Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dmk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLN 69.A OE1 no hydrogen 2.767 N/A PHE 10.A N PRO 7.A O no hydrogen 3.000 N/A GLU 11.A N LYS 26.A O no hydrogen 2.836 N/A SER 12.A OG GLU 2.A OE1 no hydrogen 2.998 N/A SER 12.A OG GLU 2.A OE2 no hydrogen 2.495 N/A SER 12.A OG HIS 23.A NE2 no hydrogen 2.680 N/A ALA 13.A N TYR 24.A O no hydrogen 2.973 N/A ARG 15.A N LEU 22.A O no hydrogen 2.904 N/A VAL 17.A N VAL 20.A O no hydrogen 2.853 N/A VAL 20.A N VAL 17.A O no hydrogen 2.920 N/A LYS 21.A N GLU 71.A OE1 no hydrogen 2.868 N/A LYS 21.A NZ.A GLU 16.A OE2 no hydrogen 2.911 N/A LEU 22.A N ARG 15.A O no hydrogen 2.873 N/A HIS 23.A N SER 70.A OG no hydrogen 2.807 N/A HIS 23.A ND1 ASP 63.A OD2 no hydrogen 2.747 N/A HIS 23.A NE2 SER 12.A OG no hydrogen 2.680 N/A TYR 24.A N ALA 13.A O no hydrogen 2.952 N/A VAL 25.A N ALA 61.A O no hydrogen 3.010 N/A LYS 26.A N GLU 11.A O no hydrogen 2.920 N/A GLY 27.A N VAL 59.A O no hydrogen 3.015 N/A VAL 33.A N THR 58.A O no hydrogen 2.806 N/A MET 34.A N ASP 100.A O no hydrogen 2.856 N/A LEU 35.A N ILE 60.A O no hydrogen 2.867 N/A VAL 36.A N VAL 102.A O no hydrogen 2.790 N/A HIS 37.A ND1 GLY 38.A O no hydrogen 2.899 N/A GLY 38.A N GLU 45.A OE1 no hydrogen 3.160 N/A PHE 39.A N ASP 105.A OD2 no hydrogen 2.817 N/A GLN 41.A N GLY 38.A O no hydrogen 3.310 N/A GLN 41.A NE2 GLU 277.A OE1 no hydrogen 2.707 N/A TRP 43.A N ASP 63.A OD1 no hydrogen 2.940 N/A TYR 44.A N THR 42.A OG1 no hydrogen 3.162 N/A GLU 45.A N THR 42.A O no hydrogen 3.172 N/A TRP 46.A N TRP 43.A O no hydrogen 3.013 N/A HIS 47.A N TYR 44.A O no hydrogen 2.981 N/A HIS 47.A ND1 TYR 44.A O no hydrogen 2.762 N/A MET 50.A N TRP 46.A O no hydrogen 2.905 N/A GLU 52.A N LEU 49.A O no hydrogen 3.146 N/A LEU 53.A N LEU 49.A O no hydrogen 3.120 N/A ALA 54.A N MET 50.A O no hydrogen 2.897 N/A LYS 55.A N GLU 52.A O no hydrogen 3.384 N/A ARG 56.A N LEU 53.A O no hydrogen 3.029 N/A ARG 56.A NH1 SER 292.A OG no hydrogen 2.658 N/A PHE 57.A N LEU 53.A O no hydrogen 2.832 N/A THR 58.A N PRO 31.A O no hydrogen 2.912 N/A THR 58.A OG1 GLY 30.A O no hydrogen 2.736 N/A VAL 59.A N GLY 27.A O no hydrogen 2.753 N/A ILE 60.A N VAL 33.A O no hydrogen 2.986 N/A ALA 61.A N VAL 25.A O no hydrogen 2.883 N/A ASP 63.A N HIS 23.A O no hydrogen 2.881 N/A LEU 64.A N HIS 37.A NE2 no hydrogen 2.915 N/A GLY 66.A N SER 70.A O no hydrogen 3.098 N/A GLY 66.A N GLU 71.A O no hydrogen 2.937 N/A LEU 67.A N LEU 64.A O no hydrogen 2.840 N/A GLN 69.A N ASP 63.A OD2 no hydrogen 2.862 N/A GLN 69.A NE2 GLU 2.A OE1 no hydrogen 3.265 N/A GLN 69.A NE2 TYR 14.A OH no hydrogen 2.845 N/A SER 70.A N LEU 67.A O no hydrogen 3.010 N/A SER 70.A OG ASP 63.A O no hydrogen 2.674 N/A GLU 71.A N LYS 21.A O no hydrogen 2.913 N/A LYS 74.A N TYR 85.A OH no hydrogen 2.901 N/A LYS 74.A NZ GLY 19.A O no hydrogen 2.714 N/A THR 75.A N TYR 85.A OH no hydrogen 3.241 N/A THR 75.A OG1 TYR 85.A OH no hydrogen 3.377 N/A GLY 76.A N THR 75.A OG1 no hydrogen 2.829 N/A GLY 79.A N SER 221.A OG no hydrogen 2.908 N/A GLU 80.A N GLN 224.A OE1 no hydrogen 3.110 N/A GLN 81.A NE2 SER 78.A OG no hydrogen 2.730 N/A VAL 82.A N SER 78.A O no hydrogen 2.953 N/A ALA 83.A N GLY 79.A O no hydrogen 2.896 N/A TYR 85.A OH THR 75.A OG1 no hydrogen 3.377 N/A LEU 86.A N VAL 82.A O no hydrogen 3.335 N/A HIS 87.A N ALA 83.A O no hydrogen 2.823 N/A HIS 87.A NE2 ASP 121.A OD2 no hydrogen 2.650 N/A LYS 88.A N VAL 84.A O no hydrogen 2.995 N/A LYS 88.A NZ ASP 18.A OD1 no hydrogen 3.034 N/A LYS 88.A NZ ASP 18.A OD2 no hydrogen 2.832 N/A LEU 89.A N TYR 85.A O no hydrogen 2.967 N/A ALA 90.A N LEU 86.A O no hydrogen 3.036 N/A ARG 91.A N HIS 87.A O no hydrogen 2.958 N/A GLN 92.A N LYS 88.A O no hydrogen 3.095 N/A GLN 92.A N LEU 89.A O no hydrogen 3.154 N/A GLN 92.A NE2 LYS 88.A O no hydrogen 3.033 N/A PHE 93.A N ALA 90.A O no hydrogen 3.019 N/A SER 94.A N ALA 90.A O no hydrogen 2.925 N/A SER 94.A OG ARG 97.A O no hydrogen 2.696 N/A PHE 99.A N ASP 121.A O no hydrogen 2.862 N/A ASP 100.A N LEU 32.A O no hydrogen 2.805 N/A LEU 101.A N ARG 124.A O no hydrogen 3.080 N/A VAL 102.A N MET 34.A O no hydrogen 2.912 N/A ALA 103.A N VAL 126.A O no hydrogen 2.920 N/A HIS 104.A N VAL 36.A O no hydrogen 3.017 N/A HIS 104.A ND1 GLU 45.A OE2 no hydrogen 2.611 N/A HIS 104.A NE2 HIS 273.A O no hydrogen 2.844 N/A ASP 105.A N MET 128.A O no hydrogen 3.054 N/A GLY 107.A N HIS 104.A O no hydrogen 2.903 N/A ILE 108.A N ASP 105.A O no hydrogen 2.836 N/A TRP 109.A NE1 PRO 131.A O no hydrogen 2.827 N/A ASN 110.A N ILE 106.A O no hydrogen 3.007 N/A THR 111.A N ILE 108.A O no hydrogen 3.150 N/A THR 111.A OG1 GLY 107.A O no hydrogen 2.820 N/A THR 111.A OG1 ILE 108.A O no hydrogen 3.408 N/A THR 111.A OG1 TYR 127.A OH no hydrogen 2.874 N/A TYR 112.A N ILE 108.A O no hydrogen 2.937 N/A VAL 115.A N THR 111.A O no hydrogen 3.086 N/A VAL 116.A N TYR 112.A O no hydrogen 3.003 N/A LYS 117.A N PRO 113.A O no hydrogen 3.028 N/A LYS 117.A NZ GLU 80.A OE2 no hydrogen 2.743 N/A ASN 118.A ND2 MET 114.A O no hydrogen 2.866 N/A GLN 119.A NE2 ARG 232.A O no hydrogen 3.029 N/A ASP 121.A N ASN 118.A O no hydrogen 2.869 N/A ILE 122.A N GLN 119.A O no hydrogen 3.106 N/A ALA 123.A N PHE 99.A O no hydrogen 2.863 N/A ARG 124.A NE PHE 290.A O no hydrogen 2.935 N/A LEU 125.A N PRO 236.A O no hydrogen 3.002 N/A VAL 126.A N LEU 101.A O no hydrogen 2.804 N/A TYR 127.A N MET 238.A O no hydrogen 2.971 N/A TYR 127.A OH THR 111.A OG1 no hydrogen 2.874 N/A MET 128.A N ALA 103.A O no hydrogen 2.942 N/A GLU 129.A N LEU 240.A O no hydrogen 3.188 N/A ALA 130.A N GLN 252.A OE1 no hydrogen 2.940 N/A ILE 132.A N GLN 255.A OE1 no hydrogen 2.938 N/A ARG 136.A N ASP 134.A OD1 no hydrogen 2.800 N/A ARG 136.A NH1 ASP 134.A OD2 no hydrogen 2.854 N/A ILE 137.A N ASP 134.A O no hydrogen 2.991 N/A TYR 138.A N ALA 135.A O no hydrogen 3.125 N/A ARG 139.A N ARG 136.A O no hydrogen 3.075 N/A THR 144.A N GLY 147.A O no hydrogen 3.026 N/A THR 144.A OG1 GLN 146.A OE1 no hydrogen 3.464 N/A THR 144.A OG1 GLY 147.A O no hydrogen 2.908 N/A GLN 146.A N THR 144.A OG1 no hydrogen 3.319 N/A GLY 147.A N THR 144.A O no hydrogen 2.989 N/A GLY 147.A N THR 144.A OG1 no hydrogen 3.263 N/A SER 149.A OG PRO 141.A O no hydrogen 2.841 N/A SER 149.A OG ALA 142.A O no hydrogen 3.315 N/A TRP 152.A NE1 GLU 148.A OE1 no hydrogen 2.695 N/A PHE 154.A N VAL 151.A O no hydrogen 2.914 N/A SER 155.A N TRP 152.A O no hydrogen 3.093 N/A PHE 156.A N TRP 152.A O no hydrogen 3.498 N/A PHE 157.A N HIS 153.A O no hydrogen 2.802 N/A ALA 158.A N PHE 154.A O no hydrogen 3.003 N/A ALA 159.A N PHE 156.A O no hydrogen 3.431 N/A ARG 162.A NH1 GLU 165.A OE1.B no hydrogen 2.963 N/A LEU 163.A N ASP 160.A O no hydrogen 3.305 N/A GLU 165.A N GLU 165.A OE1.A no hydrogen 2.804 N/A THR 166.A N ARG 162.A O no hydrogen 2.939 N/A THR 166.A OG1 ARG 162.A O no hydrogen 2.648 N/A LEU 167.A N LEU 163.A O no hydrogen 3.061 N/A ILE 168.A N ALA 164.A O no hydrogen 2.867 N/A ALA 169.A N GLU 165.A O no hydrogen 2.879 N/A GLY 170.A N GLU 172.A OE2 no hydrogen 2.860 N/A LYS 171.A N ILE 168.A O no hydrogen 2.753 N/A LYS 171.A NZ.B LEU 167.A O no hydrogen 3.138 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.816 N/A ARG 173.A NE ASP 196.A OD1 no hydrogen 2.727 N/A ARG 173.A NH1 ARG 173.A O no hydrogen 3.312 N/A ARG 173.A NH1 GLU 177.A OE1 no hydrogen 2.775 N/A ARG 173.A NH2 GLU 192.A O no hydrogen 3.283 N/A ARG 173.A NH2 GLU 192.A OE2 no hydrogen 2.734 N/A ARG 173.A NH2 ASP 196.A OD1 no hydrogen 3.246 N/A PHE 175.A N LYS 171.A O no hydrogen 2.900 N/A LEU 176.A N GLU 172.A O no hydrogen 2.881 N/A GLU 177.A N ARG 173.A O no hydrogen 3.213 N/A HIS 178.A N PHE 174.A O no hydrogen 3.179 N/A HIS 178.A NE2 GLU 148.A OE2 no hydrogen 2.881 N/A PHE 179.A N PHE 175.A O no hydrogen 2.824 N/A ILE 180.A N LEU 176.A O no hydrogen 2.839 N/A LYS 181.A N GLU 177.A O no hydrogen 2.986 N/A LYS 181.A NZ GLU 177.A OE2 no hydrogen 2.905 N/A SER 182.A N HIS 178.A O no hydrogen 2.873 N/A SER 182.A OG HIS 178.A O no hydrogen 3.070 N/A SER 182.A OG PHE 179.A O no hydrogen 3.000 N/A SER 182.A OG HIS 183.A ND1 no hydrogen 3.192 N/A HIS 183.A N ILE 180.A O no hydrogen 3.036 N/A HIS 183.A ND1 PHE 179.A O no hydrogen 2.909 N/A HIS 183.A NE2 LEU 150.A O no hydrogen 2.934 N/A ALA 184.A N LYS 181.A O no hydrogen 3.052 N/A SER 185.A N GLU 278.A OE1 no hydrogen 2.776 N/A ASN 186.A N GLU 278.A OE1 no hydrogen 2.850 N/A ASN 186.A ND2.A GLU 278.A O no hydrogen 3.099 N/A ASN 186.A ND2.B GLU 278.A O no hydrogen 3.080 N/A GLU 188.A N GLU 188.A OE2.A no hydrogen 2.880 N/A PHE 190.A N THR 187.A O no hydrogen 2.959 N/A LEU 194.A N SER 191.A OG no hydrogen 2.970 N/A LEU 195.A N SER 191.A O no hydrogen 2.953 N/A ASP 196.A N GLU 192.A O no hydrogen 2.874 N/A LEU 197.A N ARG 193.A O no hydrogen 3.217 N/A TYR 198.A N LEU 194.A O no hydrogen 3.118 N/A TYR 198.A OH GLU 277.A OE2 no hydrogen 2.723 N/A ALA 199.A N LEU 195.A O no hydrogen 2.868 N/A ARG 200.A N ASP 196.A O no hydrogen 3.021 N/A ARG 200.A NH2 GLU 3.A O no hydrogen 3.116 N/A SER 201.A N LEU 197.A O no hydrogen 3.418 N/A SER 201.A OG GLU 3.A OE1 no hydrogen 2.651 N/A TYR 202.A N TYR 198.A O no hydrogen 3.170 N/A TYR 202.A OH GLU 172.A O no hydrogen 2.756 N/A ALA 203.A N ALA 199.A O no hydrogen 2.929 N/A LYS 204.A N SER 201.A O no hydrogen 3.351 N/A LYS 204.A NZ GLU 3.A OE2 no hydrogen 2.684 N/A LYS 204.A NZ GLY 68.A O no hydrogen 2.792 N/A LYS 204.A NZ SER 201.A O no hydrogen 2.825 N/A LYS 204.A NZ SER 207.A OG no hydrogen 3.289 N/A SER 207.A N LYS 204.A O no hydrogen 2.775 N/A SER 207.A OG GLY 66.A O no hydrogen 2.851 N/A LEU 208.A N LYS 204.A O no hydrogen 2.875 N/A ASN 209.A N PRO 205.A O no hydrogen 3.096 N/A ASN 209.A ND2 GLU 165.A OE1.B no hydrogen 3.284 N/A ASN 209.A ND2 GLU 165.A OE2.A no hydrogen 2.834 N/A ASN 209.A ND2 GLU 213.A OE2 no hydrogen 3.363 N/A ALA 210.A N HIS 206.A O no hydrogen 2.913 N/A SER 211.A N SER 207.A O no hydrogen 2.885 N/A SER 211.A OG SER 207.A O no hydrogen 2.879 N/A GLU 213.A N ASN 209.A O no hydrogen 3.023 N/A TYR 214.A N ALA 210.A O no hydrogen 3.376 N/A TYR 214.A OH PRO 65.A O no hydrogen 2.662 N/A ARG 216.A N PHE 212.A O no hydrogen 2.934 N/A ARG 216.A NE.A PHE 157.A O no hydrogen 2.942 N/A ARG 216.A NH1.A GLU 165.A OE1.A no hydrogen 3.402 N/A ARG 216.A NH1.A GLU 165.A OE2.A no hydrogen 2.564 N/A ARG 216.A NH1.A GLU 213.A OE2 no hydrogen 3.009 N/A ARG 216.A NH1.B ASP 160.A OD2 no hydrogen 3.465 N/A ARG 216.A NH2.A PHE 157.A O no hydrogen 3.409 N/A ARG 216.A NH2.A GLU 165.A OE1.A no hydrogen 2.551 N/A ARG 216.A NH2.A GLU 165.A OE2.A no hydrogen 3.284 N/A ARG 216.A NH2.B ASP 160.A OD2 no hydrogen 2.913 N/A ALA 217.A N GLU 213.A O no hydrogen 2.999 N/A LEU 218.A N PHE 215.A O no hydrogen 3.113 N/A SER 221.A N ALA 217.A O no hydrogen 2.912 N/A SER 221.A OG ALA 217.A O no hydrogen 3.244 N/A VAL 222.A N LEU 218.A O no hydrogen 2.904 N/A ARG 223.A N ASN 219.A O no hydrogen 3.059 N/A GLN 224.A N GLU 220.A O no hydrogen 2.872 N/A GLN 224.A NE2 SER 78.A OG no hydrogen 2.882 N/A ASN 225.A N SER 221.A O no hydrogen 2.866 N/A ASN 225.A ND2 PRO 133.A O no hydrogen 2.941 N/A ALA 226.A N VAL 222.A O no hydrogen 3.082 N/A GLU 227.A N GLN 224.A O no hydrogen 3.264 N/A LEU 228.A N GLN 224.A O no hydrogen 3.245 N/A ALA 229.A N ASN 225.A O no hydrogen 2.851 N/A LYS 230.A N GLU 227.A O no hydrogen 3.271 N/A LYS 230.A NZ GLU 227.A OE1 no hydrogen 3.051 N/A THR 231.A N LEU 228.A O no hydrogen 3.214 N/A ARG 232.A NH2 LYS 257.A O no hydrogen 3.419 N/A LEU 233.A N TYR 259.A O no hydrogen 2.737 N/A GLN 234.A N GLN 119.A OE1 no hydrogen 2.855 N/A GLN 234.A NE2 ARG 232.A O no hydrogen 3.522 N/A GLN 234.A NE2 GLU 261.A OE2 no hydrogen 3.456 N/A THR 237.A N ASP 262.A O no hydrogen 2.920 N/A THR 237.A OG1.A MET 235.A O no hydrogen 3.174 N/A THR 237.A OG1.B ASP 262.A O no hydrogen 2.909 N/A MET 238.A N LEU 125.A O no hydrogen 2.915 N/A THR 239.A N GLU 264.A O no hydrogen 2.882 N/A LEU 240.A N TYR 127.A O no hydrogen 3.001 N/A ALA 241.A N HIS 266.A O no hydrogen 3.006 N/A GLY 242.A N GLU 129.A OE2 no hydrogen 2.792 N/A GLY 243.A N LEU 268.A O no hydrogen 2.841 N/A GLY 244.A N CYS 271.A O no hydrogen 2.761 N/A GLY 247.A N GLY 244.A O no hydrogen 3.053 N/A MET 248.A N GLU 129.A OE2 no hydrogen 2.756 N/A GLY 249.A N GLY 242.A O no hydrogen 2.973 N/A PHE 251.A N MET 248.A O no hydrogen 3.237 N/A GLN 252.A NE2 ALA 130.A O no hydrogen 2.882 N/A GLU 254.A N THR 250.A O no hydrogen 3.177 N/A GLN 255.A N PHE 251.A O no hydrogen 2.924 N/A GLN 255.A NE2 ILE 132.A O no hydrogen 2.850 N/A GLN 255.A NE2 ASP 134.A OD1 no hydrogen 3.296 N/A GLN 255.A NE2 ASP 134.A OD2 no hydrogen 2.893 N/A MET 256.A N GLN 252.A O no hydrogen 3.106 N/A LYS 257.A N LEU 253.A O no hydrogen 2.963 N/A LYS 257.A NZ GLU 254.A OE2 no hydrogen 2.980 N/A ALA 258.A N GLN 255.A O no hydrogen 2.980 N/A TYR 259.A N MET 256.A O no hydrogen 2.833 N/A TYR 259.A OH ASP 134.A OD2 no hydrogen 2.574 N/A ALA 260.A N MET 256.A O no hydrogen 2.909 N/A GLU 261.A N LEU 233.A O no hydrogen 2.964 N/A GLU 264.A N THR 237.A O no hydrogen 3.037 N/A HIS 266.A N THR 239.A O no hydrogen 2.973 N/A HIS 266.A NE2 GLU 264.A OE2 no hydrogen 2.939 N/A LEU 268.A N ALA 241.A O no hydrogen 2.824 N/A CYS 271.A SG PRO 269.A O no hydrogen 3.297 N/A GLY 272.A N GLU 278.A OE1 no hydrogen 2.803 N/A HIS 273.A N HIS 183.A O no hydrogen 2.860 N/A HIS 273.A ND1 GLU 129.A OE1 no hydrogen 2.821 N/A TRP 274.A N GLU 278.A OE2 no hydrogen 3.005 N/A TRP 274.A NE1 ILE 180.A O no hydrogen 2.818 N/A GLU 277.A N TRP 274.A O no hydrogen 3.074 N/A GLU 278.A N TRP 274.A O no hydrogen 2.850 N/A CYS 279.A N LEU 275.A O no hydrogen 2.972 N/A CYS 279.A SG GLY 270.A O no hydrogen 3.903 N/A MET 283.A N CYS 279.A O no hydrogen 3.021 N/A ASN 284.A N ALA 280.A O no hydrogen 2.817 N/A ARG 285.A N ALA 281.A O no hydrogen 3.103 N/A ARG 285.A NH1 ASP 289.A OD1 no hydrogen 2.904 N/A LEU 286.A N PRO 282.A O no hydrogen 3.009 N/A VAL 287.A N MET 283.A O no hydrogen 3.008 N/A ILE 288.A N ASN 284.A O no hydrogen 2.853 N/A ASP 289.A N ARG 285.A O no hydrogen 2.950 N/A PHE 290.A N LEU 286.A O no hydrogen 3.047 N/A LEU 291.A N VAL 287.A O no hydrogen 2.986 N/A SER 292.A N ILE 288.A O no hydrogen 2.949 N/A SER 292.A OG ILE 288.A O no hydrogen 2.686 N/A ARG 293.A N PHE 290.A O no hydrogen 3.399 N/A ARG 293.A NH1 GLU 264.A OE1 no hydrogen 2.471 N/A ARG 293.A NH2 GLU 264.A OE1 no hydrogen 2.986 N/A GLY 294.A N LEU 291.A O no hydrogen 3.332 N/A HIS 296.A ND1 GLY 294.A O no hydrogen 3.028 N/A