Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4h85_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N TYR 20.A OH no hydrogen 3.369 N/A SER 8.A OG ARG 7.A O no hydrogen 2.588 N/A SER 12.A N ASP 10.A OD1 no hydrogen 3.351 N/A SER 12.A OG ASP 10.A OD1 no hydrogen 2.722 N/A SER 12.A OG ASP 10.A OD2 no hydrogen 3.199 N/A LEU 14.A N GLY 11.A O no hydrogen 3.319 N/A LYS 16.A N SER 12.A O no hydrogen 3.082 N/A LYS 16.A NZ TYR 4.A OH no hydrogen 2.396 N/A SER 17.A N HIS 13.A O no hydrogen 2.908 N/A SER 17.A OG HIS 134.A ND1 no hydrogen 2.631 N/A GLY 18.A N LEU 14.A O no hydrogen 2.818 N/A ARG 19.A N LEU 15.A O no hydrogen 2.925 N/A TYR 20.A N LYS 16.A O no hydrogen 3.010 N/A LEU 21.A N SER 17.A O no hydrogen 2.917 N/A GLN 22.A N GLY 18.A O no hydrogen 2.762 N/A GLN 22.A NE2 PHE 66.A O no hydrogen 3.256 N/A GLN 22.A NE2 PRO 67.A O no hydrogen 2.716 N/A GLN 23.A N ARG 19.A O no hydrogen 2.973 N/A GLN 23.A NE2 GLU 24.A OE2 no hydrogen 3.357 N/A GLU 24.A N TYR 20.A O no hydrogen 2.913 N/A GLU 24.A N LEU 21.A O no hydrogen 3.035 N/A LEU 25.A N LEU 21.A O no hydrogen 2.871 N/A ARG 28.A N GLU 24.A O no hydrogen 3.199 N/A ILE 29.A N LEU 25.A O no hydrogen 2.861 N/A ALA 30.A N PRO 26.A O no hydrogen 2.826 N/A HIS 31.A N VAL 27.A O no hydrogen 3.100 N/A ARG 32.A N ARG 28.A O no hydrogen 3.117 N/A ILE 33.A N ILE 29.A O no hydrogen 2.911 N/A LYS 34.A N ALA 30.A O no hydrogen 2.983 N/A GLY 35.A N HIS 31.A O no hydrogen 3.132 N/A PHE 36.A N ARG 32.A O no hydrogen 3.127 N/A ARG 37.A N ILE 33.A O no hydrogen 2.951 N/A SER 38.A N LYS 34.A O no hydrogen 3.128 N/A SER 38.A N GLY 35.A O no hydrogen 3.319 N/A SER 38.A OG LYS 34.A O no hydrogen 3.405 N/A LEU 39.A N PHE 36.A O no hydrogen 3.202 N/A ILE 43.A N PRO 40.A O no hydrogen 2.934 N/A GLY 44.A N PRO 40.A O no hydrogen 2.866 N/A CYS 45.A N PHE 41.A O no hydrogen 2.895 N/A CYS 45.A SG PHE 41.A O no hydrogen 3.409 N/A ASN 46.A N ILE 43.A O no hydrogen 3.047 N/A THR 48.A N ASN 46.A OD1 no hydrogen 2.738 N/A ILE 49.A N ASN 46.A OD1 no hydrogen 2.887 N/A LEU 50.A N ASN 46.A O no hydrogen 2.789 N/A HIS 51.A N PRO 47.A O no hydrogen 2.969 N/A VAL 52.A N THR 48.A O no hydrogen 3.077 N/A HIS 53.A N ILE 49.A O no hydrogen 2.832 N/A GLU 54.A N LEU 50.A O no hydrogen 2.839 N/A LEU 55.A N HIS 51.A O no hydrogen 2.941 N/A TYR 56.A N VAL 52.A O no hydrogen 3.064 N/A ILE 57.A N HIS 53.A O no hydrogen 3.094 N/A ARG 58.A N GLU 54.A O no hydrogen 2.922 N/A ALA 59.A N LEU 55.A O no hydrogen 2.894 N/A PHE 60.A N TYR 56.A O no hydrogen 2.961 N/A GLN 61.A N ILE 57.A O no hydrogen 2.842 N/A LYS 62.A N ARG 58.A O no hydrogen 2.909 N/A LYS 62.A NZ GLN 84.A OE1 no hydrogen 2.891 N/A LEU 63.A N ALA 59.A O no hydrogen 2.868 N/A THR 64.A N PHE 60.A O no hydrogen 2.951 N/A THR 64.A OG1 PHE 60.A O no hydrogen 2.822 N/A THR 64.A OG1 GLN 61.A O no hydrogen 3.188 N/A ASP 65.A N GLN 61.A O no hydrogen 2.885 N/A PHE 66.A N LEU 63.A O no hydrogen 3.399 N/A ILE 69.A N GLN 22.A OE1 no hydrogen 2.921 N/A LYS 70.A N ASP 74.A OD2 no hydrogen 2.950 N/A ASP 74.A N ASP 71.A OD1 no hydrogen 2.825 N/A GLU 75.A N ASP 71.A O no hydrogen 3.005 N/A ALA 76.A N GLN 72.A O no hydrogen 2.864 N/A GLN 77.A N ALA 73.A O no hydrogen 3.266 N/A TYR 78.A N ASP 74.A O no hydrogen 2.809 N/A CYS 79.A N GLU 75.A O no hydrogen 3.023 N/A CYS 79.A SG GLU 75.A O no hydrogen 3.454 N/A CYS 79.A SG GLU 75.A OE2 no hydrogen 3.109 N/A CYS 79.A SG HIS 134.A NE2 no hydrogen 3.591 N/A CYS 79.A SG HIS 138.A NE2 no hydrogen 3.689 N/A GLN 80.A N ALA 76.A O no hydrogen 3.349 N/A LEU 81.A N GLN 77.A O no hydrogen 3.190 N/A VAL 82.A N TYR 78.A O no hydrogen 2.934 N/A ARG 83.A N CYS 79.A O no hydrogen 2.906 N/A ARG 83.A NE.B GLN 80.A OE1 no hydrogen 3.507 N/A GLN 84.A N GLN 80.A O no hydrogen 3.004 N/A LEU 85.A N LEU 81.A O no hydrogen 2.905 N/A LEU 86.A N VAL 82.A O no hydrogen 2.911 N/A ASP 87.A N ARG 83.A O no hydrogen 3.056 N/A ASP 88.A N GLN 84.A O no hydrogen 2.812 N/A HIS 89.A N LEU 85.A O no hydrogen 2.956 N/A LYS 90.A N ASP 87.A O no hydrogen 3.199 N/A VAL 92.A N HIS 89.A O no hydrogen 3.285 N/A LEU 95.A N ASP 91.A O no hydrogen 3.040 N/A LEU 96.A N VAL 92.A O no hydrogen 2.891 N/A ALA 97.A N VAL 93.A O no hydrogen 3.010 N/A GLU 98.A N THR 94.A O no hydrogen 3.024 N/A GLY 99.A N LEU 95.A O no hydrogen 2.777 N/A LEU 100.A N LEU 96.A O no hydrogen 2.858 N/A ARG 101.A N GLU 98.A O no hydrogen 3.325 N/A SER 103.A OG GLY 99.A O no hydrogen 2.623 N/A ARG 104.A N LEU 100.A O no hydrogen 3.045 N/A ARG 104.A NH1 HIS 259.A ND1 no hydrogen 3.148 N/A LYS 105.A N GLU 102.A O no hydrogen 2.919 N/A LYS 105.A NZ GLU 102.A OE1 no hydrogen 2.964 N/A LYS 105.A NZ GLU 102.A OE2 no hydrogen 3.333 N/A HIS 106.A N SER 103.A O no hydrogen 3.057 N/A LYS 111.A N ASP 109.A OD1 no hydrogen 3.167 N/A LEU 112.A N ASP 109.A O no hydrogen 3.299 N/A ARG 114.A NH2 ASP 257.A OD1 no hydrogen 2.873 N/A TYR 115.A N LYS 111.A O no hydrogen 2.962 N/A PHE 116.A N LEU 112.A O no hydrogen 2.936 N/A LEU 117.A N VAL 113.A O no hydrogen 2.799 N/A ASP 118.A N ARG 114.A O no hydrogen 2.873 N/A LYS 119.A N TYR 115.A O no hydrogen 2.924 N/A LYS 119.A NZ LYS 119.A O no hydrogen 3.281 N/A LYS 119.A NZ SER 123.A OG no hydrogen 2.497 N/A THR 120.A N PHE 116.A O no hydrogen 2.814 N/A THR 120.A OG1 PHE 116.A O no hydrogen 2.738 N/A LEU 121.A N LEU 117.A O no hydrogen 2.793 N/A THR 122.A N ASP 118.A O no hydrogen 3.138 N/A THR 122.A OG1 ASP 118.A O no hydrogen 2.638 N/A THR 122.A OG1 LYS 119.A O no hydrogen 3.365 N/A SER 123.A N LYS 119.A O no hydrogen 3.077 N/A SER 123.A OG LYS 119.A O no hydrogen 3.000 N/A ARG 124.A N THR 120.A O no hydrogen 2.972 N/A ARG 124.A NH2 HIS 89.A O no hydrogen 2.957 N/A LEU 125.A N LEU 121.A O no hydrogen 2.886 N/A GLY 126.A N THR 122.A O no hydrogen 3.034 N/A ILE 127.A N SER 123.A O no hydrogen 2.823 N/A ARG 128.A N ARG 124.A O no hydrogen 2.803 N/A ARG 128.A NH1 LEU 86.A O no hydrogen 3.039 N/A ARG 128.A NH2 LEU 86.A O no hydrogen 3.337 N/A MET 129.A N LEU 125.A O no hydrogen 2.832 N/A LEU 130.A N GLY 126.A O no hydrogen 2.941 N/A ALA 131.A N ILE 127.A O no hydrogen 2.993 N/A THR 132.A N ARG 128.A O no hydrogen 2.846 N/A THR 132.A OG1 ARG 128.A O no hydrogen 2.779 N/A HIS 133.A N MET 129.A O no hydrogen 2.829 N/A HIS 133.A NE2 TYR 4.A O no hydrogen 2.693 N/A HIS 134.A N LEU 130.A O no hydrogen 3.049 N/A HIS 134.A ND1 SER 17.A OG no hydrogen 2.631 N/A HIS 134.A NE2 GLU 75.A OE2 no hydrogen 2.561 N/A LEU 135.A N ALA 131.A O no hydrogen 3.084 N/A ALA 136.A N THR 132.A O no hydrogen 2.910 N/A LEU 137.A N HIS 133.A O no hydrogen 3.109 N/A LEU 137.A N HIS 134.A O no hydrogen 3.127 N/A HIS 138.A N LEU 135.A O no hydrogen 3.127 N/A HIS 138.A NE2 GLU 75.A OE2 no hydrogen 2.691 N/A GLU 139.A N ALA 136.A O no hydrogen 2.860 N/A VAL 145.A N ILE 148.A O no hydrogen 2.808 N/A ILE 147.A N HIS 133.A ND1 no hydrogen 3.102 N/A ILE 148.A N VAL 145.A O no hydrogen 2.843 N/A CYS 149.A N PHE 191.A O no hydrogen 2.834 N/A CYS 149.A SG ASP 143.A O no hydrogen 3.574 N/A THR 150.A N ASP 143.A O no hydrogen 2.913 N/A ARG 151.A NH1 ASP 143.A OD1 no hydrogen 2.942 N/A LEU 152.A N PHE 189.A O no hydrogen 2.790 N/A LYS 155.A NZ GLU 159.A OE2 no hydrogen 2.411 N/A LYS 156.A N SER 153.A OG no hydrogen 3.081 N/A ILE 157.A N SER 153.A O no hydrogen 3.142 N/A ILE 158.A N PRO 154.A O no hydrogen 2.923 N/A GLU 159.A N LYS 155.A O no hydrogen 2.851 N/A LYS 160.A N LYS 156.A O no hydrogen 2.964 N/A LYS 160.A NZ ASP 197.A OD1 no hydrogen 3.180 N/A TRP 161.A N ILE 157.A O no hydrogen 3.234 N/A TRP 161.A NE1 ASP 197.A OD1 no hydrogen 2.889 N/A VAL 162.A N ILE 158.A O no hydrogen 2.770 N/A ASP 163.A N GLU 159.A O no hydrogen 2.993 N/A PHE 164.A N LYS 160.A O no hydrogen 3.255 N/A ALA 165.A N TRP 161.A O no hydrogen 2.832 N/A ARG 166.A N VAL 162.A O no hydrogen 2.784 N/A ARG 166.A NE PRO 177.A O no hydrogen 2.735 N/A ARG 166.A NH2 ALA 176.A O no hydrogen 3.177 N/A ARG 167.A N ASP 163.A O no hydrogen 3.140 N/A LEU 168.A N PHE 164.A O no hydrogen 3.289 N/A CYS 169.A N ALA 165.A O no hydrogen 2.877 N/A CYS 169.A SG ASN 175.A O no hydrogen 3.501 N/A GLU 170.A N ARG 166.A O no hydrogen 2.716 N/A HIS 171.A N ARG 167.A O no hydrogen 2.981 N/A LYS 172.A N LEU 168.A O no hydrogen 3.158 N/A TYR 173.A N CYS 169.A O no hydrogen 2.919 N/A TYR 173.A OH GLU 213.A OE2 no hydrogen 2.846 N/A GLY 174.A N GLU 170.A O no hydrogen 2.944 N/A ASN 175.A ND2 PRO 219.A O no hydrogen 2.697 N/A ARG 180.A N VAL 225.A O no hydrogen 2.906 N/A ARG 180.A NH1 ASP 224.A OD2 no hydrogen 2.584 N/A ASN 182.A N ILE 227.A O no hydrogen 2.817 N/A HIS 184.A N ILE 229.A O no hydrogen 2.757 N/A VAL 185.A N GLY 183.A O no hydrogen 2.859 N/A ALA 187.A N HIS 184.A O no hydrogen 3.272 N/A PHE 189.A N LEU 152.A O no hydrogen 3.096 N/A PHE 191.A N CYS 149.A O no hydrogen 2.839 N/A ASP 197.A N PRO 193.A O no hydrogen 2.976 N/A TYR 198.A N MET 194.A O no hydrogen 3.267 N/A TYR 198.A N PRO 195.A O no hydrogen 3.185 N/A ILE 199.A N PRO 195.A O no hydrogen 2.910 N/A LEU 200.A N LEU 196.A O no hydrogen 2.824 N/A LEU 203.A N ILE 199.A O no hydrogen 3.133 N/A LEU 204.A N LEU 200.A O no hydrogen 2.927 N/A LYS 205.A N PRO 201.A O no hydrogen 2.921 N/A ASN 206.A N GLU 202.A O no hydrogen 3.154 N/A ALA 207.A N LEU 203.A O no hydrogen 3.045 N/A MET 208.A N LEU 204.A O no hydrogen 2.934 N/A ARG 209.A N LYS 205.A O no hydrogen 2.874 N/A ARG 209.A NH2 THR 262.A OG1 no hydrogen 3.409 N/A ALA 210.A N ASN 206.A O no hydrogen 2.960 N/A THR 211.A N ALA 207.A O no hydrogen 3.030 N/A THR 211.A OG1 ALA 207.A O no hydrogen 2.707 N/A MET 212.A N MET 208.A O no hydrogen 2.919 N/A GLU 213.A N ARG 209.A O no hydrogen 2.881 N/A SER 214.A N ALA 210.A O no hydrogen 3.178 N/A SER 214.A OG ALA 210.A O no hydrogen 2.932 N/A SER 214.A OG THR 211.A O no hydrogen 3.180 N/A SER 214.A OG HIS 215.A ND1 no hydrogen 3.065 N/A HIS 215.A N MET 212.A O no hydrogen 2.969 N/A HIS 215.A ND1 THR 211.A O no hydrogen 2.812 N/A THR 218.A N HIS 215.A O no hydrogen 2.914 N/A THR 218.A OG1 ASN 221.A O no hydrogen 3.517 N/A ASN 221.A N THR 218.A O no hydrogen 2.931 N/A VAL 225.A N ARG 178.A O no hydrogen 2.916 N/A VAL 226.A N SER 241.A O no hydrogen 2.885 N/A ILE 227.A N ARG 180.A O no hydrogen 2.694 N/A THR 228.A N ARG 239.A O no hydrogen 2.844 N/A THR 228.A OG1 ASN 182.A OD1 no hydrogen 2.693 N/A ILE 229.A N ASN 182.A O no hydrogen 2.915 N/A ALA 230.A N ILE 237.A O no hydrogen 2.885 N/A ASN 231.A N HIS 184.A ND1 no hydrogen 2.819 N/A ASN 232.A N ASP 235.A O no hydrogen 3.110 N/A ASN 232.A ND2 ASP 235.A OD2 no hydrogen 2.853 N/A VAL 234.A N ASN 232.A OD1 no hydrogen 2.767 N/A ASP 235.A N ASN 232.A OD1 no hydrogen 2.784 N/A LEU 236.A N LEU 299.A O no hydrogen 2.831 N/A ILE 237.A N ALA 230.A O no hydrogen 2.796 N/A ILE 238.A N LEU 297.A O no hydrogen 2.725 N/A ARG 239.A N THR 228.A O no hydrogen 2.892 N/A ARG 239.A NH2 THR 228.A OG1 no hydrogen 2.876 N/A ILE 240.A N VAL 295.A O no hydrogen 2.740 N/A SER 241.A N VAL 226.A O no hydrogen 2.949 N/A SER 241.A OG ASP 294.A OD1 no hydrogen 2.837 N/A ASP 242.A N THR 293.A O no hydrogen 2.917 N/A GLY 244.A N ASP 242.A OD2 no hydrogen 2.842 N/A GLY 245.A N ILE 291.A O no hydrogen 2.985 N/A ILE 247.A N SER 287.A OG no hydrogen 2.789 N/A ASP 251.A N ALA 248.A O no hydrogen 2.871 N/A LEU 252.A N HIS 249.A O no hydrogen 3.347 N/A ARG 254.A N ASP 251.A O no hydrogen 2.921 N/A VAL 255.A N ASP 251.A O no hydrogen 3.132 N/A ASP 257.A N ARG 254.A O no hydrogen 2.842 N/A TYR 258.A OH ASP 118.A OD1 no hydrogen 2.728 N/A HIS 259.A N GLY 266.A O no hydrogen 2.954 N/A HIS 259.A NE2 ALA 97.A O no hydrogen 2.687 N/A PHE 260.A N ASP 257.A O no hydrogen 3.246 N/A ALA 263.A N THR 261.A OG1 no hydrogen 3.107 N/A THR 271.A N PHE 267.A O no hydrogen 2.970 N/A THR 271.A OG1 PHE 267.A O no hydrogen 2.919 N/A SER 272.A N GLY 268.A O no hydrogen 3.048 N/A SER 272.A OG GLY 268.A O no hydrogen 2.696 N/A ARG 273.A N LEU 269.A O no hydrogen 2.913 N/A ALA 274.A N PRO 270.A O no hydrogen 2.913 N/A TYR 275.A N THR 271.A O no hydrogen 2.834 N/A ALA 276.A N SER 272.A O no hydrogen 2.909 N/A GLU 277.A N ARG 273.A O no hydrogen 2.979 N/A TYR 278.A N ALA 274.A O no hydrogen 2.877 N/A LEU 279.A N TYR 275.A O no hydrogen 3.212 N/A LEU 279.A N ALA 276.A O no hydrogen 3.231 N/A GLY 280.A N GLU 277.A O no hydrogen 2.907 N/A GLY 281.A N ALA 276.A O no hydrogen 2.755 N/A SER 282.A N ARG 298.A O no hydrogen 2.969 N/A GLN 284.A N TYR 296.A O no hydrogen 2.972 N/A GLN 286.A N ASP 294.A O no hydrogen 2.770 N/A SER 287.A OG ILE 247.A O no hydrogen 2.710 N/A LEU 288.A N GLY 292.A O no hydrogen 2.844 N/A GLN 289.A N GLN 289.A OE1 no hydrogen 2.710 N/A GLN 289.A NE2 ILE 247.A O no hydrogen 3.040 N/A GLY 290.A N GLY 245.A O no hydrogen 2.864 N/A ILE 291.A N LEU 288.A O no hydrogen 2.772 N/A GLY 292.A N LEU 288.A O no hydrogen 3.069 N/A THR 293.A N ASP 242.A O no hydrogen 3.346 N/A THR 293.A N ASP 242.A OD2 no hydrogen 3.118 N/A ASP 294.A N GLN 286.A O no hydrogen 2.825 N/A VAL 295.A N ILE 240.A O no hydrogen 2.807 N/A TYR 296.A N GLN 284.A O no hydrogen 2.820 N/A LEU 297.A N ILE 238.A O no hydrogen 2.834 N/A ARG 298.A N SER 282.A O no hydrogen 2.959 N/A LEU 299.A N LEU 236.A O no hydrogen 2.964 N/A HIS 301.A N VAL 234.A O no hydrogen 3.062 N/A HIS 301.A NE2 ASN 231.A OD1 no hydrogen 2.637 N/A