Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pdg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N MET 11.A O no hydrogen 2.829 N/A LEU 5.A N ALA 9.A O no hydrogen 2.832 N/A ASN 7.A ND2 LYS 153.A O no hydrogen 2.963 N/A GLY 8.A N LEU 5.A O no hydrogen 2.899 N/A ALA 9.A N ASN 7.A OD1 no hydrogen 2.960 N/A MET 11.A N ILE 3.A O no hydrogen 2.806 N/A ILE 13.A N SER 1.A O no hydrogen 2.957 N/A GLY 15.A N VAL 258.A O no hydrogen 2.947 N/A LEU 16.A N HIS 40.A O no hydrogen 2.815 N/A GLY 17.A N PRO 260.A O no hydrogen 2.986 N/A THR 18.A OG1 ASP 42.A O no hydrogen 2.701 N/A LYS 20.A NZ TRP 19.A O no hydrogen 2.804 N/A LYS 20.A NZ ASP 215.A OD1 no hydrogen 2.952 N/A LYS 20.A NZ ASP 215.A OD2 no hydrogen 3.040 N/A SER 21.A N THR 18.A O no hydrogen 3.166 N/A GLN 25.A N PRO 22.A O no hydrogen 2.876 N/A VAL 26.A N PRO 22.A O no hydrogen 2.954 N/A THR 27.A OG1 GLU 52.A O no hydrogen 2.737 N/A ALA 29.A N GLN 25.A O no hydrogen 3.028 N/A VAL 30.A N VAL 26.A O no hydrogen 2.956 N/A LYS 31.A N THR 27.A O no hydrogen 2.963 N/A VAL 32.A N GLU 28.A O no hydrogen 2.912 N/A ALA 33.A N ALA 29.A O no hydrogen 2.853 N/A ILE 34.A N VAL 30.A O no hydrogen 2.992 N/A ASP 35.A N LYS 31.A O no hydrogen 2.982 N/A VAL 36.A N VAL 32.A O no hydrogen 3.021 N/A VAL 36.A N ALA 33.A O no hydrogen 3.215 N/A GLY 37.A N ALA 33.A O no hydrogen 3.053 N/A GLY 37.A N ILE 34.A O no hydrogen 3.225 N/A TYR 38.A N ALA 33.A O no hydrogen 2.929 N/A TYR 38.A OH ILE 268.A O no hydrogen 2.747 N/A ARG 39.A NH1 ILE 34.A O no hydrogen 2.949 N/A ARG 39.A NH1 TYR 38.A O no hydrogen 2.806 N/A HIS 40.A ND1 PRO 12.A O no hydrogen 3.039 N/A ILE 41.A N PHE 72.A O no hydrogen 3.185 N/A ASP 42.A N LEU 16.A O no hydrogen 2.835 N/A CYS 43.A N VAL 74.A O no hydrogen 2.825 N/A TYR 47.A N ALA 44.A O no hydrogen 2.988 N/A GLN 48.A N HIS 45.A O no hydrogen 3.019 N/A GLU 52.A N GLU 52.A OE1 no hydrogen 2.792 N/A VAL 53.A N ASN 49.A O no hydrogen 2.916 N/A GLY 54.A N GLU 50.A O no hydrogen 2.854 N/A VAL 55.A N ASN 51.A O no hydrogen 2.964 N/A ALA 56.A N GLU 52.A O no hydrogen 3.374 N/A ILE 57.A N VAL 53.A O no hydrogen 3.095 N/A GLN 58.A N GLY 54.A O no hydrogen 2.870 N/A GLU 59.A N VAL 55.A O no hydrogen 2.957 N/A LYS 60.A N ALA 56.A O no hydrogen 3.072 N/A LYS 60.A NZ ASP 35.A OD1 no hydrogen 2.760 N/A LYS 60.A NZ ASP 35.A OD2 no hydrogen 3.135 N/A LYS 60.A NZ GLU 63.A OE1 no hydrogen 3.079 N/A LEU 61.A N ILE 57.A O no hydrogen 2.908 N/A ARG 62.A N GLN 58.A O no hydrogen 2.825 N/A ARG 62.A NE GLU 59.A OE1 no hydrogen 2.965 N/A ARG 62.A NE GLU 59.A OE2 no hydrogen 3.225 N/A ARG 62.A NH2 GLU 59.A OE2 no hydrogen 2.495 N/A GLU 63.A N GLU 59.A O no hydrogen 2.833 N/A GLN 64.A N LEU 61.A O no hydrogen 3.084 N/A VAL 65.A N LYS 60.A O no hydrogen 3.004 N/A LYS 67.A N GLU 70.A OE1 no hydrogen 3.010 N/A ARG 68.A NH1 ARG 68.A O no hydrogen 2.961 N/A ARG 68.A NH1 LEU 71.A O no hydrogen 3.195 N/A ARG 68.A NH1 ASP 104.A OD2 no hydrogen 2.937 N/A ARG 68.A NH2 TYR 102.A O no hydrogen 2.863 N/A ARG 68.A NH2 ASP 104.A OD2 no hydrogen 2.897 N/A GLU 70.A N LYS 67.A O no hydrogen 2.995 N/A LEU 71.A N ARG 68.A O no hydrogen 3.045 N/A PHE 72.A N ARG 39.A O no hydrogen 2.677 N/A ILE 73.A N ASP 104.A OD2 no hydrogen 2.854 N/A VAL 74.A N ILE 41.A O no hydrogen 3.050 N/A SER 75.A N LEU 105.A O no hydrogen 3.086 N/A SER 75.A OG GLU 50.A OE2 no hydrogen 2.644 N/A LYS 76.A N SER 75.A OG no hydrogen 2.671 N/A LYS 76.A NZ ASP 42.A OD1 no hydrogen 3.338 N/A LYS 76.A NZ ASP 42.A OD2 no hydrogen 2.643 N/A LYS 76.A NZ CYS 43.A O no hydrogen 2.847 N/A LYS 76.A NZ TYR 47.A OH no hydrogen 3.131 N/A LEU 77.A N LEU 107.A O no hydrogen 2.763 N/A TRP 78.A NE1 PHE 120.A O no hydrogen 2.802 N/A CYS 79.A SG THR 112.A O no hydrogen 3.241 N/A TYR 81.A N TRP 78.A O no hydrogen 3.068 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.805 N/A LEU 86.A N GLU 83.A O no hydrogen 2.794 N/A LYS 88.A NZ GLU 149.A OE2 no hydrogen 3.445 N/A ALA 90.A N LEU 86.A O no hydrogen 3.085 N/A CYS 91.A N VAL 87.A O no hydrogen 2.966 N/A GLN 92.A N LYS 88.A O no hydrogen 2.852 N/A LYS 93.A N GLY 89.A O no hydrogen 2.848 N/A LYS 93.A NZ ASP 97.A OD1 no hydrogen 2.806 N/A LYS 93.A NZ ASP 97.A OD2 no hydrogen 3.250 N/A THR 94.A N ALA 90.A O no hydrogen 3.223 N/A THR 94.A OG1 GLU 50.A OE1 no hydrogen 2.722 N/A LEU 95.A N CYS 91.A O no hydrogen 2.836 N/A SER 96.A N GLN 92.A O no hydrogen 2.809 N/A SER 96.A OG.B GLN 92.A O no hydrogen 3.136 N/A ASP 97.A N LYS 93.A O no hydrogen 2.817 N/A LEU 98.A N THR 94.A O no hydrogen 2.858 N/A LYS 99.A N SER 96.A O no hydrogen 3.261 N/A LYS 99.A NZ ASN 51.A O no hydrogen 2.952 N/A LYS 99.A NZ ASP 97.A O no hydrogen 2.728 N/A LEU 100.A N LEU 95.A O no hydrogen 2.968 N/A LEU 103.A N LEU 151.A O no hydrogen 2.912 N/A ASP 104.A N ILE 73.A O no hydrogen 2.927 N/A LEU 105.A N ILE 73.A O no hydrogen 3.410 N/A TYR 106.A N ALA 154.A O no hydrogen 2.922 N/A LEU 107.A N SER 75.A O no hydrogen 2.955 N/A ILE 108.A N GLY 156.A O no hydrogen 2.877 N/A HIS 109.A N LEU 77.A O no hydrogen 3.177 N/A PHE 114.A N CYS 79.A O no hydrogen 2.793 N/A LYS 115.A N VAL 130.A O no hydrogen 2.904 N/A ASP 124.A N ASN 128.A O no hydrogen 2.883 N/A SER 126.A N ASP 124.A OD1 no hydrogen 3.094 N/A GLY 127.A N ASP 124.A O no hydrogen 2.994 N/A ASN 128.A N ASP 124.A OD1 no hydrogen 2.956 N/A ASN 128.A ND2 ASP 124.A OD1 no hydrogen 3.440 N/A ASN 128.A ND2 ASP 124.A OD2 no hydrogen 3.403 N/A VAL 129.A N SER 301.A O no hydrogen 2.931 N/A VAL 130.A N PRO 122.A O no hydrogen 2.830 N/A SER 132.A N GLY 113.A O no hydrogen 2.892 N/A SER 132.A OG THR 134.A OG1 no hydrogen 2.772 N/A THR 134.A OG1 SER 132.A OG no hydrogen 2.772 N/A THR 139.A N ASN 135.A O no hydrogen 3.193 N/A THR 139.A OG1 HIS 82.A O no hydrogen 3.185 N/A THR 139.A OG1 ASN 135.A O no hydrogen 3.090 N/A TRP 140.A N ILE 136.A O no hydrogen 2.867 N/A TRP 140.A NE1 TYR 176.A O no hydrogen 2.874 N/A ALA 141.A N LEU 137.A O no hydrogen 3.079 N/A ALA 142.A N ASP 138.A O no hydrogen 3.005 N/A MET 143.A N THR 139.A O no hydrogen 2.905 N/A GLU 144.A N TRP 140.A O no hydrogen 2.890 N/A GLU 145.A N ALA 141.A O no hydrogen 3.167 N/A VAL 147.A N MET 143.A O no hydrogen 3.465 N/A ASP 148.A N GLU 144.A O no hydrogen 3.178 N/A GLU 149.A N LEU 146.A O no hydrogen 3.324 N/A GLY 150.A N VAL 147.A O no hydrogen 3.077 N/A LEU 151.A N LEU 146.A O no hydrogen 3.062 N/A LYS 153.A N LEU 103.A O no hydrogen 2.835 N/A GLY 156.A N TYR 106.A O no hydrogen 2.919 N/A ILE 157.A N VAL 180.A O no hydrogen 2.913 N/A SER 158.A OG HIS 109.A O no hydrogen 3.437 N/A SER 158.A OG GLN 182.A O no hydrogen 2.735 N/A ASN 159.A N GLN 182.A O no hydrogen 3.006 N/A ASN 159.A ND2 HIS 109.A O no hydrogen 2.893 N/A ASN 161.A N GLN 164.A OE1 no hydrogen 2.854 N/A ASN 161.A ND2 PRO 309.A O no hydrogen 3.014 N/A HIS 162.A N PHE 314.A OXT no hydrogen 2.766 N/A HIS 162.A ND1 PHE 314.A O no hydrogen 3.099 N/A GLN 164.A N ASN 161.A OD1 no hydrogen 2.898 N/A GLN 164.A NE2 ASP 307.A O no hydrogen 2.957 N/A VAL 165.A N ASN 161.A O no hydrogen 2.909 N/A GLU 166.A N HIS 162.A O no hydrogen 2.887 N/A MET 167.A N LEU 163.A O no hydrogen 2.902 N/A ILE 168.A N GLN 164.A O no hydrogen 3.151 N/A LEU 169.A N VAL 165.A O no hydrogen 2.859 N/A ASN 170.A N GLU 166.A O no hydrogen 2.861 N/A ASN 170.A N MET 167.A O no hydrogen 3.235 N/A LYS 171.A N ILE 168.A O no hydrogen 2.920 N/A LYS 171.A NZ PRO 172.A O no hydrogen 3.134 N/A LEU 174.A N LYS 171.A O no hydrogen 3.079 N/A LYS 175.A N GLU 144.A OE2 no hydrogen 2.741 N/A LYS 175.A NZ ASP 148.A OD2 no hydrogen 2.763 N/A TYR 176.A N GLU 144.A OE2 no hydrogen 2.958 N/A TYR 176.A OH ASP 148.A OD1 no hydrogen 2.538 N/A ALA 179.A N ILE 155.A O no hydrogen 2.823 N/A ASN 181.A N VAL 204.A O no hydrogen 2.961 N/A GLN 182.A N ILE 157.A O no hydrogen 3.021 N/A GLN 182.A NE2 ASP 42.A OD1 no hydrogen 2.949 N/A ILE 183.A N THR 206.A O no hydrogen 2.821 N/A CYS 185.A N TYR 208.A O no hydrogen 3.097 N/A CYS 185.A SG LEU 189.A O no hydrogen 3.852 N/A CYS 185.A SG THR 190.A O no hydrogen 3.677 N/A HIS 186.A N LEU 189.A O no hydrogen 3.174 N/A HIS 186.A NE2 TRP 294.A O no hydrogen 3.222 N/A TYR 188.A OH ASP 229.A OD2 no hydrogen 2.641 N/A LEU 189.A N HIS 186.A O no hydrogen 2.911 N/A THR 190.A N ASN 291.A OD1 no hydrogen 3.028 N/A THR 190.A OG1 GLU 192.A OE1 no hydrogen 2.774 N/A GLN 191.A NE2 GLU 184.A O no hydrogen 2.830 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.814 N/A ILE 195.A N GLN 191.A O no hydrogen 3.034 N/A GLN 196.A N GLU 192.A O no hydrogen 3.072 N/A TYR 197.A N LYS 193.A O no hydrogen 3.134 N/A CYS 198.A N LEU 194.A O no hydrogen 2.958 N/A CYS 198.A SG ASN 181.A OD1 no hydrogen 3.693 N/A CYS 198.A SG LEU 194.A O no hydrogen 3.437 N/A GLN 199.A N ILE 195.A O no hydrogen 2.801 N/A SER 200.A N GLN 196.A O no hydrogen 2.810 N/A SER 200.A OG GLN 196.A O no hydrogen 3.435 N/A SER 200.A OG TYR 197.A O no hydrogen 2.794 N/A LYS 201.A N TYR 197.A O no hydrogen 3.249 N/A LYS 201.A N CYS 198.A O no hydrogen 2.991 N/A GLY 202.A N GLN 199.A O no hydrogen 2.891 N/A ILE 203.A N CYS 198.A O no hydrogen 3.052 N/A VAL 204.A N ALA 179.A O no hydrogen 3.028 N/A THR 206.A N ASN 181.A O no hydrogen 3.033 N/A ALA 207.A N VAL 257.A O no hydrogen 2.740 N/A TYR 208.A N ILE 183.A O no hydrogen 2.848 N/A TYR 208.A OH ASN 159.A OD1 no hydrogen 2.642 N/A GLY 212.A N SER 209.A O no hydrogen 2.952 N/A ARG 216.A N SER 213.A O no hydrogen 2.899 N/A ARG 216.A NH1 SER 213.A O no hydrogen 3.047 N/A ARG 216.A NH2 ASP 223.A OD1 no hydrogen 2.813 N/A TRP 218.A NE1 VAL 296.A O no hydrogen 2.841 N/A ALA 219.A N ARG 216.A O no hydrogen 3.152 N/A LYS 220.A N ASP 223.A OD1 no hydrogen 2.961 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.495 N/A ASP 223.A N LYS 220.A O no hydrogen 2.962 N/A GLU 228.A N SER 225.A O no hydrogen 3.201 N/A GLU 228.A N SER 225.A OG no hydrogen 3.147 N/A ASP 229.A N LEU 226.A O no hydrogen 3.127 N/A ARG 231.A N ASP 229.A OD1 no hydrogen 2.843 N/A ARG 231.A NE ASP 229.A OD1 no hydrogen 2.997 N/A ARG 231.A NE ASP 229.A OD2 no hydrogen 3.408 N/A ARG 231.A NH2 ASP 229.A OD2 no hydrogen 2.789 N/A ILE 232.A N ASP 229.A O no hydrogen 2.989 N/A LYS 233.A N ASP 229.A O no hydrogen 2.933 N/A ALA 234.A N PRO 230.A O no hydrogen 2.990 N/A ILE 235.A N ARG 231.A O no hydrogen 3.288 N/A ALA 236.A N ILE 232.A O no hydrogen 2.902 N/A ALA 237.A N LYS 233.A O no hydrogen 2.821 N/A LYS 238.A N ALA 234.A O no hydrogen 3.071 N/A LYS 238.A NZ ASP 283.A OD1 no hydrogen 2.722 N/A HIS 239.A N ILE 235.A O no hydrogen 3.285 N/A HIS 239.A N ALA 236.A O no hydrogen 3.025 N/A HIS 239.A NE2 ASP 283.A OD2 no hydrogen 2.642 N/A ASN 240.A N ALA 237.A O no hydrogen 3.143 N/A LYS 241.A N ALA 236.A O no hydrogen 2.965 N/A LYS 241.A NZ GLN 245.A OE1.B no hydrogen 2.798 N/A LYS 241.A NZ LYS 273.A O no hydrogen 2.771 N/A LYS 241.A NZ ASP 276.A OD1 no hydrogen 3.375 N/A LYS 241.A NZ ASP 276.A OD2 no hydrogen 2.856 N/A THR 242.A N GLN 245.A OE1.A no hydrogen 2.745 N/A THR 242.A OG1 GLU 270.A OE2 no hydrogen 2.674 N/A THR 243.A OG1.A LEU 227.A O no hydrogen 3.492 N/A GLN 245.A N THR 242.A OG1 no hydrogen 3.105 N/A GLN 245.A NE2.A GLU 270.A O no hydrogen 2.849 N/A GLN 245.A NE2.B THR 242.A OG1 no hydrogen 3.081 N/A VAL 246.A N THR 242.A O no hydrogen 3.044 N/A LEU 247.A N THR 243.A O no hydrogen 2.855 N/A ILE 248.A N ALA 244.A O no hydrogen 2.943 N/A ARG 249.A N GLN 245.A O no hydrogen 2.952 N/A ARG 249.A NE GLN 253.A OE1 no hydrogen 2.804 N/A ARG 249.A NH1 VAL 274.A O no hydrogen 2.893 N/A ARG 249.A NH2 GLN 253.A OE1 no hydrogen 3.540 N/A PHE 250.A N VAL 246.A O no hydrogen 2.999 N/A GLN 253.A N ARG 249.A O no hydrogen 3.080 N/A GLN 253.A N PHE 250.A O no hydrogen 3.171 N/A GLN 253.A NE2 LEU 279.A O no hydrogen 2.860 N/A ARG 254.A N PRO 251.A O no hydrogen 2.981 N/A ARG 254.A NH1 THR 190.A O no hydrogen 2.983 N/A ARG 254.A NH2 THR 190.A O no hydrogen 2.922 N/A ASN 255.A N MET 252.A O no hydrogen 3.151 N/A LEU 256.A N PRO 251.A O no hydrogen 3.122 N/A VAL 257.A N VAL 205.A O no hydrogen 2.962 N/A VAL 258.A N ILE 13.A O no hydrogen 2.745 N/A ILE 259.A N ALA 207.A O no hydrogen 3.390 N/A LYS 261.A NZ ASP 215.A OD2 no hydrogen 2.868 N/A SER 262.A OG THR 264.A O no hydrogen 3.481 N/A THR 264.A N SER 262.A OG no hydrogen 2.967 N/A ILE 268.A N THR 264.A O no hydrogen 2.871 N/A ALA 269.A N PRO 265.A O no hydrogen 3.129 N/A GLU 270.A N GLU 266.A O no hydrogen 2.945 N/A ASN 271.A N ARG 267.A O no hydrogen 2.890 N/A PHE 272.A N ALA 269.A O no hydrogen 3.130 N/A LYS 273.A N GLU 270.A O no hydrogen 2.991 N/A VAL 274.A N PHE 272.A O no hydrogen 2.861 N/A LEU 279.A N GLN 253.A OE1 no hydrogen 2.826 N/A SER 280.A N ASP 283.A OD2 no hydrogen 3.017 N/A ASP 283.A N SER 280.A OG no hydrogen 2.856 N/A MET 284.A N SER 280.A O no hydrogen 2.923 N/A THR 285.A N SER 281.A O no hydrogen 2.967 N/A THR 285.A OG1 SER 281.A O no hydrogen 3.327 N/A THR 286.A N GLN 282.A O no hydrogen 2.886 N/A THR 286.A OG1 GLN 282.A O no hydrogen 2.649 N/A LEU 287.A N ASP 283.A O no hydrogen 2.848 N/A LEU 288.A N MET 284.A O no hydrogen 2.954 N/A SER 289.A N THR 285.A O no hydrogen 2.964 N/A SER 289.A N THR 286.A O no hydrogen 2.953 N/A SER 289.A OG THR 286.A O no hydrogen 2.651 N/A TYR 290.A N LEU 287.A O no hydrogen 3.121 N/A ASN 291.A N LEU 288.A O no hydrogen 3.280 N/A ASN 291.A ND2 ASN 293.A OD1 no hydrogen 2.849 N/A ARG 292.A N TYR 188.A O no hydrogen 2.947 N/A ASN 293.A N ASN 291.A OD1 no hydrogen 3.289 N/A TRP 294.A N TYR 188.A O no hydrogen 2.958 N/A VAL 296.A N GLU 184.A OE2 no hydrogen 2.677 N/A CYS 297.A N GLU 184.A OE1 no hydrogen 2.909 N/A CYS 302.A N LEU 299.A O no hydrogen 2.991 N/A THR 303.A N LEU 300.A O no hydrogen 3.109 N/A THR 303.A OG1 LEU 300.A O no hydrogen 2.842 N/A HIS 305.A N CYS 302.A O no hydrogen 3.050 N/A HIS 305.A NE2 GLY 113.A O no hydrogen 2.702 N/A LYS 306.A NZ ASP 307.A OD2 no hydrogen 2.962 N/A ASP 307.A N HIS 305.A ND1 no hydrogen 3.002 N/A TYR 308.A N HIS 305.A O no hydrogen 2.997 N/A