Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4he2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N PHE 166.A O no hydrogen 2.674 N/A TYR 6.A N THR 2.A O no hydrogen 2.840 N/A TYR 6.A OH ASP 155.A OD2 no hydrogen 2.687 N/A VAL 7.A N LEU 3.A O no hydrogen 2.752 N/A MET 8.A N THR 4.A O no hydrogen 2.946 N/A GLU 9.A N ARG 5.A O no hydrogen 2.904 N/A LYS 10.A N TYR 6.A O no hydrogen 2.899 N/A LYS 10.A NZ GLN 152.A OE1 no hydrogen 3.069 N/A GLY 11.A N VAL 7.A O no hydrogen 2.928 N/A ARG 12.A N MET 8.A O no hydrogen 2.953 N/A ARG 12.A NE GLU 9.A OE1 no hydrogen 2.821 N/A ARG 12.A NE GLU 9.A OE2 no hydrogen 3.460 N/A ARG 12.A NH2 GLU 9.A OE2 no hydrogen 2.845 N/A GLN 13.A N GLU 9.A O no hydrogen 2.948 N/A ALA 14.A N LYS 10.A O no hydrogen 2.981 N/A LYS 15.A N ARG 12.A O no hydrogen 3.161 N/A GLY 16.A N GLY 11.A O no hydrogen 3.095 N/A ARG 22.A N GLY 18.A O no hydrogen 2.899 N/A ARG 22.A NE SER 61.A O no hydrogen 2.975 N/A ARG 22.A NH2 TYR 62.A O no hydrogen 3.533 N/A LEU 23.A N GLU 19.A O no hydrogen 3.091 N/A LEU 24.A N LEU 20.A O no hydrogen 2.826 N/A ASN 25.A N THR 21.A O no hydrogen 2.964 N/A SER 26.A N ARG 22.A O no hydrogen 3.018 N/A SER 26.A OG ARG 22.A O no hydrogen 3.185 N/A SER 26.A OG MET 57.A O no hydrogen 3.425 N/A MET 27.A N LEU 23.A O no hydrogen 2.914 N/A LEU 28.A N LEU 24.A O no hydrogen 2.867 N/A THR 29.A N ASN 25.A O no hydrogen 2.879 N/A THR 29.A OG1 ASN 25.A O no hydrogen 2.760 N/A ALA 30.A N SER 26.A O no hydrogen 3.092 N/A ILE 31.A N MET 27.A O no hydrogen 2.993 N/A LYS 32.A N LEU 28.A O no hydrogen 2.962 N/A LYS 32.A NZ GLY 164.A O no hydrogen 2.751 N/A ALA 33.A N THR 29.A O no hydrogen 3.068 N/A ILE 34.A N ALA 30.A O no hydrogen 2.851 N/A SER 35.A N ILE 31.A O no hydrogen 2.842 N/A SER 35.A OG THR 144.A OG1 no hydrogen 3.070 N/A SER 36.A N LYS 32.A O no hydrogen 3.149 N/A ALA 37.A N ALA 33.A O no hydrogen 3.085 N/A VAL 38.A N ILE 34.A O no hydrogen 2.838 N/A ARG 39.A N SER 35.A O no hydrogen 2.923 N/A LYS 40.A N ALA 37.A O no hydrogen 3.185 N/A ALA 41.A N VAL 38.A O no hydrogen 3.331 N/A ALA 44.A N LYS 40.A O no hydrogen 2.950 N/A LEU 49.A N LYS 45.A O no hydrogen 3.139 N/A SER 50.A N LEU 46.A O no hydrogen 3.037 N/A SER 50.A OG.A LEU 46.A O no hydrogen 2.669 N/A SER 50.A OG.B LEU 46.A O no hydrogen 2.849 N/A SER 50.A OG.B ASP 47.A O no hydrogen 3.009 N/A ASN 51.A N ASP 47.A O no hydrogen 2.960 N/A ASN 51.A ND2 ASN 72.A OD1 no hydrogen 2.839 N/A SER 52.A N VAL 48.A O no hydrogen 3.083 N/A SER 52.A OG VAL 48.A O no hydrogen 3.337 N/A LEU 53.A N LEU 49.A O no hydrogen 3.002 N/A VAL 54.A N SER 50.A O no hydrogen 2.981 N/A ILE 55.A N ASN 51.A O no hydrogen 2.986 N/A ASN 56.A N SER 52.A O no hydrogen 3.002 N/A MET 57.A N LEU 53.A O no hydrogen 2.994 N/A LEU 58.A N VAL 54.A O no hydrogen 2.858 N/A GLN 59.A N ILE 55.A O no hydrogen 2.909 N/A SER 60.A N ASN 56.A O no hydrogen 3.099 N/A SER 60.A OG ASN 56.A O no hydrogen 2.920 N/A SER 60.A OG MET 57.A O no hydrogen 3.276 N/A SER 61.A N LEU 58.A O no hydrogen 3.167 N/A SER 61.A OG LEU 58.A O no hydrogen 2.543 N/A SER 61.A OG SER 63.A OG.B no hydrogen 2.489 N/A TYR 62.A N GLN 59.A O no hydrogen 3.505 N/A SER 63.A OG.A GLU 19.A O no hydrogen 2.753 N/A SER 63.A OG.A SER 61.A O no hydrogen 3.239 N/A SER 63.A OG.B SER 61.A OG no hydrogen 2.489 N/A THR 64.A OG1 THR 78.A OG1 no hydrogen 2.780 N/A CYS 65.A N TYR 86.A O no hydrogen 2.830 N/A CYS 65.A SG TYR 86.A O no hydrogen 3.642 N/A LEU 67.A N ILE 76.A O no hydrogen 2.859 N/A VAL 68.A N VAL 88.A O no hydrogen 2.887 N/A SER 69.A OG ASN 51.A OD1 no hydrogen 2.664 N/A GLU 70.A N PHE 90.A O no hydrogen 3.267 N/A GLU 71.A N SER 69.A OG no hydrogen 3.012 N/A ASN 72.A N SER 69.A O no hydrogen 3.133 N/A ILE 76.A N LEU 67.A O no hydrogen 2.788 N/A THR 78.A N CYS 65.A O no hydrogen 2.910 N/A THR 78.A OG1 THR 64.A OG1 no hydrogen 2.780 N/A LYS 82.A N ALA 79.A O no hydrogen 2.856 N/A ARG 83.A N LYS 80.A O no hydrogen 3.227 N/A ARG 83.A NH1 THR 78.A O no hydrogen 2.940 N/A GLY 84.A N THR 64.A O no hydrogen 2.801 N/A LYS 85.A N GLU 19.A OE2 no hydrogen 2.658 N/A TYR 86.A N SER 63.A O no hydrogen 2.946 N/A VAL 87.A N TYR 112.A O no hydrogen 2.769 N/A VAL 88.A N VAL 66.A O no hydrogen 3.031 N/A CYS 89.A N ALA 110.A O no hydrogen 2.827 N/A PHE 90.A N VAL 68.A O no hydrogen 2.800 N/A ASP 91.A N ILE 108.A O no hydrogen 2.837 N/A ASP 94.A N GLY 106.A O no hydrogen 2.552 N/A SER 96.A OG ASP 47.A OD1 no hydrogen 2.989 N/A SER 96.A OG ASP 47.A OD2 no hydrogen 3.299 N/A ASN 98.A N GLY 95.A O no hydrogen 2.786 N/A ASN 98.A ND2 VAL 218.A O no hydrogen 2.953 N/A ASN 98.A ND2 SER 220.A OG.A no hydrogen 2.926 N/A ILE 99.A N SER 96.A O no hydrogen 3.236 N/A CYS 101.A SG ASN 98.A O no hydrogen 3.575 N/A CYS 101.A SG ASN 98.A OD1 no hydrogen 3.386 N/A LEU 102.A N ILE 99.A O no hydrogen 3.123 N/A ALA 103.A N ASN 98.A O no hydrogen 3.258 N/A ILE 105.A N TYR 140.A O no hydrogen 3.304 N/A GLY 106.A N ASP 94.A O no hydrogen 2.921 N/A THR 107.A N ALA 138.A O no hydrogen 2.966 N/A THR 107.A OG1 PRO 92.A O no hydrogen 2.701 N/A THR 107.A OG1 TYR 140.A OH no hydrogen 2.728 N/A ILE 108.A N ASP 91.A O no hydrogen 2.961 N/A PHE 109.A N GLY 136.A O no hydrogen 3.035 N/A ALA 110.A N CYS 89.A O no hydrogen 2.835 N/A ILE 111.A N ALA 134.A O no hydrogen 2.759 N/A TYR 112.A N VAL 87.A O no hydrogen 2.795 N/A LYS 114.A N LYS 85.A O no hydrogen 2.806 N/A LYS 114.A NZ SER 116.A O no hydrogen 2.835 N/A LYS 114.A NZ SER 116.A OG no hydrogen 3.399 N/A LYS 114.A NZ ASP 118.A O no hydrogen 2.641 N/A SER 116.A OG ASP 124.A OD1 no hydrogen 2.620 N/A SER 121.A N ASP 124.A OD2 no hydrogen 2.959 N/A LYS 123.A N SER 121.A OG no hydrogen 3.158 N/A ASP 124.A N SER 121.A O no hydrogen 3.069 N/A ALA 125.A N GLU 122.A O no hydrogen 2.914 N/A LEU 126.A N LYS 123.A O no hydrogen 3.065 N/A GLN 127.A NE2 ARG 113.A O no hydrogen 2.879 N/A GLN 127.A NE2 ASP 124.A O no hydrogen 3.045 N/A CYS 128.A SG ASP 277.A O no hydrogen 3.854 N/A CYS 128.A SG VAL 278.A O no hydrogen 3.599 N/A ARG 130.A N LEU 276.A O no hydrogen 2.978 N/A ARG 130.A NE ASP 277.A OD1 no hydrogen 2.732 N/A ARG 130.A NH1 GLU 262.A OE1 no hydrogen 2.830 N/A ARG 130.A NH2 GLU 262.A OE2 no hydrogen 3.164 N/A ARG 130.A NH2 ASP 277.A OD2 no hydrogen 3.202 N/A ASN 131.A N CYS 128.A O no hydrogen 2.872 N/A ASN 131.A ND2 GLN 127.A OE1 no hydrogen 2.824 N/A ILE 132.A N GLY 129.A O no hydrogen 2.988 N/A VAL 133.A N ILE 111.A O no hydrogen 2.799 N/A ALA 134.A N ILE 111.A O no hydrogen 3.386 N/A ALA 135.A N SER 149.A O no hydrogen 2.968 N/A GLY 136.A N PHE 109.A O no hydrogen 3.026 N/A TYR 137.A N ALA 147.A O no hydrogen 3.012 N/A TYR 137.A OH HIS 226.A ND1 no hydrogen 2.755 N/A ALA 138.A N THR 107.A O no hydrogen 2.810 N/A LEU 139.A N LEU 145.A O no hydrogen 2.762 N/A TYR 140.A N ILE 105.A O no hydrogen 2.742 N/A TYR 140.A OH THR 107.A OG1 no hydrogen 2.728 N/A GLY 141.A N ALA 143.A O no hydrogen 2.973 N/A THR 144.A OG1 SER 35.A OG no hydrogen 3.070 N/A LEU 145.A N LEU 139.A O no hydrogen 2.959 N/A VAL 146.A N PHE 157.A O no hydrogen 2.843 N/A ALA 147.A N TYR 137.A O no hydrogen 2.904 N/A LEU 148.A N ASP 155.A O no hydrogen 2.985 N/A SER 149.A N ALA 135.A O no hydrogen 2.984 N/A SER 149.A OG GLY 153.A O no hydrogen 3.074 N/A SER 149.A OG GLN 263.A OE1 no hydrogen 2.776 N/A THR 150.A OG1 GLN 152.A OE1 no hydrogen 2.683 N/A GLY 151.A N SER 149.A OG no hydrogen 3.006 N/A GLN 152.A NE2 THR 150.A O no hydrogen 2.921 N/A GLY 153.A N GLN 263.A OE1 no hydrogen 2.831 N/A ASP 155.A N LEU 148.A O no hydrogen 3.005 N/A LEU 156.A N GLU 170.A O no hydrogen 2.806 N/A PHE 157.A N VAL 146.A O no hydrogen 2.856 N/A MET 158.A N VAL 167.A O no hydrogen 2.800 N/A LEU 159.A N THR 144.A O no hydrogen 2.859 N/A ASP 160.A N GLU 165.A O no hydrogen 2.901 N/A ALA 162.A N ASP 160.A OD1 no hydrogen 3.013 N/A LEU 163.A N ASP 160.A OD1 no hydrogen 3.337 N/A GLY 164.A N ASP 160.A O no hydrogen 2.746 N/A VAL 167.A N MET 158.A O no hydrogen 2.852 N/A LEU 168.A N LEU 1.A O no hydrogen 2.930 N/A VAL 169.A N LEU 156.A O no hydrogen 2.870 N/A GLU 170.A N LEU 156.A O no hydrogen 3.247 N/A ASP 172.A N ASP 155.A OD1 no hydrogen 2.933 N/A VAL 173.A N VAL 154.A O no hydrogen 2.845 N/A LYS 174.A NZ ASP 172.A OD1 no hydrogen 3.531 N/A LYS 174.A NZ GLN 263.A O no hydrogen 2.868 N/A ILE 175.A N ALA 264.A O no hydrogen 2.835 N/A LYS 176.A NZ TYR 231.A O no hydrogen 2.976 N/A LYS 178.A NZ TYR 213.A OH no hydrogen 2.966 N/A GLY 179.A N ASP 296.A OD2 no hydrogen 2.827 N/A TYR 182.A N GLY 214.A O no hydrogen 2.937 N/A TYR 182.A OH GLU 186.A OE2 no hydrogen 2.623 N/A SER 183.A OG ARG 216.A O no hydrogen 2.610 N/A GLY 187.A N ASN 185.A OD1 no hydrogen 2.860 N/A TYR 188.A N ASN 185.A O no hydrogen 3.252 N/A ALA 189.A N GLU 186.A O no hydrogen 3.034 N/A TYR 191.A N TYR 188.A O no hydrogen 2.759 N/A PHE 192.A N ALA 189.A O no hydrogen 3.204 N/A THR 196.A N ASP 193.A OD1 no hydrogen 2.851 N/A THR 196.A OG1 ASP 193.A OD1 no hydrogen 2.754 N/A THR 196.A OG1 TYR 300.A OH no hydrogen 2.869 N/A THR 197.A N ASP 193.A O no hydrogen 3.059 N/A THR 197.A OG1 ASP 193.A O no hydrogen 3.146 N/A GLU 198.A N ALA 194.A O no hydrogen 2.880 N/A TYR 199.A N ALA 195.A O no hydrogen 2.927 N/A VAL 200.A N THR 196.A O no hydrogen 2.950 N/A GLN 201.A N THR 197.A O no hydrogen 3.052 N/A LYS 202.A N GLU 198.A O no hydrogen 3.008 N/A LYS 203.A N TYR 199.A O no hydrogen 3.040 N/A LYS 203.A NZ GLU 299.A OE1 no hydrogen 3.103 N/A LYS 204.A N VAL 200.A O no hydrogen 3.079 N/A LYS 204.A NZ GLU 186.A OE1 no hydrogen 2.696 N/A PHE 205.A N GLN 201.A O no hydrogen 2.729 N/A SER 210.A N ASP 208.A OD1 no hydrogen 3.053 N/A SER 210.A OG ASP 208.A OD1 no hydrogen 2.650 N/A TYR 213.A N LYS 203.A O no hydrogen 2.918 N/A TYR 213.A OH ASP 296.A OD1 no hydrogen 2.602 N/A GLY 214.A N LYS 180.A O no hydrogen 2.882 N/A ARG 216.A N TYR 182.A O no hydrogen 3.215 N/A ARG 216.A NH1 ALA 215.A O no hydrogen 2.885 N/A VAL 218.A N ASP 224.A OD1 no hydrogen 2.819 N/A GLY 219.A N ASP 224.A OD2 no hydrogen 2.988 N/A SER 220.A OG.A SER 104.A O no hydrogen 2.673 N/A SER 220.A OG.B SER 104.A O no hydrogen 2.962 N/A VAL 222.A N ASP 94.A OD2 no hydrogen 2.883 N/A ASP 224.A N SER 220.A O no hydrogen 3.046 N/A VAL 225.A N MET 221.A O no hydrogen 2.739 N/A HIS 226.A N VAL 222.A O no hydrogen 2.865 N/A HIS 226.A ND1 TYR 137.A OH no hydrogen 2.755 N/A ARG 227.A N ALA 223.A O no hydrogen 3.028 N/A ARG 227.A NH1 ASP 224.A OD1 no hydrogen 2.875 N/A ARG 227.A NH2 SER 183.A OG no hydrogen 2.989 N/A ARG 227.A NH2 ASP 224.A OD1 no hydrogen 3.424 N/A THR 228.A N ASP 224.A O no hydrogen 3.037 N/A THR 228.A OG1 ASP 224.A O no hydrogen 2.751 N/A LEU 229.A N VAL 225.A O no hydrogen 2.895 N/A VAL 230.A N HIS 226.A O no hydrogen 3.025 N/A TYR 231.A N ARG 227.A O no hydrogen 2.792 N/A GLY 232.A N THR 228.A O no hydrogen 2.792 N/A GLY 233.A N SER 293.A OG no hydrogen 2.973 N/A ILE 234.A N ILE 181.A O no hydrogen 3.000 N/A PHE 235.A N LEU 291.A O no hydrogen 2.912 N/A LEU 236.A N SER 183.A O no hydrogen 2.818 N/A TYR 237.A N LEU 289.A O no hydrogen 2.710 N/A ASN 240.A N SER 243.A O no hydrogen 3.032 N/A GLN 241.A N TYR 191.A O no hydrogen 2.910 N/A LYS 242.A N ASN 240.A OD1 no hydrogen 2.777 N/A SER 243.A N ASN 240.A O no hydrogen 3.041 N/A SER 243.A N ASN 240.A OD1 no hydrogen 2.900 N/A GLY 246.A N SER 243.A O no hydrogen 2.911 N/A ARG 249.A N GLU 253.A OE1 no hydrogen 2.750 N/A ARG 249.A NH1 HIS 284.A O no hydrogen 2.792 N/A LEU 250.A N GLN 285.A O no hydrogen 2.821 N/A TYR 252.A OH HIS 284.A ND1 no hydrogen 2.677 N/A GLU 253.A N ARG 249.A O no hydrogen 3.093 N/A CYS 254.A N ARG 249.A O no hydrogen 2.871 N/A CYS 254.A SG ARG 249.A O no hydrogen 3.636 N/A ASN 255.A N LEU 250.A O no hydrogen 2.931 N/A VAL 257.A N GLU 253.A O no hydrogen 3.476 N/A ALA 258.A N CYS 254.A O no hydrogen 2.825 N/A TYR 259.A N ASN 255.A O no hydrogen 2.888 N/A ILE 260.A N PRO 256.A O no hydrogen 3.122 N/A ILE 261.A N VAL 257.A O no hydrogen 2.875 N/A GLU 262.A N ALA 258.A O no hydrogen 2.855 N/A GLN 263.A N TYR 259.A O no hydrogen 2.906 N/A ALA 264.A N ILE 260.A O no hydrogen 3.044 N/A ALA 264.A N ILE 261.A O no hydrogen 3.171 N/A GLY 265.A N GLU 262.A O no hydrogen 2.970 N/A GLY 266.A N ILE 261.A O no hydrogen 2.811 N/A LEU 267.A N GLY 292.A O no hydrogen 3.041 N/A THR 269.A N ILE 290.A O no hydrogen 2.794 N/A THR 269.A OG1 GLN 273.A O no hydrogen 3.213 N/A THR 270.A N GLN 273.A O no hydrogen 2.928 N/A THR 270.A OG1 THR 272.A OG1 no hydrogen 3.200 N/A THR 270.A OG1 GLN 273.A O no hydrogen 3.268 N/A GLY 271.A N THR 269.A OG1 no hydrogen 2.901 N/A THR 272.A N THR 270.A OG1 no hydrogen 3.135 N/A THR 272.A OG1 THR 270.A OG1 no hydrogen 3.200 N/A GLN 273.A N THR 270.A OG1 no hydrogen 3.213 N/A VAL 275.A N ALA 268.A O no hydrogen 2.936 N/A ASP 277.A N PRO 274.A O no hydrogen 2.985 N/A VAL 278.A N VAL 275.A O no hydrogen 3.104 N/A LYS 279.A NZ LEU 126.A O no hydrogen 2.840 N/A GLU 281.A N GLN 285.A OE1 no hydrogen 2.732 N/A HIS 284.A ND1 TYR 252.A OH no hydrogen 2.677 N/A HIS 284.A NE2 ASN 72.A O no hydrogen 2.851 N/A HIS 284.A NE2 LYS 73.A O no hydrogen 3.132 N/A GLN 285.A N ALA 282.A O no hydrogen 3.200 N/A ARG 286.A NH1 LYS 247.A O no hydrogen 2.900 N/A VAL 287.A N LEU 248.A O no hydrogen 2.982 N/A LEU 289.A N TYR 237.A O no hydrogen 3.041 N/A ILE 290.A N THR 269.A O no hydrogen 2.840 N/A LEU 291.A N PHE 235.A O no hydrogen 2.867 N/A GLY 292.A N LEU 267.A O no hydrogen 2.948 N/A SER 293.A N GLY 233.A O no hydrogen 2.859 N/A SER 293.A OG LYS 176.A O no hydrogen 2.793 N/A GLU 295.A N LYS 177.A O no hydrogen 2.910 N/A VAL 297.A N SER 293.A O no hydrogen 3.049 N/A GLN 298.A N PRO 294.A O no hydrogen 2.901 N/A GLU 299.A N GLU 295.A O no hydrogen 3.054 N/A TYR 300.A N ASP 296.A O no hydrogen 3.035 N/A TYR 300.A OH THR 196.A OG1 no hydrogen 2.869 N/A LEU 301.A N VAL 297.A O no hydrogen 2.886 N/A THR 302.A N GLN 298.A O no hydrogen 2.991 N/A THR 302.A OG1 GLN 298.A O no hydrogen 3.183 N/A CYS 303.A N GLU 299.A O no hydrogen 3.201 N/A CYS 303.A SG GLU 299.A O no hydrogen 3.584 N/A VAL 304.A N TYR 300.A O no hydrogen 3.037 N/A GLN 305.A N LEU 301.A O no hydrogen 2.903 N/A LYS 306.A N THR 302.A O no hydrogen 2.899 N/A LYS 306.A NZ GLU 198.A OE2 no hydrogen 2.620 N/A ASN 307.A N CYS 303.A O no hydrogen 3.196 N/A ASN 307.A N VAL 304.A O no hydrogen 3.178 N/A ASN 307.A ND2 GLU 198.A OE1 no hydrogen 2.770 N/A ASN 307.A ND2 CYS 303.A O no hydrogen 2.701 N/A