Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a65_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N LEU 106.A O no hydrogen 3.046 N/A VAL 5.A N SER 109.A O no hydrogen 3.089 N/A ILE 6.A N VAL 28.A O no hydrogen 2.783 N/A ILE 7.A N ILE 111.A O no hydrogen 2.826 N/A GLY 8.A N TYR 30.A O no hydrogen 2.878 N/A SER 9.A OG GLU 31.A O no hydrogen 2.754 N/A HIS 14.A N GLY 10.A O no hydrogen 2.958 N/A HIS 14.A ND1 SER 73.A OG no hydrogen 2.733 N/A THR 15.A N PRO 11.A O no hydrogen 2.968 N/A THR 15.A OG1 PRO 11.A O no hydrogen 2.867 N/A ALA 16.A N ALA 12.A O no hydrogen 2.851 N/A ALA 17.A N ALA 13.A O no hydrogen 2.833 N/A ILE 18.A N HIS 14.A O no hydrogen 2.895 N/A TYR 19.A N THR 15.A O no hydrogen 3.129 N/A LEU 20.A N ALA 16.A O no hydrogen 2.856 N/A GLY 21.A N ALA 17.A O no hydrogen 2.688 N/A ARG 22.A N ILE 18.A O no hydrogen 2.935 N/A SER 23.A N TYR 19.A O no hydrogen 3.072 N/A SER 23.A OG TYR 19.A O no hydrogen 3.239 N/A SER 23.A OG GLU 305.A OE2 no hydrogen 2.863 N/A SER 24.A N GLY 21.A O no hydrogen 2.808 N/A LEU 25.A N LEU 20.A O no hydrogen 3.050 N/A VAL 28.A N VAL 4.A O no hydrogen 3.375 N/A MET 29.A N THR 79.A O no hydrogen 2.806 N/A TYR 30.A N ILE 6.A O no hydrogen 2.937 N/A GLU 31.A N ILE 81.A O no hydrogen 2.977 N/A GLY 32.A N GLU 83.A O no hydrogen 2.999 N/A PHE 33.A N THR 84.A OG1 no hydrogen 2.997 N/A GLY 37.A N MET 34.A O no hydrogen 2.922 N/A VAL 38.A N ALA 35.A O no hydrogen 2.962 N/A GLY 41.A N SER 9.A OG no hydrogen 2.909 N/A GLY 42.A N ALA 39.A O no hydrogen 3.005 N/A THR 45.A N GLY 42.A O no hydrogen 2.909 N/A THR 45.A OG1 GLY 42.A O no hydrogen 2.791 N/A THR 46.A N GLN 43.A O no hydrogen 2.929 N/A THR 46.A OG1 GLN 43.A O no hydrogen 2.701 N/A ILE 49.A N THR 48.A OG1 no hydrogen 2.645 N/A ILE 50.A N ILE 60.A O no hydrogen 2.808 N/A GLY 59.A N PHE 56.A O no hydrogen 3.105 N/A ILE 60.A N ILE 50.A O no hydrogen 3.040 N/A GLY 62.A N THR 48.A O no hydrogen 2.818 N/A ASN 63.A ND2 THR 45.A O no hydrogen 3.098 N/A GLU 64.A N ASP 61.A OD2 no hydrogen 3.046 N/A LEU 65.A N ASP 61.A O no hydrogen 2.725 N/A MET 66.A N GLY 62.A O no hydrogen 2.934 N/A MET 67.A N.A ASN 63.A O no hydrogen 2.860 N/A MET 67.A N.B ASN 63.A O no hydrogen 2.903 N/A MET 67.A N.B GLU 64.A O no hydrogen 3.153 N/A ASN 68.A N GLU 64.A O no hydrogen 2.953 N/A MET 69.A N LEU 65.A O no hydrogen 2.994 N/A ARG 70.A N MET 66.A O no hydrogen 2.976 N/A ARG 70.A NE GLU 31.A OE1 no hydrogen 3.029 N/A ARG 70.A NH2 GLU 31.A OE2 no hydrogen 2.863 N/A THR 71.A N MET 67.A O.A no hydrogen 3.083 N/A THR 71.A N MET 67.A O.B no hydrogen 3.080 N/A THR 71.A OG1 MET 67.A O.A no hydrogen 3.054 N/A THR 71.A OG1 MET 67.A O.B no hydrogen 2.943 N/A GLN 72.A N ASN 68.A O no hydrogen 3.001 N/A SER 73.A N MET 69.A O no hydrogen 2.810 N/A SER 73.A OG HIS 14.A ND1 no hydrogen 2.733 N/A SER 73.A OG HIS 14.A O no hydrogen 3.407 N/A SER 73.A OG MET 69.A O no hydrogen 3.209 N/A GLU 74.A N ARG 70.A O no hydrogen 3.009 N/A LYS 75.A N THR 71.A O no hydrogen 2.781 N/A TYR 76.A N GLN 72.A O no hydrogen 3.183 N/A GLY 77.A N GLU 74.A O no hydrogen 3.044 N/A THR 78.A N SER 73.A O no hydrogen 3.114 N/A THR 78.A OG1 SER 73.A O no hydrogen 3.046 N/A THR 79.A N PRO 27.A O no hydrogen 2.973 N/A ILE 81.A N MET 29.A O no hydrogen 2.736 N/A THR 82.A OG1 GLU 31.A OE2 no hydrogen 2.604 N/A ASP 86.A N PHE 98.A O no hydrogen 2.752 N/A HIS 87.A ND1 ASP 86.A OD2 no hydrogen 2.715 N/A ASP 89.A N LYS 96.A O no hydrogen 2.739 N/A SER 91.A N ASP 89.A OD1 no hydrogen 2.977 N/A SER 91.A OG ASP 89.A OD1 no hydrogen 2.596 N/A PHE 95.A N THR 107.A O no hydrogen 2.766 N/A LYS 96.A N ASP 89.A O no hydrogen 3.053 N/A LEU 97.A N VAL 105.A O no hydrogen 2.759 N/A PHE 98.A N HIS 87.A O no hydrogen 2.885 N/A THR 99.A N LYS 103.A O no hydrogen 2.909 N/A GLU 100.A N THR 84.A O no hydrogen 2.999 N/A GLY 102.A N THR 99.A O no hydrogen 2.831 N/A LYS 103.A N THR 99.A OG1 no hydrogen 3.097 N/A VAL 105.A N LEU 97.A O no hydrogen 2.725 N/A THR 107.A N PHE 95.A O no hydrogen 3.011 N/A THR 107.A OG1 HIS 2.A O no hydrogen 3.427 N/A THR 107.A OG1 SER 109.A O no hydrogen 2.926 N/A LYS 108.A N HIS 2.A O no hydrogen 2.862 N/A LYS 108.A NZ HIS 311.A O no hydrogen 2.803 N/A SER 109.A OG ASP 3.A O no hydrogen 2.783 N/A VAL 110.A N GLY 275.A O no hydrogen 2.988 N/A ILE 111.A N VAL 5.A O no hydrogen 2.825 N/A ILE 112.A N PHE 277.A O no hydrogen 2.776 N/A ALA 113.A N ILE 7.A O no hydrogen 2.744 N/A THR 114.A OG1 ASN 248.A O no hydrogen 2.645 N/A THR 117.A N SER 246.A O no hydrogen 2.722 N/A THR 117.A OG1 SER 246.A O no hydrogen 3.091 N/A THR 117.A OG1 SER 246.A OG no hydrogen 3.317 N/A LYS 119.A N GLY 244.A O no hydrogen 2.752 N/A ARG 120.A NE GLU 126.A OE2 no hydrogen 2.984 N/A ARG 120.A NH2 GLU 126.A OE2 no hydrogen 3.312 N/A HIS 122.A N GLU 126.A OE2 no hydrogen 3.141 N/A VAL 123.A N GLU 126.A OE1 no hydrogen 3.260 N/A GLU 126.A N VAL 123.A O no hydrogen 3.008 N/A LYS 128.A NZ GLY 215.A O no hydrogen 2.376 N/A TYR 129.A N GLY 125.A O no hydrogen 3.306 N/A GLN 131.A N VAL 134.A O no hydrogen 3.101 N/A ASN 132.A N.A TYR 129.A O no hydrogen 2.844 N/A ASN 132.A N.B TYR 129.A O no hydrogen 2.864 N/A ASN 132.A ND2.A TRP 130.A O no hydrogen 3.300 N/A VAL 134.A N TYR 129.A O no hydrogen 2.864 N/A SER 135.A N LEU 239.A O no hydrogen 2.799 N/A SER 135.A OG ASP 141.A OD2 no hydrogen 2.649 N/A CYS 137.A N SER 135.A OG no hydrogen 2.877 N/A ASP 141.A N CYS 137.A O no hydrogen 2.918 N/A ASP 141.A N ALA 138.A O no hydrogen 3.280 N/A GLY 142.A N ALA 138.A O no hydrogen 2.761 N/A VAL 144.A N ASP 141.A O no hydrogen 3.034 N/A PHE 147.A N VAL 144.A O no hydrogen 3.115 N/A ARG 148.A N PRO 145.A O no hydrogen 3.044 N/A ARG 148.A NH2 ALA 143.A O no hydrogen 2.842 N/A ASN 149.A N.A TYR 171.A O no hydrogen 2.885 N/A ASN 149.A N.B TYR 171.A O no hydrogen 2.920 N/A LYS 150.A N PHE 147.A O no hydrogen 3.188 N/A LEU 152.A N LYS 174.A O no hydrogen 2.907 N/A MET 153.A N GLY 238.A O no hydrogen 2.829 N/A VAL 154.A N ILE 176.A O no hydrogen 2.836 N/A VAL 155.A N PHE 240.A O no hydrogen 2.926 N/A GLY 156.A N LEU 178.A O no hydrogen 2.889 N/A MET 162.A N GLY 158.A O no hydrogen 3.078 N/A GLU 163.A N ASP 159.A O no hydrogen 2.788 N/A GLU 164.A N ALA 160.A O no hydrogen 2.807 N/A ALA 165.A N ALA 161.A O no hydrogen 2.978 N/A LEU 166.A N MET 162.A O no hydrogen 2.983 N/A HIS 167.A N GLU 163.A O no hydrogen 2.935 N/A LEU 168.A N GLU 164.A O no hydrogen 3.003 N/A THR 169.A N LEU 166.A O no hydrogen 3.359 N/A THR 169.A OG1 LEU 166.A O no hydrogen 2.715 N/A THR 169.A OG1 HIS 197.A NE2 no hydrogen 3.374 N/A LYS 170.A N HIS 167.A O no hydrogen 3.181 N/A TYR 171.A N LEU 168.A O no hydrogen 2.882 N/A GLY 172.A N LEU 168.A O no hydrogen 2.830 N/A SER 173.A N LYS 150.A O no hydrogen 2.848 N/A VAL 175.A N LYS 199.A O no hydrogen 2.764 N/A ILE 176.A N LEU 152.A O no hydrogen 2.821 N/A ILE 177.A N GLU 201.A O no hydrogen 2.784 N/A LEU 178.A N VAL 154.A O no hydrogen 2.810 N/A HIS 179.A N ILE 203.A O no hydrogen 3.037 N/A HIS 179.A NE2 ALA 183.A O no hydrogen 2.867 N/A ARG 185.A N GLY 157.A O no hydrogen 2.891 N/A ALA 186.A N GLY 157.A O no hydrogen 3.278 N/A SER 187.A N ASP 159.A OD1 no hydrogen 2.793 N/A SER 187.A OG ASP 159.A OD1 no hydrogen 3.376 N/A LYS 188.A NZ GLU 192.A OE1 no hydrogen 3.011 N/A MET 190.A N SER 187.A OG no hydrogen 3.243 N/A GLN 191.A N SER 187.A O no hydrogen 3.011 N/A GLU 192.A N LYS 188.A O no hydrogen 3.049 N/A ARG 193.A N THR 189.A O no hydrogen 3.210 N/A VAL 194.A N MET 190.A O no hydrogen 3.141 N/A LEU 195.A N GLN 191.A O no hydrogen 2.801 N/A ASN 196.A N GLU 192.A O no hydrogen 3.243 N/A HIS 197.A N VAL 194.A O no hydrogen 3.208 N/A LYS 199.A N HIS 197.A ND1 no hydrogen 3.012 N/A LYS 199.A NZ THR 169.A O no hydrogen 2.798 N/A LYS 199.A NZ GLY 172.A O no hydrogen 2.984 N/A ILE 200.A N HIS 197.A O no hydrogen 3.341 N/A GLU 201.A N VAL 175.A O no hydrogen 2.771 N/A ILE 203.A N ILE 177.A O no hydrogen 2.815 N/A ASN 205.A N ARG 181.A O no hydrogen 2.763 N/A ASN 205.A ND2 ARG 180.A O no hydrogen 3.634 N/A SER 206.A N HIS 179.A O no hydrogen 2.973 N/A SER 206.A OG TRP 204.A O no hydrogen 2.843 N/A GLU 207.A N HIS 224.A O no hydrogen 2.916 N/A VAL 209.A N LYS 222.A O no hydrogen 2.840 N/A GLU 210.A N LYS 222.A O no hydrogen 3.267 N/A LEU 211.A N PRO 124.A O no hydrogen 2.826 N/A GLU 212.A N GLY 220.A O no hydrogen 2.825 N/A ASP 214.A N LEU 217.A O no hydrogen 3.140 N/A GLY 215.A N TYR 129.A OH no hydrogen 2.795 N/A ASP 216.A N ASP 214.A OD1 no hydrogen 2.610 N/A LEU 217.A N ASP 214.A OD1 no hydrogen 2.732 N/A ASN 219.A N GLU 212.A O no hydrogen 2.925 N/A GLY 220.A N GLU 212.A O no hydrogen 3.079 N/A ALA 221.A N VAL 234.A O no hydrogen 2.812 N/A LYS 222.A N GLU 210.A O no hydrogen 2.768 N/A ILE 223.A N LYS 232.A O no hydrogen 2.801 N/A HIS 224.A N GLU 207.A O no hydrogen 2.826 N/A ASN 225.A N GLU 230.A O no hydrogen 2.916 N/A LEU 226.A N ASN 205.A O no hydrogen 2.797 N/A VAL 227.A N ASN 225.A OD1 no hydrogen 2.841 N/A SER 228.A N ASN 225.A OD1 no hydrogen 2.895 N/A GLY 229.A N ASN 225.A O no hydrogen 2.782 N/A GLU 230.A N SER 228.A OG no hydrogen 3.046 N/A LYS 232.A N ILE 223.A O no hydrogen 3.136 N/A VAL 234.A N ALA 221.A O no hydrogen 2.805 N/A VAL 236.A N ASN 219.A O no hydrogen 3.175 N/A ALA 237.A N VAL 151.A O no hydrogen 2.786 N/A GLY 238.A N VAL 151.A O no hydrogen 3.391 N/A LEU 239.A N GLY 133.A O no hydrogen 2.945 N/A PHE 240.A N MET 153.A O no hydrogen 2.763 N/A TYR 241.A N SER 135.A O no hydrogen 3.103 N/A TYR 241.A OH GLU 126.A OE1 no hydrogen 2.419 N/A ALA 242.A N VAL 155.A O no hydrogen 2.835 N/A SER 246.A N THR 117.A O no hydrogen 2.859 N/A SER 246.A OG THR 117.A OG1 no hydrogen 3.317 N/A ASN 248.A N GLY 115.A O no hydrogen 2.899 N/A SER 249.A OG GLY 262.A O no hydrogen 2.531 N/A LEU 252.A N SER 249.A O no hydrogen 3.177 N/A GLY 253.A N LYS 250.A O no hydrogen 2.950 N/A GLN 255.A N LEU 252.A O no hydrogen 2.823 N/A LYS 257.A N SER 272.A OG no hydrogen 2.963 N/A THR 258.A OG1 ALA 259.A O no hydrogen 3.570 N/A ALA 259.A N TYR 263.A O no hydrogen 2.759 N/A GLY 262.A N ALA 259.A O no hydrogen 2.943 N/A ILE 264.A N VAL 282.A O no hydrogen 3.126 N/A LEU 265.A N LYS 257.A O no hydrogen 2.924 N/A THR 266.A OG1 GLY 268.A O no hydrogen 2.967 N/A GLU 267.A N LYS 270.A O no hydrogen 2.974 N/A LYS 270.A N GLU 267.A O no hydrogen 3.049 N/A THR 271.A N VAL 276.A O no hydrogen 3.198 N/A THR 271.A OG1 VAL 273.A O no hydrogen 3.304 N/A THR 271.A OG1 VAL 276.A O no hydrogen 2.933 N/A VAL 273.A N THR 271.A OG1 no hydrogen 3.101 N/A VAL 276.A N VAL 273.A O no hydrogen 3.009 N/A PHE 277.A N VAL 110.A O no hydrogen 2.849 N/A ALA 278.A N PRO 269.A O no hydrogen 2.793 N/A CYS 279.A N ILE 112.A O no hydrogen 3.045 N/A CYS 279.A SG ILE 112.A O no hydrogen 4.011 N/A GLY 280.A N SER 296.A OG no hydrogen 3.161 N/A CYS 283.A N GLY 280.A O no hydrogen 3.006 N/A CYS 283.A SG GLY 280.A O no hydrogen 3.702 N/A ARG 285.A NE ASP 261.A OD2 no hydrogen 2.662 N/A ARG 285.A NH2 ASP 261.A OD1 no hydrogen 2.894 N/A ARG 285.A NH2 ASP 261.A OD2 no hydrogen 3.368 N/A VAL 286.A N ASP 284.A OD1 no hydrogen 2.827 N/A TYR 287.A N ASP 284.A OD1 no hydrogen 2.844 N/A TYR 287.A N ASP 284.A OD2 no hydrogen 3.259 N/A ARG 288.A N.A ASP 284.A OD2 no hydrogen 2.796 N/A ARG 288.A N.B ASP 284.A OD2 no hydrogen 2.798 N/A ARG 288.A NE.B ARG 285.A O no hydrogen 3.146 N/A ARG 288.A NH2.B ARG 285.A O no hydrogen 3.171 N/A ALA 293.A N GLN 289.A O no hydrogen 2.953 N/A ALA 294.A N ALA 290.A O no hydrogen 2.899 N/A GLY 295.A N ILE 291.A O no hydrogen 3.056 N/A SER 296.A N VAL 292.A O no hydrogen 2.953 N/A GLY 297.A N ALA 293.A O no hydrogen 2.840 N/A CYS 298.A N ALA 294.A O no hydrogen 3.053 N/A MET 299.A N GLY 295.A O no hydrogen 3.059 N/A ALA 300.A N SER 296.A O no hydrogen 2.875 N/A ALA 301.A N GLY 297.A O no hydrogen 2.993 N/A LEU 302.A N CYS 298.A O no hydrogen 2.880 N/A SER 303.A N.A MET 299.A O no hydrogen 3.050 N/A SER 303.A N.B MET 299.A O no hydrogen 3.042 N/A SER 303.A OG.A MET 299.A O no hydrogen 3.187 N/A CYS 304.A N ALA 300.A O no hydrogen 2.902 N/A CYS 304.A SG SER 109.A OG no hydrogen 3.280 N/A GLU 305.A N ALA 301.A O no hydrogen 2.868 N/A LYS 306.A N LEU 302.A O no hydrogen 3.107 N/A TRP 307.A N SER 303.A O.A no hydrogen 2.849 N/A TRP 307.A N SER 303.A O.B no hydrogen 3.064 N/A LEU 308.A N CYS 304.A O no hydrogen 2.885 N/A GLN 309.A N GLU 305.A O no hydrogen 3.129 N/A GLN 309.A N LYS 306.A O no hydrogen 3.180 N/A THR 310.A N TRP 307.A O no hydrogen 3.274 N/A THR 310.A OG1 TRP 307.A O no hydrogen 3.277 N/A THR 310.A OG1 HIS 311.A ND1 no hydrogen 3.105 N/A HIS 311.A N LEU 308.A O no hydrogen 3.065 N/A HIS 311.A ND1 TRP 307.A O no hydrogen 2.676 N/A