Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a91_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A OH GLU 185.A OE1 no hydrogen 2.566 N/A ILE 5.A N THR 184.A OG1 no hydrogen 2.972 N/A GLY 6.A N ARG 37.A O no hydrogen 2.959 N/A ARG 7.A NE ASP 178.A OD1 no hydrogen 2.739 N/A ARG 7.A NE ASP 178.A OD2 no hydrogen 3.262 N/A ARG 7.A NH1 ARG 7.A O no hydrogen 3.420 N/A ARG 7.A NH2 ASP 178.A OD2 no hydrogen 2.928 N/A PHE 8.A N LEU 39.A O no hydrogen 2.883 N/A LEU 16.A N GLN 61.A OE1 no hydrogen 2.844 N/A HIS 17.A N SER 20.A OG no hydrogen 2.971 N/A SER 20.A OG HIS 17.A O no hydrogen 3.209 N/A LEU 21.A N HIS 17.A O no hydrogen 2.852 N/A ILE 22.A N PHE 18.A O no hydrogen 2.892 N/A ALA 23.A N GLY 19.A O no hydrogen 3.243 N/A ALA 24.A N SER 20.A O no hydrogen 2.943 N/A LEU 25.A N LEU 21.A O no hydrogen 2.766 N/A GLY 26.A N ILE 22.A O no hydrogen 2.826 N/A SER 27.A N ALA 23.A O no hydrogen 3.051 N/A SER 27.A OG ALA 23.A O no hydrogen 2.885 N/A SER 27.A OG ALA 24.A O no hydrogen 3.138 N/A TYR 28.A N ALA 24.A O no hydrogen 2.954 N/A LEU 29.A N LEU 25.A O no hydrogen 2.835 N/A GLN 30.A N GLY 26.A O no hydrogen 3.092 N/A GLN 30.A NE2 GLU 185.A OE1 no hydrogen 2.893 N/A ALA 31.A N SER 27.A O no hydrogen 3.015 N/A ARG 32.A N TYR 28.A O no hydrogen 2.867 N/A ARG 32.A NH1 GLY 36.A O no hydrogen 3.063 N/A ARG 32.A NH1 ASP 70.A OD2 no hydrogen 2.793 N/A ARG 32.A NH2 HIS 68.A O no hydrogen 2.997 N/A ARG 32.A NH2 ASP 70.A OD1 no hydrogen 3.128 N/A ARG 32.A NH2 ASP 70.A OD2 no hydrogen 3.434 N/A ALA 33.A N LEU 29.A O no hydrogen 2.812 N/A ARG 34.A N GLN 30.A O no hydrogen 3.007 N/A GLN 35.A N ARG 32.A O no hydrogen 2.986 N/A GLY 36.A N ALA 31.A O no hydrogen 2.850 N/A ARG 37.A N TYR 4.A O no hydrogen 2.885 N/A TRP 38.A N ASP 70.A OD2 no hydrogen 2.838 N/A TRP 38.A NE1 SER 27.A OG no hydrogen 2.907 N/A LEU 39.A N GLY 6.A O no hydrogen 2.909 N/A ARG 41.A N PHE 8.A O no hydrogen 3.022 N/A ARG 41.A NE GLU 43.A OE2 no hydrogen 2.914 N/A ARG 41.A NH1 ASP 178.A OD1 no hydrogen 2.891 N/A ARG 41.A NH1 GLN 181.A OE1 no hydrogen 2.817 N/A ARG 41.A NH2 GLU 43.A OE2 no hydrogen 2.957 N/A ARG 41.A NH2 ASP 178.A OD1 no hydrogen 3.024 N/A ILE 42.A N LEU 74.A O no hydrogen 2.788 N/A GLU 43.A N PRO 10.A O no hydrogen 2.918 N/A ARG 49.A N ASP 46.A O no hydrogen 3.094 N/A GLU 50.A N ASP 46.A O no hydrogen 3.223 N/A GLU 50.A N PRO 47.A O no hydrogen 3.115 N/A VAL 51.A N PRO 12.A O no hydrogen 3.094 N/A ALA 54.A N VAL 51.A O no hydrogen 2.982 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.719 N/A THR 57.A N GLY 53.A O no hydrogen 2.941 N/A THR 57.A OG1 GLY 53.A O no hydrogen 2.991 N/A ILE 58.A N ALA 54.A O no hydrogen 2.882 N/A LEU 59.A N ALA 55.A O no hydrogen 3.072 N/A ARG 60.A N GLU 56.A O no hydrogen 2.996 N/A GLN 61.A N THR 57.A O no hydrogen 2.747 N/A GLN 61.A NE2 LEU 16.A O no hydrogen 3.567 N/A LEU 62.A N ILE 58.A O no hydrogen 2.867 N/A GLU 63.A N LEU 59.A O no hydrogen 3.203 N/A HIS 64.A N ARG 60.A O no hydrogen 2.981 N/A HIS 64.A NE2 GLY 237.A O no hydrogen 2.856 N/A TYR 65.A N GLN 61.A O no hydrogen 3.015 N/A TYR 65.A N LEU 62.A O no hydrogen 3.205 N/A TYR 65.A OH PRO 235.A O no hydrogen 3.051 N/A GLY 66.A N GLU 63.A O no hydrogen 2.960 N/A LEU 67.A N LEU 62.A O no hydrogen 2.851 N/A ASP 70.A N TRP 38.A O no hydrogen 2.888 N/A LEU 74.A N VAL 40.A O no hydrogen 3.231 N/A GLN 76.A N ILE 42.A O no hydrogen 3.008 N/A SER 77.A N ASP 44.A OD1 no hydrogen 2.858 N/A SER 77.A OG ASP 44.A OD1 no hydrogen 3.368 N/A SER 77.A OG ASP 44.A OD2 no hydrogen 2.574 N/A GLN 78.A N TRP 75.A O no hydrogen 2.863 N/A ARG 79.A N GLN 76.A O no hydrogen 2.921 N/A ARG 79.A NE ASP 177.A OD1 no hydrogen 2.777 N/A ARG 79.A NH2 ASP 177.A OD1 no hydrogen 3.022 N/A TYR 83.A N ARG 79.A O no hydrogen 3.096 N/A TYR 83.A OH ASP 177.A OD2 no hydrogen 2.549 N/A ARG 84.A N HIS 80.A O no hydrogen 2.981 N/A GLU 85.A N ASP 81.A O no hydrogen 2.900 N/A ALA 86.A N ALA 82.A O no hydrogen 3.065 N/A LEU 87.A N TYR 83.A O no hydrogen 2.979 N/A ALA 88.A N ARG 84.A O no hydrogen 2.889 N/A TRP 89.A N GLU 85.A O no hydrogen 3.135 N/A LEU 90.A N ALA 86.A O no hydrogen 3.030 N/A HIS 91.A N LEU 87.A O no hydrogen 2.979 N/A GLU 92.A N ALA 88.A O no hydrogen 2.934 N/A GLN 93.A N TRP 89.A O no hydrogen 2.952 N/A GLY 94.A N HIS 91.A O no hydrogen 3.087 N/A LEU 95.A N LEU 90.A O no hydrogen 2.805 N/A TYR 97.A N ARG 130.A O no hydrogen 3.052 N/A TYR 97.A OH ASP 158.A OD2 no hydrogen 2.682 N/A CYS 99.A N ALA 128.A O no hydrogen 2.734 N/A CYS 99.A SG TYR 113.A OH no hydrogen 3.532 N/A CYS 101.A SG TYR 113.A OH no hydrogen 3.762 N/A CYS 101.A SG HIS 116.A ND1 no hydrogen 3.720 N/A ARG 105.A N THR 102.A OG1 no hydrogen 3.044 N/A ARG 105.A NH1 ASP 114.A OD1 no hydrogen 2.977 N/A ARG 105.A NH2 ASP 114.A OD1 no hydrogen 3.491 N/A ARG 105.A NH2 ASP 114.A OD2 no hydrogen 2.726 N/A ILE 106.A N THR 102.A O no hydrogen 3.214 N/A GLN 107.A N ARG 103.A O no hydrogen 2.890 N/A SER 108.A N ALA 104.A O no hydrogen 3.044 N/A SER 108.A OG ARG 105.A O no hydrogen 2.699 N/A ILE 109.A N ILE 106.A O no hydrogen 3.302 N/A GLY 110.A N GLN 107.A O no hydrogen 3.165 N/A GLY 111.A N ILE 106.A O no hydrogen 2.869 N/A TYR 113.A N GLU 157.A OE2 no hydrogen 2.737 N/A HIS 116.A N ASP 114.A OD1 no hydrogen 3.170 N/A CYS 117.A N TYR 113.A OH no hydrogen 2.705 N/A CYS 117.A SG TYR 113.A OH no hydrogen 3.474 N/A CYS 117.A SG HIS 116.A ND1 no hydrogen 3.638 N/A ARG 118.A N GLY 115.A O no hydrogen 3.046 N/A ARG 118.A NH1 GLN 133.A O no hydrogen 3.139 N/A ARG 118.A NH1 ASP 158.A OD2 no hydrogen 2.947 N/A ARG 118.A NH2 GLN 133.A O no hydrogen 3.024 N/A LEU 120.A N CYS 117.A O no hydrogen 3.118 N/A ALA 127.A N PRO 124.A O no hydrogen 3.248 N/A ALA 128.A N CYS 99.A O no hydrogen 2.898 N/A VAL 129.A N HIS 162.A O no hydrogen 2.876 N/A ARG 130.A N TYR 97.A O no hydrogen 2.904 N/A ARG 130.A NH1 ASP 158.A O no hydrogen 2.876 N/A ILE 131.A N PHE 159.A O no hydrogen 2.979 N/A ARG 132.A N LEU 95.A O no hydrogen 2.860 N/A ARG 132.A NE GLY 94.A O no hydrogen 3.100 N/A ARG 132.A NH1 ARG 118.A O no hydrogen 2.713 N/A ARG 132.A NH2 SER 96.A O no hydrogen 3.413 N/A GLN 133.A N ASP 158.A OD1 no hydrogen 2.963 N/A GLN 133.A NE2 ALA 155.A O no hydrogen 2.925 N/A GLN 133.A NE2 GLU 157.A O no hydrogen 2.878 N/A VAL 137.A N SER 201.A OG no hydrogen 2.965 N/A PHE 140.A N ILE 148.A O.A no hydrogen 3.097 N/A PHE 140.A N ILE 148.A O.B no hydrogen 3.067 N/A ASP 142.A N GLY 146.A O no hydrogen 2.859 N/A GLN 143.A N TYR 213.A O no hydrogen 2.797 N/A LEU 144.A N ASP 142.A OD1 no hydrogen 2.867 N/A ARG 145.A N ASP 142.A OD1 no hydrogen 2.801 N/A ARG 145.A NE HIS 215.A O no hydrogen 2.980 N/A ARG 145.A NH2 LEU 216.A O no hydrogen 2.854 N/A ARG 145.A NH2 GLU 281.A O no hydrogen 3.201 N/A GLY 146.A N ASP 142.A O no hydrogen 2.888 N/A ILE 148.A N.A PHE 140.A O no hydrogen 2.869 N/A ILE 148.A N.B PHE 140.A O no hydrogen 2.847 N/A ALA 150.A N THR 138.A O no hydrogen 2.922 N/A ASP 151.A N GLU 194.A OE2 no hydrogen 2.807 N/A LEU 154.A N ASP 151.A OD1 no hydrogen 2.986 N/A ALA 155.A N ASP 151.A O no hydrogen 2.995 N/A ARG 156.A N GLU 152.A O no hydrogen 3.024 N/A ARG 156.A N LYS 153.A O no hydrogen 3.362 N/A ARG 156.A NE GLU 152.A OE1 no hydrogen 3.058 N/A ARG 156.A NH2 GLU 152.A OE1 no hydrogen 2.866 N/A GLU 157.A N LEU 154.A O no hydrogen 3.388 N/A ILE 161.A N.A VAL 129.A O no hydrogen 2.768 N/A ILE 161.A N.B VAL 129.A O no hydrogen 2.766 N/A HIS 162.A N VAL 129.A O no hydrogen 3.401 N/A HIS 162.A NE2 GLY 166.A O no hydrogen 2.892 N/A ARG 163.A N LEU 167.A O no hydrogen 2.837 N/A ARG 164.A NE ASN 126.A O no hydrogen 2.654 N/A ARG 164.A NH1 THR 100.A O no hydrogen 3.373 N/A ARG 164.A NH2 ASN 126.A O no hydrogen 3.019 N/A ARG 164.A NH2 ASN 126.A OD1 no hydrogen 3.332 N/A GLY 166.A N ARG 163.A O no hydrogen 2.854 N/A LEU 167.A N ASP 165.A OD1 no hydrogen 3.063 N/A ALA 169.A N ILE 161.A O.A no hydrogen 2.900 N/A ALA 169.A N ILE 161.A O.B no hydrogen 3.014 N/A ALA 173.A N ALA 169.A O no hydrogen 3.006 N/A VAL 174.A N TYR 170.A O no hydrogen 2.888 N/A VAL 176.A N LEU 172.A O no hydrogen 2.989 N/A ASP 177.A N ALA 173.A O no hydrogen 2.877 N/A ASP 178.A N VAL 174.A O no hydrogen 2.919 N/A HIS 179.A N VAL 175.A O no hydrogen 3.031 N/A PHE 180.A N VAL 176.A O no hydrogen 2.959 N/A GLN 181.A N ASP 177.A O no hydrogen 2.869 N/A GLY 182.A N HIS 179.A O no hydrogen 3.032 N/A VAL 183.A N ASP 178.A O no hydrogen 2.924 N/A THR 184.A N ILE 5.A O no hydrogen 2.806 N/A THR 184.A OG1 ILE 5.A O no hydrogen 3.369 N/A GLU 185.A N ILE 5.A O no hydrogen 3.317 N/A ILE 186.A N ASP 212.A O no hydrogen 2.810 N/A ARG 188.A N ILE 214.A O no hydrogen 2.921 N/A ARG 188.A NE HIS 215.A NE2 no hydrogen 3.016 N/A ARG 188.A NH1 GLN 199.A OE1 no hydrogen 3.057 N/A ARG 188.A NH2 THR 196.A OG1 no hydrogen 2.760 N/A ARG 188.A NH2 GLN 199.A OE1 no hydrogen 3.027 N/A LEU 192.A N GLY 189.A O no hydrogen 3.060 N/A ILE 193.A N ALA 190.A O no hydrogen 3.183 N/A THR 196.A N ILE 193.A O no hydrogen 3.110 N/A THR 196.A OG1 LEU 192.A O no hydrogen 3.165 N/A THR 196.A OG1 ILE 193.A O no hydrogen 3.028 N/A THR 196.A OG1 HIS 215.A NE2 no hydrogen 3.242 N/A ARG 198.A NE LEU 154.A O no hydrogen 3.049 N/A ARG 198.A NH2 LEU 154.A O no hydrogen 2.919 N/A GLN 199.A N PRO 195.A O no hydrogen 3.162 N/A GLN 199.A NE2 TYR 170.A OH no hydrogen 3.335 N/A ILE 200.A N THR 196.A O no hydrogen 2.964 N/A SER 201.A N VAL 197.A O no hydrogen 2.914 N/A SER 201.A OG GLN 133.A OE1 no hydrogen 3.396 N/A SER 201.A OG VAL 197.A O no hydrogen 3.090 N/A LEU 202.A N ARG 198.A O no hydrogen 2.993 N/A TYR 203.A N GLN 199.A O no hydrogen 2.913 N/A GLN 204.A N ILE 200.A O no hydrogen 3.023 N/A LEU 205.A N SER 201.A O no hydrogen 3.005 N/A PHE 206.A N LEU 202.A O no hydrogen 2.996 N/A GLY 207.A N GLN 204.A O no hydrogen 3.025 N/A TRP 208.A N TYR 203.A O no hydrogen 2.865 N/A ASP 212.A N THR 184.A O no hydrogen 2.965 N/A ILE 214.A N ILE 186.A O no hydrogen 2.787 N/A HIS 215.A N ASP 142.A OD2 no hydrogen 2.826 N/A HIS 215.A ND1 ASP 142.A OD2 no hydrogen 2.881 N/A LEU 216.A N ARG 188.A O no hydrogen 2.838 N/A LEU 218.A N GLU 281.A O no hydrogen 2.955 N/A LEU 220.A N ALA 283.A O no hydrogen 2.837 N/A ASN 221.A N ALA 225.A O no hydrogen 2.741 N/A GLN 223.A N ASN 221.A OD1 no hydrogen 2.911 N/A GLY 224.A N ASN 221.A O no hydrogen 2.892 N/A ALA 225.A N ASN 221.A OD1 no hydrogen 3.031 N/A LEU 227.A N ALA 219.A O no hydrogen 2.920 N/A GLN 230.A N SER 228.A O no hydrogen 2.607 N/A LEU 234.A N LEU 16.A O no hydrogen 3.167 N/A ARG 240.A N ASP 238.A OD1 no hydrogen 3.064 N/A ARG 240.A NE ASP 238.A OD1 no hydrogen 3.052 N/A ARG 240.A NE ASP 238.A OD2 no hydrogen 3.253 N/A ARG 240.A NH1 GLN 259.A O no hydrogen 3.099 N/A ARG 240.A NH1 PHE 261.A O no hydrogen 2.910 N/A ARG 240.A NH2 ASP 238.A OD2 no hydrogen 2.830 N/A LEU 243.A N PRO 239.A O no hydrogen 2.947 N/A ILE 244.A N ARG 240.A O no hydrogen 2.898 N/A ALA 245.A N PRO 241.A O no hydrogen 3.001 N/A ALA 246.A N VAL 242.A O no hydrogen 2.895 N/A LEU 247.A N LEU 243.A O no hydrogen 2.872 N/A GLN 248.A N ILE 244.A O no hydrogen 3.021 N/A PHE 249.A N ALA 245.A O no hydrogen 2.956 N/A LEU 250.A N ALA 246.A O no hydrogen 3.088 N/A GLY 251.A N GLN 248.A O no hydrogen 2.946 N/A GLN 252.A N LEU 247.A O no hydrogen 2.881 N/A HIS 257.A N GLU 255.A OE2 no hydrogen 3.203 N/A GLN 259.A N GLN 259.A OE1 no hydrogen 2.773 N/A PHE 261.A N TRP 258.A O no hydrogen 3.080 N/A SER 262.A N GLN 265.A OE1 no hydrogen 3.011 N/A GLN 265.A N SER 262.A OG no hydrogen 3.184 N/A ILE 266.A N SER 262.A O no hydrogen 2.987 N/A LEU 267.A N VAL 263.A O no hydrogen 2.973 N/A GLN 268.A N GLU 264.A O no hydrogen 2.811 N/A SER 269.A N GLN 265.A O no hydrogen 2.990 N/A SER 269.A OG GLN 265.A O no hydrogen 3.282 N/A ALA 270.A N ILE 266.A O no hydrogen 2.929 N/A VAL 271.A N LEU 267.A O no hydrogen 2.861 N/A LYS 272.A N GLN 268.A O no hydrogen 3.097 N/A ASN 273.A N SER 269.A O no hydrogen 2.850 N/A TRP 274.A N VAL 271.A O no hydrogen 3.261 N/A TRP 274.A NE1 GLN 30.A OE1 no hydrogen 2.873 N/A ALA 278.A N ARG 275.A O no hydrogen 3.054 N/A VAL 279.A N LEU 276.A O no hydrogen 3.006 N/A ALA 283.A N LEU 218.A O no hydrogen 2.950 N/A VAL 285.A N LEU 220.A O no hydrogen 2.921 N/A PHE 289.A N ASN 286.A O no hydrogen 2.930 N/A SER 290.A N SER 287.A O no hydrogen 3.178 N/A