3.343 N/A ARG 91.A N GLU 95.A OE1 no hydrogen 2.874 N/A PHE 96.A N LEU 93.A O no hydrogen 3.242 N/A TYR 100.A N PHE 87.A O no hydrogen 3.079 N/A LEU 101.A N LYS 50.A O no hydrogen 2.804 N/A VAL 102.A N ASP 85.A O no hydrogen 2.810 N/A THR 103.A N ALA 48.A O no hydrogen 2.927 N/A THR 103.A OG1 HIS 104.A O no hydrogen 2.864 N/A LEU 105.A N ARG 46.A O no hydrogen 3.189 N/A ALA 108.A N VAL 155.A O no hydrogen 3.085 N/A ASP 109.A N ASN 112.A OD1 no hydrogen 3.142 N/A LEU 110.A N PRO 150.A O no hydrogen 3.160 N/A LEU 110.A N LEU 153.A O no hydrogen 2.907 N/A ASN 112.A N ASP 109.A O no hydrogen 2.987 N/A ASN 112.A N ASP 109.A OD2 no hydrogen 3.194 N/A ILE 113.A N LEU 110.A O no hydrogen 3.252 N/A VAL 114.A N LEU 110.A O no hydrogen 3.046 N/A LYS 115.A N ASN 111.A O no hydrogen 3.246 N/A LYS 115.A NZ ASN 112.A O no hydrogen 2.971 N/A GLN 117.A N VAL 114.A O no hydrogen 2.976 N/A LEU 119.A N LEU 208.A O no hydrogen 3.177 N/A HIS 123.A N THR 120.A OG1 no hydrogen 3.407 N/A VAL 124.A N THR 120.A O no hydrogen 3.001 N/A GLN 125.A N ASP 121.A O no hydrogen 2.835 N/A GLN 125.A NE2 ASP 121.A OD2 no hydrogen 3.141 N/A PHE 126.A N ASP 122.A O no hydrogen 2.970 N/A LEU 127.A N HIS 123.A O no hydrogen 2.975 N/A ILE 128.A N VAL 124.A O no hydrogen 3.006 N/A TYR 129.A N GLN 125.A O no hydrogen 2.995 N/A TYR 129.A OH GLU 309.A OE2 no hydrogen 2.642 N/A GLN 130.A N PHE 126.A O no hydrogen 3.202 N/A GLN 130.A NE2 PHE 126.A O no hydrogen 3.260 N/A GLN 130.A NE2 CYS 159.A O no hydrogen 2.757 N/A ILE 131.A N LEU 127.A O no hydrogen 3.127 N/A LEU 132.A N ILE 128.A O no hydrogen 2.978 N/A ARG 133.A N TYR 129.A O no hydrogen 2.880 N/A ARG 133.A NE ASP 308.A O no hydrogen 2.878 N/A ARG 133.A NH1 ASP 308.A O no hydrogen 3.131 N/A ARG 133.A NH1 ASP 308.A OD1 no hydrogen 3.475 N/A ARG 133.A NH2 GLU 78.A OE2 no hydrogen 2.805 N/A ARG 133.A NH2 ASN 79.A OD1 no hydrogen 2.877 N/A GLY 134.A N GLN 130.A O no hydrogen 2.917 N/A LEU 135.A N ILE 131.A O no hydrogen 2.759 N/A LYS 136.A N LEU 132.A O no hydrogen 2.806 N/A LYS 136.A NZ GLU 309.A O no hydrogen 2.731 N/A TYR 137.A N ARG 133.A O no hydrogen 3.355 N/A ILE 138.A N GLY 134.A O no hydrogen 2.989 N/A HIS 139.A N LEU 135.A O no hydrogen 2.769 N/A HIS 139.A NE2 ASP 197.A OD2 no hydrogen 2.680 N/A SER 140.A N LYS 136.A O no hydrogen 2.953 N/A SER 140.A OG LYS 136.A O no hydrogen 3.507 N/A SER 140.A OG TYR 137.A O no hydrogen 2.449 N/A ALA 141.A N ILE 138.A O no hydrogen 3.056 N/A ASP 142.A N HIS 139.A O no hydrogen 2.935 N/A ILE 143.A N ILE 138.A O no hydrogen 3.354 N/A HIS 145.A N ASP 197.A OD2 no hydrogen 2.845 N/A HIS 145.A NE2 LEU 164.A O no hydrogen 2.773 N/A ARG 146.A N ASP 197.A OD1 no hydrogen 2.831 N/A ARG 146.A NH1 TYR 192.A OH no hydrogen 2.695 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.153 N/A LYS 149.A N ASN 152.A OD1 no hydrogen 2.967 N/A LYS 149.A NZ ASP 147.A OD2 no hydrogen 3.380 N/A ASN 152.A N LYS 149.A O no hydrogen 2.964 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 2.829 N/A LEU 153.A N PRO 150.A O no hydrogen 3.268 N/A ALA 154.A N LYS 162.A O no hydrogen 2.914 N/A VAL 155.A N ALA 108.A O no hydrogen 2.803 N/A ASN 156.A N GLU 160.A O no hydrogen 3.024 N/A CYS 159.A N ASN 156.A O no hydrogen 2.965 N/A CYS 159.A SG HIS 123.A ND1 no hydrogen 3.956 N/A GLU 160.A N ASN 156.A OD1 no hydrogen 3.014 N/A LEU 161.A N GLN 130.A OE1 no hydrogen 2.873 N/A LYS 162.A N ALA 154.A O no hydrogen 2.810 N/A LYS 162.A NZ GLU 78.A O no hydrogen 2.748 N/A ILE 163.A N ASN 79.A O no hydrogen 2.884 N/A LEU 164.A N ASN 152.A O no hydrogen 2.880 N/A GLY 167.A N ILE 144.A O no hydrogen 3.062 N/A VAL 175.A N GLY 173.A O no hydrogen 3.000 N/A THR 177.A OG1 GLU 170.A O no hydrogen 2.616 N/A ARG 178.A N VAL 175.A O no hydrogen 3.223 N/A ARG 178.A NE GLN 223.A OE1 no hydrogen 2.848 N/A ARG 178.A NH1 MET 171.A O no hydrogen 2.860 N/A ARG 178.A NH1 GLY 173.A O no hydrogen 2.765 N/A ARG 178.A NH2 GLY 173.A O no hydrogen 3.122 N/A ARG 178.A NH2 GLY 217.A O no hydrogen 2.913 N/A ARG 178.A NH2 GLN 223.A OE1 no hydrogen 3.085 N/A TRP 179.A NE1 GLY 217.A O no hydrogen 2.982 N/A TYR 180.A OH GLU 207.A OE1 no hydrogen 2.423 N/A TYR 180.A OH GLU 207.A OE2 no hydrogen 3.358 N/A ARG 181.A N ARG 178.A O no hydrogen 3.226 N/A ARG 181.A NH1 ARG 146.A O no hydrogen 2.867 N/A GLU 184.A N GLU 184.A OE2 no hydrogen 2.979 N/A ILE 185.A N ALA 182.A O no hydrogen 3.048 N/A MET 186.A N ALA 182.A O no hydrogen 3.019 N/A LEU 187.A N PRO 183.A O no hydrogen 3.022 N/A ASN 188.A N ILE 185.A O no hydrogen 3.452 N/A TRP 189.A N GLU 184.A O no hydrogen 2.774 N/A ASN 193.A ND2 SER 285.A O no hydrogen 3.643 N/A GLN 194.A NE2 HIS 139.A O no hydrogen 2.787 N/A THR 195.A N ASN 193.A OD1 no hydrogen 2.904 N/A THR 195.A OG1 ASN 193.A OD1 no hydrogen 2.591 N/A THR 195.A OG1 SER 285.A O no hydrogen 2.884 N/A VAL 196.A N ASN 193.A O no hydrogen 3.353 N/A ASP 197.A N GLN 194.A O no hydrogen 3.067 N/A ILE 198.A N THR 195.A O no hydrogen 3.076 N/A TRP 199.A N THR 195.A O no hydrogen 3.193 N/A SER 200.A N VAL 196.A O no hydrogen 3.368 N/A SER 200.A OG TYR 180.A O no hydrogen 2.815 N/A SER 200.A OG VAL 196.A O no hydrogen 3.383 N/A VAL 201.A N ASP 197.A O no hydrogen 3.014 N/A GLY 202.A N ILE 198.A O no hydrogen 3.015 N/A CYS 203.A N TRP 199.A O no hydrogen 2.997 N/A CYS 203.A SG TRP 179.A O no hydrogen 3.991 N/A CYS 203.A SG TRP 199.A O no hydrogen 3.565 N/A ILE 204.A N SER 200.A O no hydrogen 2.947 N/A MET 205.A N VAL 201.A O no hydrogen 2.738 N/A ALA 206.A N GLY 202.A O no hydrogen 3.007 N/A GLU 207.A N CYS 203.A O no hydrogen 3.205 N/A LEU 208.A N ILE 204.A O no hydrogen 2.959 N/A LEU 209.A N MET 205.A O no hydrogen 2.996 N/A THR 210.A N ALA 206.A O no hydrogen 2.933 N/A THR 210.A OG1 ALA 206.A O no hydrogen 3.068 N/A GLY 211.A N GLU 207.A O no hydrogen 2.680 N/A ARG 212.A N THR 210.A OG1 no hydrogen 3.141 N/A GLY 217.A N PHE 215.A O no hydrogen 2.774 N/A THR 218.A N ASP 222.A OD1 no hydrogen 2.753 N/A THR 218.A OG1 ASP 219.A OD2 no hydrogen 3.369 N/A ASP 222.A N ASP 219.A OD1 no hydrogen 3.035 N/A GLN 223.A N ASP 219.A O no hydrogen 2.901 N/A GLN 223.A NE2 ARG 178.A O no hydrogen 2.752 N/A LEU 224.A N HIS 220.A O no hydrogen 3.010 N/A LYS 225.A N ILE 221.A O no hydrogen 2.998 N/A LEU 226.A N ASP 222.A O no hydrogen 3.020 N/A ILE 227.A N GLN 223.A O no hydrogen 2.899 N/A LEU 228.A N LEU 224.A O no hydrogen 2.846 N/A ARG 229.A N LYS 225.A O no hydrogen 2.958 N/A LEU 230.A N LEU 226.A O no hydrogen 3.422 N/A LEU 230.A N ILE 227.A O no hydrogen 2.993 N/A VAL 231.A N ILE 227.A O no hydrogen 2.944 N/A GLY 232.A N LEU 228.A O no hydrogen 2.704 N/A THR 233.A N MET 257.A O no hydrogen 2.971 N/A THR 233.A OG1 MET 257.A O no hydrogen 3.176 N/A LEU 239.A N GLY 235.A O no hydrogen 3.086 N/A LYS 240.A N ALA 236.A O no hydrogen 3.115 N/A LYS 241.A NZ ASP 284.A OD1 no hydrogen 2.689 N/A LYS 241.A NZ ASP 284.A OD2 no hydrogen 3.368 N/A LYS 241.A NZ ASP 286.A OD1 no hydrogen 3.185 N/A ILE 242.A N LEU 238.A O no hydrogen 3.174 N/A ILE 242.A N LEU 239.A O no hydrogen 3.129 N/A SER 243.A OG TRP 189.A O no hydrogen 3.337 N/A SER 244.A N TRP 189.A O no hydrogen 3.090 N/A ALA 247.A N SER 244.A OG no hydrogen 3.216 N/A ARG 248.A N SER 244.A O no hydrogen 2.926 N/A ARG 248.A NH1 LEU 239.A O no hydrogen 3.518 N/A ASN 249.A N GLU 245.A O no hydrogen 2.969 N/A TYR 250.A N SER 246.A O no hydrogen 3.262 N/A ILE 251.A N ALA 247.A O no hydrogen 3.073 N/A GLN 252.A N ARG 248.A O no hydrogen 3.047 N/A SER 253.A N TYR 250.A O no hydrogen 3.118 N/A SER 253.A OG TYR 250.A O no hydrogen 2.670 N/A LEU 254.A N ILE 251.A O no hydrogen 3.228 N/A MET 257.A N THR 233.A OG1 no hydrogen 2.892 N/A LYS 259.A NZ MET 260.A O no hydrogen 3.154 N/A LYS 259.A NZ GLU 278.A OE2 no hydrogen 3.068 N/A MET 260.A N LEU 230.A O no hydrogen 2.930 N/A ALA 263.A N ASN 261.A OD1 no hydrogen 2.978 N/A ASN 264.A N ASN 261.A O no hydrogen 3.012 N/A VAL 265.A N PHE 262.A O no hydrogen 3.076 N/A PHE 266.A N PHE 262.A O no hydrogen 2.789 N/A ALA 269.A N PHE 266.A O no hydrogen 3.218 N/A ASN 270.A ND2 ASP 121.A OD2 no hydrogen 2.832 N/A LEU 272.A N ASN 270.A OD1 no hydrogen 2.942 N/A VAL 274.A N ASN 270.A O no hydrogen 3.075 N/A ASP 275.A N PRO 271.A O no hydrogen 2.972 N/A LEU 276.A N LEU 272.A O no hydrogen 2.954 N/A LEU 277.A N ALA 273.A O no hydrogen 2.865 N/A GLU 278.A N VAL 274.A O no hydrogen 3.042 N/A LYS 279.A N ASP 275.A O no hydrogen 3.280 N/A LYS 279.A N LEU 276.A O no hydrogen 3.047 N/A LYS 279.A NZ ASP 275.A OD1 no hydrogen 3.415 N/A MET 280.A N LEU 276.A O no hydrogen 2.972 N/A MET 280.A N LEU 277.A O no hydrogen 3.191 N/A LEU 281.A N LEU 277.A O no hydrogen 2.858 N/A ASP 286.A N ASP 284.A OD2 no hydrogen 3.115 N/A LYS 287.A N ASP 284.A O no hydrogen 2.988 N/A LYS 287.A NZ GLU 237.A OE1 no hydrogen 3.261 N/A LYS 287.A NZ GLU 237.A OE2 no hydrogen 2.794 N/A ARG 288.A NE VAL 282.A O no hydrogen 2.847 N/A ARG 288.A NH1 GLU 184.A OE1 no hydrogen 3.387 N/A ARG 288.A NH1 GLU 184.A OE2 no hydrogen 2.959 N/A ARG 288.A NH1 VAL 282.A O no hydrogen 2.937 N/A ARG 288.A NH2 GLU 184.A OE1 no hydrogen 2.747 N/A ARG 288.A NH2 THR 195.A O no hydrogen 2.911 N/A ILE 289.A N LYS 279.A O no hydrogen 3.061 N/A THR 290.A N GLN 293.A OE1 no hydrogen 3.060 N/A GLN 293.A N THR 290.A OG1 no hydrogen 3.169 N/A ALA 294.A N THR 290.A O no hydrogen 2.771 N/A LEU 295.A N ALA 291.A O no hydrogen 3.036 N/A ALA 296.A N GLN 293.A O no hydrogen 3.195 N/A HIS 297.A N ALA 294.A O no hydrogen 3.026 N/A HIS 297.A NE2 ASP 275.A OD2 no hydrogen 2.645 N/A TYR 299.A N HIS 297.A ND1 no hydrogen 3.066 N/A TYR 299.A OH ASP 121.A OD1 no hydrogen 2.790 N/A PHE 300.A N HIS 297.A O no hydrogen 3.054 N/A ALA 301.A N ALA 298.A O no hydrogen 3.280 N/A GLN 302.A NE2 GLN 125.A OE1 no hydrogen 3.029 N/A TYR 303.A N PHE 300.A O no hydrogen 3.029 N/A TYR 303.A OH ASP 122.A OD1 no hydrogen 2.525 N/A HIS 304.A N PHE 300.A O no hydrogen 2.800 N/A ASP 305.A N GLU 309.A OE2 no hydrogen 3.171 N/A ASP 307.A N ASP 305.A OD2 no hydrogen 3.374 N/A ASP 308.A N ASP 305.A O no hydrogen 2.833 N/A ALA 312.A N SER 140.A OG no hydrogen 2.838 N/A GLN 317.A NE2 ASP 142.A O no hydrogen 3.015 N/A SER 318.A N ASP 316.A OD1 no hydrogen 2.989 N/A SER 318.A OG ASP 316.A OD1 no hydrogen 2.855 N/A GLU 320.A N GLN 317.A O no hydrogen 3.079 N/A SER 321.A N SER 318.A O no hydrogen 3.320 N/A SER 321.A OG SER 318.A O no hydrogen 3.170 N/A ARG 322.A N PHE 319.A O no hydrogen 3.010 N/A LEU 325.A N GLU 328.A OE1 no hydrogen 3.046 N/A TRP 329.A N LEU 325.A O no hydrogen 3.009 N/A LYS 330.A N ILE 326.A O no hydrogen 2.763 N/A LYS 330.A NZ PHE 96.A O no hydrogen 2.991 N/A SER 331.A N ASP 327.A O no hydrogen 3.010 N/A LEU 332.A N GLU 328.A O no hydrogen 3.156 N/A THR 333.A N TRP 329.A O no hydrogen 2.960 N/A THR 333.A OG1 TRP 329.A O no hydrogen 2.854 N/A TYR 334.A N LYS 330.A O no hydrogen 2.957 N/A ASP 335.A N SER 331.A O no hydrogen 3.026 N/A GLU 336.A N LEU 332.A O no hydrogen 3.256 N/A VAL 337.A N THR 333.A O no hydrogen 2.991 N/A ILE 338.A N TYR 334.A O no hydrogen 2.959 N/A SER 339.A N ASP 335.A O no hydrogen 3.080 N/A SER 339.A OG ASP 335.A O no hydrogen 2.933 N/A SER 339.A OG GLU 336.A O no hydrogen 3.304 N/A PHE 340.A N VAL 337.A O no hydrogen 3.284 N/A