Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pag_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N THR 4.A OG1 no hydrogen 3.074 N/A ARG 3.A NE PRO 16.A O no hydrogen 2.994 N/A ARG 3.A NH1 PRO 16.A O no hydrogen 2.944 N/A ARG 3.A NH1 VAL 134.A O no hydrogen 2.852 N/A ARG 3.A NH2 ARG 133.A O.A no hydrogen 2.825 N/A ARG 3.A NH2 ARG 133.A O.B no hydrogen 2.896 N/A ARG 3.A NH2 VAL 134.A O no hydrogen 3.419 N/A THR 4.A N GLU 1.A O no hydrogen 3.328 N/A PHE 5.A N ILE 13.A O no hydrogen 2.877 N/A ASP 7.A N LYS 11.A O no hydrogen 2.858 N/A VAL 8.A N ALA 113.A O no hydrogen 2.995 N/A SER 9.A N ASP 7.A OD1 no hydrogen 2.820 N/A ASN 10.A N ASP 7.A O no hydrogen 2.935 N/A LYS 11.A N ASP 7.A OD1 no hydrogen 2.950 N/A ILE 13.A N PHE 5.A O no hydrogen 2.735 N/A LEU 15.A N ARG 3.A O no hydrogen 2.885 N/A THR 20.A N ASP 88.A OD2 no hydrogen 2.837 N/A THR 20.A OG1 ASP 88.A OD2 no hydrogen 3.471 N/A ARG 21.A N ASP 88.A OD2 no hydrogen 3.134 N/A ARG 21.A NE ALA 85.A O no hydrogen 2.768 N/A ARG 21.A NE LYS 86.A O no hydrogen 3.224 N/A ARG 21.A NH2 ALA 85.A O no hydrogen 2.691 N/A ILE 22.A N PRO 39.A O no hydrogen 2.796 N/A TYR 23.A N VAL 89.A O no hydrogen 3.336 N/A TYR 23.A OH GLY 69.A O no hydrogen 2.584 N/A SER 25.A N ILE 91.A O no hydrogen 2.834 N/A ILE 29.A N ALA 26.A O no hydrogen 2.876 N/A SER 30.A N ALA 26.A O no hydrogen 2.984 N/A SER 30.A OG ALA 26.A O no hydrogen 3.538 N/A SER 30.A OG ASN 44.A OD1 no hydrogen 2.532 N/A PHE 31.A N PRO 27.A O no hydrogen 2.817 N/A TYR 33.A N SER 30.A O no hydrogen 2.979 N/A VAL 34.A N PHE 31.A O no hydrogen 3.381 N/A ASP 36.A N ILE 32.A O no hydrogen 2.847 N/A THR 38.A N ASP 36.A OD1 no hydrogen 3.136 N/A THR 38.A OG1 ASP 36.A OD1 no hydrogen 2.775 N/A LEU 40.A N ASP 37.A O no hydrogen 3.036 N/A ILE 41.A N ILE 22.A O no hydrogen 3.037 N/A VAL 43.A N PRO 66.A O no hydrogen 2.955 N/A ASN 44.A ND2 GLY 24.A O no hydrogen 2.814 N/A ASN 44.A ND2 GLY 69.A O no hydrogen 2.958 N/A GLN 47.A N GLN 47.A OE1 no hydrogen 2.671 N/A GLN 47.A NE2 PHE 63.A O no hydrogen 2.945 N/A GLN 47.A NE2 LEU 65.A O no hydrogen 3.023 N/A ASN 49.A N ASN 52.A O no hydrogen 2.865 N/A ASN 49.A ND2 PRO 46.A O no hydrogen 2.942 N/A LYS 50.A NZ ASP 174.A OD1 no hydrogen 2.904 N/A ASP 51.A N ASN 49.A OD1 no hydrogen 2.918 N/A ASN 52.A ND2 ASN 49.A OD1 no hydrogen 3.013 N/A ASN 52.A ND2 ARG 266.A O no hydrogen 2.998 N/A ASN 53.A N LYS 258.A O no hydrogen 2.954 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.696 N/A LYS 57.A N ASN 54.A O no hydrogen 3.055 N/A PHE 58.A N GLY 55.A O no hydrogen 2.961 N/A LEU 59.A N GLY 55.A O no hydrogen 2.761 N/A SER 60.A N TYR 33.A OH no hydrogen 2.981 N/A SER 60.A OG ASP 37.A OD2 no hydrogen 2.647 N/A LYS 61.A NZ GLU 64.A OE2 no hydrogen 2.887 N/A PHE 63.A N SER 60.A OG no hydrogen 3.088 N/A LEU 65.A N PHE 63.A O no hydrogen 3.264 N/A LEU 68.A N VAL 43.A O no hydrogen 2.828 N/A GLY 70.A N ILE 76.A O no hydrogen 3.294 N/A TRP 71.A N SER 25.A O no hydrogen 2.879 N/A TRP 71.A NE1 ASP 105.A OD2 no hydrogen 2.835 N/A ASN 75.A N HIS 72.A O no hydrogen 3.080 N/A ASN 75.A ND2 ASN 44.A O no hydrogen 2.889 N/A ASN 75.A ND2 HIS 72.A NE2 no hydrogen 3.072 N/A ILE 76.A N ASN 75.A OD1 no hydrogen 3.079 N/A ASN 78.A N LEU 68.A O no hydrogen 2.919 N/A GLU 80.A N GLU 80.A OE1 no hydrogen 2.717 N/A ALA 81.A N ASN 78.A OD1 no hydrogen 3.242 N/A ILE 82.A N ASN 78.A O no hydrogen 2.906 N/A LEU 83.A N LEU 79.A O no hydrogen 2.898 N/A ALA 84.A N GLU 80.A O no hydrogen 2.881 N/A ALA 85.A N ALA 81.A O no hydrogen 2.868 N/A ALA 85.A N ILE 82.A O no hydrogen 3.126 N/A LYS 86.A N LEU 83.A O no hydrogen 3.280 N/A ASP 88.A N ARG 21.A O no hydrogen 2.756 N/A ILE 90.A N PRO 112.A O no hydrogen 2.939 N/A ILE 91.A N TYR 23.A O no hydrogen 2.921 N/A THR 92.A N LEU 114.A O no hydrogen 2.717 N/A THR 92.A OG1 LEU 114.A O no hydrogen 3.291 N/A TRP 93.A N SER 25.A OG no hydrogen 3.140 N/A TRP 93.A NE1 ASP 119.A OD1 no hydrogen 3.178 N/A ASP 94.A N VAL 116.A O no hydrogen 2.873 N/A THR 95.A N ASN 99.A OD1 no hydrogen 3.138 N/A THR 95.A OG1 ASP 119.A OD2 no hydrogen 2.642 N/A LEU 98.A N THR 95.A O no hydrogen 2.952 N/A ASN 99.A N THR 95.A O no hydrogen 3.039 N/A ASN 99.A ND2 ASP 94.A OD1 no hydrogen 2.930 N/A LYS 101.A NZ ASP 105.A OD2 no hydrogen 3.398 N/A THR 102.A N LEU 98.A O no hydrogen 3.159 N/A THR 102.A OG1 LEU 98.A O no hydrogen 2.857 N/A ALA 103.A N ASN 99.A O no hydrogen 2.913 N/A LYS 104.A N GLU 100.A O no hydrogen 2.999 N/A LYS 104.A NZ GLU 100.A OE2 no hydrogen 3.013 N/A ASP 105.A N LYS 101.A O no hydrogen 3.059 N/A LEU 106.A N THR 102.A O no hydrogen 2.928 N/A ALA 107.A N ALA 103.A O no hydrogen 3.190 N/A ARG 108.A N LYS 104.A O no hydrogen 3.401 N/A ILE 109.A N ASP 105.A O no hydrogen 3.035 N/A SER 110.A N LEU 106.A O no hydrogen 2.869 N/A SER 110.A OG SER 110.A O no hydrogen 2.508 N/A LEU 114.A N ILE 90.A O no hydrogen 2.891 N/A LYS 115.A NZ VAL 8.A O no hydrogen 3.154 N/A VAL 116.A N THR 92.A O no hydrogen 2.955 N/A ASP 119.A N ASN 117.A OD1 no hydrogen 3.477 N/A SER 121.A N GLU 188.A OE2 no hydrogen 2.999 N/A SER 121.A OG GLU 188.A OE1 no hydrogen 2.598 N/A SER 121.A OG GLU 188.A OE2 no hydrogen 3.190 N/A GLN 122.A N.A ASP 120.A OD1 no hydrogen 3.081 N/A GLN 122.A N.B ASP 120.A OD1 no hydrogen 3.080 N/A ASN 123.A N ASP 120.A O no hydrogen 2.914 N/A ASN 123.A ND2 ASN 117.A O no hydrogen 3.134 N/A TYR 124.A N SER 121.A O no hydrogen 3.070 N/A VAL 127.A N ASN 123.A O no hydrogen 3.078 N/A PHE 128.A N TYR 124.A O no hydrogen 2.830 N/A ARG 129.A N PRO 125.A O no hydrogen 3.005 N/A ARG 129.A NH1 GLU 126.A OE2 no hydrogen 2.757 N/A TYR 130.A N GLU 126.A O no hydrogen 2.917 N/A LEU 131.A N VAL 127.A O no hydrogen 2.905 N/A GLY 132.A N PHE 128.A O no hydrogen 2.916 N/A ARG 133.A N.A ARG 129.A O no hydrogen 3.110 N/A ARG 133.A N.B ARG 129.A O no hydrogen 3.097 N/A ARG 133.A N.B TYR 130.A O no hydrogen 3.100 N/A VAL 134.A N TYR 130.A O no hydrogen 3.056 N/A GLN 135.A NE2 GLU 17.A O no hydrogen 3.046 N/A LYS 136.A N GLY 132.A O no hydrogen 2.849 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.871 N/A ARG 139.A NE VAL 34.A O no hydrogen 2.894 N/A ARG 139.A NH1 LEU 301.A O no hydrogen 2.873 N/A ARG 139.A NH2 VAL 34.A O no hydrogen 2.807 N/A ARG 139.A NH2 LEU 301.A O no hydrogen 2.971 N/A ALA 140.A N LYS 136.A O no hydrogen 2.886 N/A ASN 141.A N GLU 137.A O no hydrogen 2.799 N/A ALA 142.A N GLU 138.A O no hydrogen 3.071 N/A LEU 143.A N ARG 139.A O no hydrogen 3.260 N/A ALA 144.A N ALA 140.A O no hydrogen 2.946 N/A ASN 145.A N.A ASN 141.A O no hydrogen 2.943 N/A ASN 145.A N.B ASN 141.A O no hydrogen 2.935 N/A GLN 147.A N ALA 144.A O no hydrogen 2.795 N/A GLN 147.A NE2 GLN 147.A O no hydrogen 3.464 N/A GLN 147.A NE2 ASP 151.A OD1 no hydrogen 2.875 N/A GLN 147.A NE2 ASP 151.A OD2 no hydrogen 3.421 N/A THR 148.A N ASN 145.A O.A no hydrogen 3.034 N/A THR 148.A N ASN 145.A O.B no hydrogen 3.043 N/A THR 148.A OG1 ASN 145.A O.A no hydrogen 3.119 N/A THR 148.A OG1 ASN 145.A O.B no hydrogen 3.139 N/A TYR 149.A OH LYS 294.A O no hydrogen 3.312 N/A LEU 150.A N ALA 146.A O no hydrogen 2.891 N/A ASP 151.A N GLN 147.A O no hydrogen 2.889 N/A GLU 152.A N THR 148.A O no hydrogen 2.955 N/A LEU 153.A N TYR 149.A O no hydrogen 3.047 N/A LYS 154.A N LEU 150.A O no hydrogen 2.950 N/A THR 155.A N ASP 151.A O no hydrogen 3.003 N/A THR 155.A OG1 ASP 151.A O no hydrogen 3.120 N/A PHE 156.A N GLU 152.A O no hydrogen 3.017 N/A VAL 157.A N LEU 153.A O no hydrogen 2.845 N/A ALA 158.A N LYS 154.A O no hydrogen 3.009 N/A SER 159.A N PHE 156.A O no hydrogen 2.963 N/A SER 159.A OG PHE 156.A O no hydrogen 2.617 N/A ILE 160.A N VAL 157.A O no hydrogen 3.006 N/A GLU 164.A N PRO 161.A O no hydrogen 2.872 N/A ARG 165.A N GLU 162.A O no hydrogen 3.306 N/A ARG 165.A NE ILE 160.A O no hydrogen 2.967 N/A ARG 165.A NH2 ILE 160.A O no hydrogen 3.181 N/A THR 166.A N TYR 283.A OH no hydrogen 3.009 N/A THR 166.A OG1 LEU 282.A O no hydrogen 2.784 N/A LYS 167.A N GLU 223.A OE2 no hydrogen 2.800 N/A LYS 167.A NZ TYR 220.A O no hydrogen 2.969 N/A LYS 167.A NZ ASP 221.A O no hydrogen 3.183 N/A VAL 168.A N ASN 196.A O no hydrogen 2.982 N/A TYR 169.A N VAL 224.A O no hydrogen 3.066 N/A TYR 169.A OH GLY 176.A O no hydrogen 2.728 N/A TYR 170.A OH ASP 265.A OD2 no hydrogen 2.795 N/A ALA 171.A N ILE 226.A O no hydrogen 2.761 N/A GLU 172.A N GLN 178.A O.A no hydrogen 2.812 N/A GLU 172.A N GLN 178.A O.B no hydrogen 2.793 N/A GLY 176.A N GLY 173.A O no hydrogen 3.454 N/A GLN 178.A N.A GLU 172.A O no hydrogen 3.376 N/A GLN 178.A N.B GLU 172.A O no hydrogen 3.356 N/A GLN 178.A NE2.A GLU 211.A OE1 no hydrogen 2.925 N/A THR 179.A N GLN 210.A O no hydrogen 2.897 N/A THR 179.A OG1 TYR 170.A O no hydrogen 2.717 N/A GLU 180.A N THR 179.A OG1 no hydrogen 2.741 N/A ASP 182.A N HIS 199.A O no hydrogen 2.845 N/A ARG 183.A N CYS 201.A O no hydrogen 3.344 N/A ARG 183.A NE ASP 182.A OD1 no hydrogen 3.219 N/A ARG 183.A NE ASP 182.A OD2 no hydrogen 3.155 N/A ARG 183.A NH2 ASP 182.A OD1 no hydrogen 2.964 N/A SER 184.A OG GLU 180.A OE1 no hydrogen 3.018 N/A SER 184.A OG GLN 203.A OE1 no hydrogen 3.300 N/A PHE 185.A N GLN 203.A OE1 no hydrogen 2.874 N/A HIS 186.A N SER 184.A OG no hydrogen 3.035 N/A HIS 186.A ND1 ASP 265.A OD1 no hydrogen 2.676 N/A HIS 186.A NE2 VAL 206.A O no hydrogen 2.790 N/A SER 187.A N SER 184.A O no hydrogen 3.191 N/A SER 187.A OG CYS 181.A O no hydrogen 2.764 N/A SER 187.A OG SER 184.A O no hydrogen 3.491 N/A LEU 190.A N SER 187.A O no hydrogen 2.910 N/A LEU 192.A N GLU 188.A O no hydrogen 2.895 N/A ALA 193.A N PRO 189.A O no hydrogen 2.942 N/A GLY 194.A N ALA 191.A O no hydrogen 3.035 N/A GLY 195.A N LEU 190.A O no hydrogen 2.966 N/A ASN 196.A N THR 166.A O no hydrogen 2.852 N/A VAL 198.A N VAL 168.A O no hydrogen 3.086 N/A HIS 199.A ND1 TYR 220.A OH no hydrogen 2.761 N/A LYS 200.A NZ ASN 196.A OD1 no hydrogen 2.833 N/A LYS 200.A NZ LEU 197.A O no hydrogen 2.760 N/A CYS 201.A N ASP 182.A OD1 no hydrogen 2.946 N/A GLN 203.A N ARG 183.A O no hydrogen 2.916 N/A GLN 203.A NE2 SER 205.A O no hydrogen 2.931 N/A GLN 203.A NE2 VAL 206.A O no hydrogen 3.308 N/A GLY 208.A N SER 205.A OG no hydrogen 3.130 N/A LEU 209.A N GLU 180.A OE2 no hydrogen 2.850 N/A GLN 210.A N THR 179.A O no hydrogen 2.752 N/A VAL 212.A N.A LEU 177.A O no hydrogen 3.009 N/A VAL 212.A N.B LEU 177.A O no hydrogen 3.017 N/A GLN 216.A N SER 213.A OG no hydrogen 3.016 N/A GLN 216.A NE2 GLN 216.A O no hydrogen 3.394 N/A ILE 217.A N SER 213.A O no hydrogen 3.138 N/A ILE 218.A N PHE 214.A O no hydrogen 3.084 N/A LEU 219.A N GLU 215.A O no hydrogen 3.157 N/A TYR 220.A N GLN 216.A O no hydrogen 2.922 N/A TYR 220.A OH HIS 199.A ND1 no hydrogen 2.761 N/A ASP 221.A N ILE 217.A O no hydrogen 3.120 N/A ASP 221.A N ILE 218.A O no hydrogen 3.180 N/A GLU 223.A N LYS 167.A O no hydrogen 2.904 N/A VAL 224.A N LYS 167.A O no hydrogen 3.090 N/A ILE 225.A N LYS 252.A O no hydrogen 2.932 N/A ILE 226.A N TYR 169.A O no hydrogen 3.013 N/A VAL 227.A N TYR 254.A O no hydrogen 2.825 N/A GLN 228.A N ALA 171.A O no hydrogen 3.206 N/A GLN 228.A NE2 TYR 170.A OH no hydrogen 3.033 N/A GLN 228.A NE2 ASN 262.A OD1 no hydrogen 3.425 N/A ASN 229.A ND2 ASP 174.A OD1 no hydrogen 3.004 N/A TYR 233.A N ASN 229.A O no hydrogen 3.097 N/A LYS 234.A N PRO 230.A O no hydrogen 3.164 N/A THR 235.A N THR 231.A O no hydrogen 3.005 N/A THR 235.A OG1 THR 231.A O no hydrogen 3.011 N/A VAL 236.A N PHE 232.A O no hydrogen 2.817 N/A PHE 237.A N LYS 234.A O no hydrogen 3.209 N/A ARG 238.A N LYS 234.A O no hydrogen 3.025 N/A ARG 238.A N THR 235.A O no hydrogen 3.024 N/A ARG 238.A NH2 THR 235.A OG1 no hydrogen 3.057 N/A GLU 239.A N THR 235.A O no hydrogen 2.815 N/A TRP 242.A N GLU 239.A O no hydrogen 3.375 N/A ALA 243.A N LYS 240.A O no hydrogen 2.995 N/A VAL 244.A N LYS 241.A O no hydrogen 3.444 N/A LEU 245.A N TRP 242.A O no hydrogen 3.082 N/A VAL 248.A N LEU 245.A O no hydrogen 3.040 N/A GLN 249.A N LEU 245.A O no hydrogen 3.058 N/A GLN 249.A NE2 ALA 243.A O no hydrogen 2.750 N/A ASN 250.A N LYS 246.A O no hydrogen 2.837 N/A LYS 251.A N VAL 248.A O no hydrogen 3.079 N/A LYS 252.A N ALA 247.A O no hydrogen 2.818 N/A TYR 254.A N ILE 225.A O no hydrogen 2.939 N/A VAL 256.A N VAL 227.A O no hydrogen 2.918 N/A LYS 258.A NZ GLN 228.A O no hydrogen 2.642 N/A LYS 258.A NZ GLN 228.A OE1 no hydrogen 3.559 N/A LYS 258.A NZ VAL 256.A O no hydrogen 2.753 N/A SER 259.A OG ASN 53.A O no hydrogen 3.480 N/A SER 259.A OG ASN 54.A OD1 no hydrogen 2.815 N/A ASN 262.A N ASN 52.A OD1 no hydrogen 2.862 N/A ASN 262.A ND2 ASP 51.A O no hydrogen 3.043 N/A ASN 262.A ND2 GLN 228.A OE1 no hydrogen 2.842 N/A TRP 263.A N PRO 257.A O no hydrogen 3.046 N/A TRP 263.A NE1 TYR 299.A OH no hydrogen 2.937 N/A THR 264.A N ASN 262.A OD1 no hydrogen 2.987 N/A ASP 265.A N ASN 262.A OD1 no hydrogen 3.057 N/A ARG 266.A N ASP 265.A OD1 no hydrogen 2.858 N/A ARG 266.A NE ASP 265.A OD2 no hydrogen 2.917 N/A ARG 266.A NH1 VAL 207.A O no hydrogen 2.821 N/A ARG 266.A NH2 GLU 172.A OE2 no hydrogen 2.868 N/A ARG 266.A NH2 VAL 207.A O no hydrogen 3.006 N/A ARG 271.A NE THR 264.A O no hydrogen 2.854 N/A ARG 271.A NH1 PHE 185.A O no hydrogen 2.931 N/A ARG 271.A NH2 PHE 185.A O no hydrogen 2.678 N/A ARG 271.A NH2 THR 264.A O no hydrogen 2.782 N/A ILE 272.A N PHE 270.A O no hydrogen 2.960 N/A ALA 275.A N ARG 271.A O no hydrogen 2.830 N/A HIS 276.A ND1 TYR 287.A OH no hydrogen 2.747 N/A HIS 276.A NE2 TYR 149.A O no hydrogen 2.806 N/A TRP 277.A N LEU 273.A O no hydrogen 2.979 N/A ILE 278.A N GLY 274.A O no hydrogen 2.878 N/A ALA 279.A N ALA 275.A O no hydrogen 2.890 N/A SER 280.A N HIS 276.A O no hydrogen 2.891 N/A SER 280.A OG TRP 277.A O no hydrogen 2.552 N/A LYS 281.A N TRP 277.A O no hydrogen 3.202 N/A LYS 281.A N ILE 278.A O no hydrogen 2.998 N/A LEU 282.A N ILE 278.A O no hydrogen 2.853 N/A TYR 283.A N ALA 279.A O no hydrogen 2.882 N/A TYR 283.A OH GLY 194.A O no hydrogen 2.591 N/A TYR 287.A N TYR 283.A O no hydrogen 2.804 N/A TYR 287.A OH HIS 276.A ND1 no hydrogen 2.747 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.764 N/A ASP 293.A N LYS 290.A O no hydrogen 3.066 N/A LYS 294.A N LYS 290.A O no hydrogen 3.174 N/A LYS 294.A NZ GLU 152.A OE1 no hydrogen 2.591 N/A VAL 295.A N ILE 291.A O no hydrogen 2.923 N/A LYS 296.A N GLU 292.A O no hydrogen 3.142 N/A LYS 296.A NZ LEU 307.A O no hydrogen 2.721 N/A ALA 297.A N ASP 293.A O no hydrogen 3.018 N/A PHE 298.A N LYS 294.A O no hydrogen 2.888 N/A TYR 299.A N VAL 295.A O no hydrogen 2.920 N/A TYR 299.A OH SER 259.A O no hydrogen 2.478 N/A GLN 300.A N LYS 296.A O no hydrogen 3.050 N/A LEU 301.A N ALA 297.A O no hydrogen 3.208 N/A PHE 302.A N PHE 298.A O no hydrogen 2.870 N/A PHE 303.A N TYR 299.A O no hydrogen 2.981 N/A VAL 305.A N TYR 299.A O no hydrogen 3.238 N/A SER 308.A N ASP 311.A OD2 no hydrogen 3.019 N/A ASP 311.A N SER 308.A OG no hydrogen 2.897 N/A LEU 312.A N SER 308.A O no hydrogen 3.077 N/A LYS 313.A N ASN 309.A O no hydrogen 3.200 N/A THR 314.A N GLU 310.A O no hydrogen 2.837 N/A THR 314.A OG1 GLU 310.A O no hydrogen 2.907 N/A TYR 315.A N ASP 311.A O no hydrogen 2.891 N/A PHE 316.A N LEU 312.A O no hydrogen 3.074 N/A LYS 317.A N LYS 313.A O no hydrogen 3.012 N/A LEU 318.A N LEU 312.A O no hydrogen 3.035 N/A