Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gxk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 HIS 42.A O no hydrogen 2.788 N/A GLY 4.A N THR 1.A O no hydrogen 3.478 N/A THR 7.A N ASN 3.A O no hydrogen 2.972 N/A THR 7.A OG1 GLY 4.A O no hydrogen 3.388 N/A ASP 8.A N GLY 4.A O no hydrogen 2.884 N/A MET 9.A N GLY 5.A O no hydrogen 3.063 N/A LEU 10.A N ILE 6.A O no hydrogen 2.927 N/A THR 11.A N THR 7.A O no hydrogen 2.885 N/A THR 11.A OG1 THR 7.A O no hydrogen 3.046 N/A GLU 12.A N ASP 8.A O no hydrogen 3.025 N/A LEU 13.A N MET 9.A O no hydrogen 2.972 N/A ALA 14.A N LEU 10.A O no hydrogen 2.784 N/A ASN 15.A N THR 11.A O no hydrogen 2.891 N/A PHE 16.A N GLU 12.A O no hydrogen 3.021 N/A GLU 17.A N LEU 13.A O no hydrogen 3.021 N/A LYS 18.A N ALA 14.A O no hydrogen 2.997 N/A LYS 18.A NZ ASN 19.A OD1 no hydrogen 3.211 N/A ASN 19.A N ASN 15.A O no hydrogen 2.901 N/A ASN 19.A ND2 ASN 89.A OD1 no hydrogen 3.095 N/A VAL 20.A N PHE 16.A O no hydrogen 2.895 N/A SER 21.A N PHE 16.A O no hydrogen 3.230 N/A SER 21.A OG GLU 17.A OE1 no hydrogen 3.019 N/A ALA 23.A N GLU 17.A O no hydrogen 2.785 N/A TYR 27.A N ALA 23.A O no hydrogen 3.007 N/A ASN 28.A N ILE 24.A O no hydrogen 3.018 N/A ALA 29.A N HIS 25.A O no hydrogen 2.833 N/A TYR 30.A N LYS 26.A O no hydrogen 2.843 N/A ARG 31.A N TYR 27.A O no hydrogen 3.037 N/A ARG 31.A NH1 ASP 264.A OD1 no hydrogen 3.292 N/A ARG 31.A NH2 ASP 264.A OD1 no hydrogen 2.823 N/A LYS 32.A N ASN 28.A O no hydrogen 2.908 N/A ALA 33.A N ALA 29.A O no hydrogen 3.093 N/A ALA 34.A N TYR 30.A O no hydrogen 2.906 N/A SER 35.A N ARG 31.A O no hydrogen 2.914 N/A SER 35.A OG GLU 316.A O no hydrogen 3.257 N/A VAL 36.A N LYS 32.A O no hydrogen 2.978 N/A ILE 37.A N ALA 33.A O no hydrogen 2.972 N/A ALA 38.A N ALA 34.A O no hydrogen 2.868 N/A LYS 39.A N SER 35.A O no hydrogen 3.197 N/A TYR 40.A N ILE 37.A O no hydrogen 3.007 N/A TYR 40.A OH GLU 49.A OE2 no hydrogen 2.733 N/A LYS 43.A NZ ASN 3.A OD1 no hydrogen 3.005 N/A LYS 43.A NZ ILE 44.A O no hydrogen 2.975 N/A ILE 44.A N ASN 3.A OD1 no hydrogen 2.828 N/A LYS 45.A N GLU 49.A OE1 no hydrogen 2.809 N/A GLY 47.A N ASP 65.A OD1 no hydrogen 2.812 N/A GLU 49.A N SER 46.A OG no hydrogen 3.190 N/A ALA 50.A N SER 46.A O no hydrogen 3.368 N/A LYS 51.A N GLY 47.A O no hydrogen 2.723 N/A LYS 52.A N GLU 49.A O no hydrogen 3.330 N/A LEU 53.A N ALA 50.A O no hydrogen 2.904 N/A VAL 56.A N LEU 53.A O no hydrogen 3.219 N/A ALA 61.A N GLY 57.A O no hydrogen 2.962 N/A GLU 62.A N THR 58.A O no hydrogen 3.079 N/A LYS 63.A N LYS 59.A O no hydrogen 3.008 N/A ILE 64.A N ILE 60.A O no hydrogen 2.900 N/A ASP 65.A N ALA 61.A O no hydrogen 3.017 N/A GLU 66.A N GLU 62.A O no hydrogen 3.217 N/A PHE 67.A N LYS 63.A O no hydrogen 2.994 N/A LEU 68.A N ILE 64.A O no hydrogen 2.862 N/A ALA 69.A N ASP 65.A O no hydrogen 3.036 N/A THR 70.A N GLU 66.A O no hydrogen 2.794 N/A THR 70.A OG1 GLU 66.A O no hydrogen 2.690 N/A LYS 72.A N THR 70.A OG1 no hydrogen 3.310 N/A ARG 74.A N GLU 66.A OE2 no hydrogen 2.843 N/A ARG 74.A NH2 GLU 66.A OE1 no hydrogen 3.162 N/A GLU 77.A N LEU 73.A O no hydrogen 2.998 N/A LYS 78.A N ARG 74.A O no hydrogen 2.674 N/A ILE 79.A N LYS 75.A O no hydrogen 2.884 N/A ARG 80.A N LEU 76.A O no hydrogen 2.945 N/A ARG 80.A NE GLU 12.A OE1 no hydrogen 3.459 N/A ARG 80.A NE GLU 12.A OE2 no hydrogen 2.645 N/A ARG 80.A NH2 GLU 12.A OE1 no hydrogen 3.200 N/A GLN 81.A N GLU 77.A O no hydrogen 3.218 N/A ASP 82.A N LYS 78.A O no hydrogen 3.263 N/A ASP 82.A N ILE 79.A O no hydrogen 2.966 N/A SER 85.A N ASP 82.A OD2 no hydrogen 2.790 N/A SER 85.A OG ASP 82.A OD2 no hydrogen 3.061 N/A SER 86.A N ASP 82.A O no hydrogen 2.913 N/A SER 86.A OG ASP 82.A O no hydrogen 2.772 N/A SER 86.A OG ASP 83.A O no hydrogen 3.402 N/A SER 87.A N ASP 83.A O no hydrogen 2.998 N/A SER 87.A OG ASP 83.A O no hydrogen 2.635 N/A ILE 88.A N THR 84.A O no hydrogen 2.891 N/A ASN 89.A N SER 85.A O no hydrogen 2.854 N/A PHE 90.A N SER 86.A O no hydrogen 2.920 N/A LEU 91.A N SER 87.A O no hydrogen 2.936 N/A THR 92.A N ILE 88.A O no hydrogen 3.236 N/A THR 92.A OG1 ASN 89.A O no hydrogen 2.881 N/A ARG 93.A N PHE 90.A O no hydrogen 2.802 N/A ARG 93.A NE GLU 138.A OE2 no hydrogen 2.714 N/A ARG 93.A NH2 GLU 138.A OE1 no hydrogen 2.746 N/A ARG 93.A NH2 GLU 138.A OE2 no hydrogen 3.289 N/A VAL 94.A N LEU 91.A O no hydrogen 3.017 N/A SER 95.A OG HIS 126.A NE2 no hydrogen 2.635 N/A ILE 97.A N VAL 94.A O no hydrogen 3.024 N/A ALA 102.A N GLY 98.A O no hydrogen 2.970 N/A ARG 103.A N PRO 99.A O no hydrogen 3.192 N/A ARG 103.A NH1 VAL 20.A O no hydrogen 3.104 N/A ARG 103.A NH1 GLN 22.A OE1 no hydrogen 3.306 N/A ARG 103.A NH2 VAL 20.A O no hydrogen 3.120 N/A LYS 104.A N SER 100.A O no hydrogen 3.074 N/A LYS 104.A NZ GLU 108.A OE1 no hydrogen 3.056 N/A PHE 105.A N ALA 101.A O no hydrogen 2.823 N/A VAL 106.A N ALA 102.A O no hydrogen 2.851 N/A ASP 107.A N ARG 103.A O no hydrogen 2.910 N/A GLU 108.A N LYS 104.A O no hydrogen 3.183 N/A GLU 108.A N PHE 105.A O no hydrogen 3.102 N/A GLY 109.A N VAL 106.A O no hydrogen 2.952 N/A ILE 110.A N PHE 105.A O no hydrogen 2.907 N/A LYS 111.A N ASP 115.A OD2 no hydrogen 2.969 N/A LYS 111.A NZ ASP 83.A OD2 no hydrogen 2.656 N/A THR 112.A OG1 GLU 114.A OE1 no hydrogen 2.965 N/A ASP 115.A N THR 112.A OG1 no hydrogen 3.204 N/A LEU 116.A N THR 112.A O no hydrogen 3.047 N/A ARG 117.A N LEU 113.A O no hydrogen 2.976 N/A LYS 118.A N GLU 114.A O no hydrogen 2.830 N/A ASN 119.A N LEU 116.A O no hydrogen 3.044 N/A ASN 119.A ND2 ASP 115.A O no hydrogen 2.757 N/A LYS 122.A N ASN 119.A O no hydrogen 2.727 N/A LEU 123.A N GLU 120.A O no hydrogen 2.832 N/A ASN 124.A N GLN 127.A OE1 no hydrogen 2.935 N/A HIS 125.A NE2 THR 216.A O no hydrogen 3.006 N/A HIS 126.A NE2 SER 95.A OG no hydrogen 2.635 N/A GLN 127.A N ASN 124.A OD1 no hydrogen 2.740 N/A GLN 127.A NE2 GLY 96.A O no hydrogen 3.004 N/A ARG 128.A N ASN 124.A O no hydrogen 2.860 N/A ARG 128.A NH2 GLU 120.A O no hydrogen 3.402 N/A ILE 129.A N HIS 125.A O no hydrogen 3.189 N/A GLY 130.A N HIS 126.A O no hydrogen 2.876 N/A LEU 131.A N GLN 127.A O no hydrogen 2.898 N/A LYS 132.A N ARG 128.A O no hydrogen 2.974 N/A LYS 132.A NZ TYR 133.A OH no hydrogen 3.385 N/A TYR 133.A N ILE 129.A O no hydrogen 3.006 N/A TYR 133.A OH ASP 215.A OD2 no hydrogen 2.953 N/A PHE 134.A N LEU 131.A O no hydrogen 3.272 N/A PHE 137.A N TYR 133.A O no hydrogen 2.851 N/A GLU 138.A N GLY 135.A O no hydrogen 2.926 N/A LYS 139.A N GLY 135.A O no hydrogen 3.251 N/A LYS 139.A N ASP 136.A O no hydrogen 2.972 N/A ARG 140.A NE SER 178.A OG no hydrogen 2.778 N/A ARG 140.A NH2 SER 178.A O no hydrogen 2.835 N/A ILE 141.A N SER 179.A O no hydrogen 2.758 N/A ARG 143.A N GLU 177.A O no hydrogen 2.729 N/A ARG 143.A NH1 PHE 172.A O no hydrogen 3.034 N/A ARG 143.A NH1 ALA 176.A O no hydrogen 2.772 N/A ARG 143.A NH2 PHE 172.A O no hydrogen 3.134 N/A GLU 145.A N PRO 142.A O no hydrogen 2.776 N/A MET 146.A N PRO 142.A O no hydrogen 3.009 N/A LEU 147.A N ARG 143.A O no hydrogen 2.863 N/A GLN 148.A N GLU 144.A O no hydrogen 3.257 N/A MET 149.A N GLU 145.A O no hydrogen 2.919 N/A GLN 150.A N MET 146.A O no hydrogen 2.799 N/A ASP 151.A N LEU 147.A O no hydrogen 3.016 N/A ILE 152.A N GLN 148.A O no hydrogen 3.298 N/A VAL 153.A N MET 149.A O no hydrogen 2.882 N/A LEU 154.A N GLN 150.A O no hydrogen 2.885 N/A ASN 155.A N ASP 151.A O no hydrogen 2.921 N/A GLU 156.A N ILE 152.A O no hydrogen 3.013 N/A VAL 157.A N VAL 153.A O no hydrogen 2.966 N/A LYS 158.A N LEU 154.A O no hydrogen 3.028 N/A LYS 159.A N ASN 155.A O no hydrogen 3.073 N/A LYS 159.A NZ GLU 156.A OE1 no hydrogen 2.974 N/A LYS 159.A NZ GLU 156.A OE2 no hydrogen 2.788 N/A VAL 160.A N VAL 157.A O no hydrogen 2.962 N/A ASP 161.A N VAL 157.A O no hydrogen 3.190 N/A GLU 163.A N ASP 161.A OD1 no hydrogen 2.937 N/A TYR 164.A N ASP 161.A O no hydrogen 3.247 N/A TYR 164.A OH LEU 199.A O no hydrogen 2.532 N/A ILE 165.A N THR 187.A O no hydrogen 3.075 N/A THR 167.A N LEU 185.A O no hydrogen 2.845 N/A THR 167.A OG1 TYR 253.A OH no hydrogen 3.298 N/A CYS 169.A N ASP 183.A O no hydrogen 2.977 N/A CYS 169.A SG THR 167.A O no hydrogen 3.606 N/A GLY 170.A N PHE 260.A O no hydrogen 2.755 N/A SER 171.A OG SER 179.A OG no hydrogen 2.583 N/A ARG 173.A N GLY 170.A O no hydrogen 3.101 N/A ARG 173.A NH1 THR 261.A OG1 no hydrogen 2.815 N/A ARG 173.A NH1 GLU 297.A OE1 no hydrogen 3.315 N/A ARG 173.A NH1 GLU 297.A OE2 no hydrogen 3.061 N/A ARG 173.A NH2 GLU 297.A OE1 no hydrogen 2.809 N/A ARG 174.A N GLY 170.A O no hydrogen 3.344 N/A ARG 174.A NE SER 315.A OG no hydrogen 2.917 N/A ARG 174.A NH1 THR 261.A O no hydrogen 2.735 N/A GLY 175.A N PHE 172.A O no hydrogen 2.981 N/A ALA 176.A N SER 171.A O no hydrogen 3.139 N/A SER 179.A N ILE 141.A O no hydrogen 2.848 N/A SER 179.A OG SER 171.A OG no hydrogen 2.583 N/A MET 182.A N ARG 242.A O no hydrogen 3.088 N/A VAL 184.A N ASP 244.A O no hydrogen 2.688 N/A LEU 185.A N THR 167.A O no hydrogen 2.806 N/A LEU 186.A N ARG 246.A O no hydrogen 2.587 N/A THR 187.A N ILE 165.A O no hydrogen 3.065 N/A THR 187.A OG1 ILE 248.A O no hydrogen 3.489 N/A HIS 188.A ND1 SER 190.A OG no hydrogen 2.896 N/A HIS 188.A NE2 ASP 161.A OD1 no hydrogen 2.975 N/A SER 190.A N HIS 188.A ND1 no hydrogen 3.160 N/A SER 190.A OG HIS 188.A ND1 no hydrogen 2.896 N/A PHE 191.A N HIS 188.A O no hydrogen 2.829 N/A THR 192.A N SER 195.A OG no hydrogen 2.992 N/A SER 193.A N ASP 251.A OD1 no hydrogen 3.039 N/A SER 193.A OG ASP 251.A OD1 no hydrogen 2.989 N/A SER 193.A OG ASP 251.A OD2 no hydrogen 2.591 N/A SER 195.A OG SER 190.A O no hydrogen 3.196 N/A SER 195.A OG THR 192.A O no hydrogen 3.272 N/A LEU 199.A N GLN 196.A O no hydrogen 3.120 N/A GLN 202.A N LYS 198.A O no hydrogen 2.830 N/A GLN 202.A NE2 LYS 198.A O no hydrogen 3.116 N/A VAL 203.A N LEU 200.A O no hydrogen 2.841 N/A VAL 204.A N LEU 200.A O no hydrogen 2.989 N/A GLU 205.A N HIS 201.A O no hydrogen 2.780 N/A GLN 206.A N GLN 202.A O no hydrogen 3.211 N/A GLN 206.A NE2 GLU 156.A OE1 no hydrogen 2.864 N/A LEU 207.A N VAL 203.A O no hydrogen 3.067 N/A GLN 208.A N VAL 204.A O no hydrogen 2.908 N/A LYS 209.A N GLU 205.A O no hydrogen 2.944 N/A VAL 210.A N GLN 206.A O no hydrogen 3.179 N/A HIS 211.A N GLN 208.A O no hydrogen 2.820 N/A PHE 212.A N LEU 207.A O no hydrogen 2.922 N/A ILE 213.A N LEU 207.A O no hydrogen 3.050 N/A THR 214.A N VAL 227.A O no hydrogen 2.862 N/A THR 214.A OG1 ASP 215.A OD2 no hydrogen 2.948 N/A ASP 215.A N VAL 227.A O no hydrogen 3.461 N/A LEU 217.A N MET 225.A O no hydrogen 2.817 N/A SER 218.A N MET 225.A O no hydrogen 3.053 N/A LYS 219.A NZ HIS 201.A ND1 no hydrogen 3.079 N/A GLY 220.A N LYS 223.A O no hydrogen 2.986 N/A PHE 224.A N ILE 245.A O no hydrogen 2.917 N/A MET 225.A N SER 218.A O no hydrogen 2.915 N/A GLY 226.A N ILE 243.A O no hydrogen 3.013 N/A VAL 227.A N ASP 215.A O no hydrogen 2.947 N/A CYS 228.A N ARG 241.A O no hydrogen 2.877 N/A CYS 228.A SG ARG 241.A O no hydrogen 3.957 N/A GLN 229.A N PHE 212.A O no hydrogen 2.853 N/A GLN 229.A NE2 GLU 237.A OE2 no hydrogen 3.343 N/A GLN 229.A NE2 TYR 238.A O no hydrogen 2.919 N/A SER 232.A OG LYS 236.A O no hydrogen 3.034 N/A GLU 235.A N LYS 233.A O no hydrogen 2.659 N/A HIS 240.A N ASP 136.A OD2 no hydrogen 2.912 N/A ARG 241.A N CYS 228.A O no hydrogen 2.802 N/A ARG 241.A NH1 ARG 140.A O no hydrogen 3.337 N/A ARG 241.A NH2 ARG 140.A O no hydrogen 3.399 N/A ARG 241.A NH2 GLU 145.A OE1 no hydrogen 2.752 N/A ARG 242.A NH1 GLY 226.A O no hydrogen 3.019 N/A ARG 242.A NH1 ILE 243.A O no hydrogen 3.171 N/A ARG 242.A NH1 ASP 244.A OD1 no hydrogen 3.039 N/A ARG 242.A NH2 ASP 244.A OD1 no hydrogen 2.771 N/A ILE 243.A N GLY 226.A O no hydrogen 3.087 N/A ASP 244.A N MET 182.A O no hydrogen 2.838 N/A ILE 245.A N PHE 224.A O no hydrogen 2.885 N/A ARG 246.A N VAL 184.A O no hydrogen 2.705 N/A LEU 247.A N THR 222.A O no hydrogen 2.814 N/A ILE 248.A N LEU 186.A O no hydrogen 2.969 N/A LYS 250.A N PHE 191.A O no hydrogen 2.925 N/A GLN 252.A N PRO 249.A O no hydrogen 2.833 N/A TYR 253.A N LYS 250.A O no hydrogen 3.298 N/A TYR 253.A OH THR 167.A OG1 no hydrogen 3.298 N/A GLY 256.A N GLN 252.A O no hydrogen 3.098 N/A VAL 257.A N TYR 253.A O no hydrogen 2.807 N/A LEU 258.A N TYR 254.A O no hydrogen 2.976 N/A TYR 259.A N CYS 255.A O no hydrogen 2.997 N/A PHE 260.A N GLY 256.A O no hydrogen 2.839 N/A THR 261.A N VAL 257.A O no hydrogen 2.915 N/A THR 261.A N LEU 258.A O no hydrogen 3.301 N/A THR 261.A OG1 VAL 257.A O no hydrogen 2.646 N/A GLY 262.A N LEU 258.A O no hydrogen 3.228 N/A SER 263.A N ARG 314.A O no hydrogen 3.204 N/A SER 263.A OG ARG 314.A O no hydrogen 3.519 N/A ILE 265.A N ASP 264.A OD2 no hydrogen 2.802 N/A PHE 266.A N SER 263.A OG no hydrogen 3.067 N/A ASN 267.A N SER 263.A O no hydrogen 2.783 N/A ASN 267.A ND2 TYR 259.A O no hydrogen 2.691 N/A LYS 268.A N ASP 264.A O no hydrogen 3.170 N/A ASN 269.A N ILE 265.A O no hydrogen 3.064 N/A ASN 269.A ND2 GLU 316.A OE2 no hydrogen 2.785 N/A MET 270.A N PHE 266.A O no hydrogen 2.872 N/A LYS 271.A N ASN 267.A O no hydrogen 3.388 N/A LYS 271.A NZ ILE 281.A O no hydrogen 2.986 N/A ALA 272.A N ASN 269.A O no hydrogen 2.871 N/A HIS 273.A N ASN 269.A O no hydrogen 3.016 N/A LEU 275.A N LYS 271.A O no hydrogen 3.184 N/A GLU 276.A N ALA 272.A O no hydrogen 3.008 N/A LYS 277.A N ALA 274.A O no hydrogen 3.190 N/A GLY 278.A N LEU 275.A O no hydrogen 3.455 N/A THR 280.A N ARG 287.A O no hydrogen 2.833 N/A ASN 282.A N THR 285.A O no hydrogen 3.043 N/A TYR 284.A N.A ASN 282.A OD1 no hydrogen 2.861 N/A TYR 284.A N.B ASN 282.A OD1 no hydrogen 2.855 N/A THR 285.A N ASN 282.A OD1 no hydrogen 2.822 N/A THR 285.A OG1 ASN 282.A OD1 no hydrogen 3.433 N/A ARG 287.A N THR 280.A O no hydrogen 2.957 N/A ARG 287.A NE THR 285.A OG1 no hydrogen 3.060 N/A ARG 287.A NH1 GLY 289.A O no hydrogen 3.325 N/A ARG 287.A NH1 GLU 290.A OE1 no hydrogen 3.358 N/A LEU 292.A N ILE 286.A O no hydrogen 2.897 N/A ASP 295.A N ASP 299.A OD2 no hydrogen 2.901 N/A ASP 299.A N SER 296.A O no hydrogen 3.155 N/A ASP 299.A N SER 296.A OG no hydrogen 3.210 N/A ILE 300.A N GLU 297.A O no hydrogen 2.971 N/A PHE 301.A N GLU 297.A O no hydrogen 3.424 N/A ASP 302.A N LYS 298.A O no hydrogen 2.890 N/A TYR 303.A N ASP 299.A O no hydrogen 2.868 N/A TYR 303.A OH PRO 293.A O no hydrogen 2.663 N/A ILE 304.A N ILE 300.A O no hydrogen 3.241 N/A GLN 305.A N ASP 302.A O no hydrogen 2.702 N/A TRP 306.A N PHE 301.A O no hydrogen 3.222 N/A ARG 309.A NH1 ASP 313.A O no hydrogen 3.031 N/A ARG 309.A NH1 GLU 316.A OE1 no hydrogen 2.301 N/A ASP 313.A N GLU 310.A O no hydrogen 2.847 N/A ARG 314.A NE ARG 309.A O no hydrogen 2.781 N/A ARG 314.A NH1 GLU 297.A OE2 no hydrogen 3.081 N/A ARG 314.A NH2 GLU 297.A OE1 no hydrogen 3.514 N/A ARG 314.A NH2 ARG 309.A O no hydrogen 2.914 N/A GLU 316.A N ARG 314.A O no hydrogen 2.882 N/A