Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8v84_n.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N TYR 31.A O no hydrogen 2.617 N/A GLN 6.A N THR 3.A OG1 no hydrogen 3.334 N/A ALA 7.A N THR 3.A O no hydrogen 2.906 N/A VAL 8.A N ARG 4.A O no hydrogen 2.896 N/A ARG 9.A N SER 5.A O no hydrogen 2.895 N/A LYS 10.A N GLN 6.A O no hydrogen 2.902 N/A LYS 10.A NZ GLN 37.A OE1 no hydrogen 2.643 N/A LEU 11.A N ALA 7.A O no hydrogen 2.907 N/A GLN 12.A N VAL 8.A O no hydrogen 2.901 N/A GLN 12.A N ARG 9.A O no hydrogen 3.299 N/A PHE 18.A N SER 14.A O no hydrogen 2.900 N/A ARG 19.A N LEU 15.A O no hydrogen 2.902 N/A ARG 20.A N ALA 16.A O no hydrogen 2.937 N/A ARG 20.A NH2 ASP 17.A OD1 no hydrogen 2.479 N/A LEU 21.A N ASP 17.A O no hydrogen 2.902 N/A CYS 22.A N PHE 18.A O no hydrogen 2.914 N/A CYS 22.A SG PHE 18.A O no hydrogen 3.330 N/A ILE 23.A N ARG 19.A O no hydrogen 2.911 N/A PHE 24.A N ARG 20.A O no hydrogen 2.923 N/A LYS 25.A N LEU 21.A O no hydrogen 2.903 N/A LYS 25.A NZ GLU 42.A OE1 no hydrogen 2.634 N/A LYS 25.A NZ GLU 88.A OE1 no hydrogen 2.537 N/A LYS 25.A NZ GLU 88.A OE2 no hydrogen 3.346 N/A GLY 26.A N CYS 22.A O no hydrogen 2.885 N/A ILE 27.A N CYS 22.A O no hydrogen 3.344 N/A TYR 31.A N ILE 2.A O no hydrogen 2.618 N/A ILE 36.A N TYR 32.A O no hydrogen 2.921 N/A GLN 37.A N ALA 33.A O no hydrogen 2.900 N/A TYR 38.A N LYS 34.A O no hydrogen 2.889 N/A TYR 38.A OH GLU 88.A OE2 no hydrogen 2.548 N/A LEU 39.A N ASP 35.A O no hydrogen 2.916 N/A MET 40.A N ILE 36.A O no hydrogen 2.887 N/A HIS 41.A N GLN 37.A O no hydrogen 2.900 N/A HIS 41.A ND1 GLN 37.A O no hydrogen 2.285 N/A GLU 42.A N TYR 38.A O no hydrogen 2.930 N/A GLU 42.A N LEU 39.A O no hydrogen 3.166 N/A LEU 45.A N GLU 42.A O no hydrogen 3.437 N/A LYS 47.A N PRO 43.A O no hydrogen 3.404 N/A LYS 47.A NZ ASP 78.A OD2 no hydrogen 3.415 N/A PHE 48.A N VAL 44.A O no hydrogen 2.922 N/A ARG 49.A N LEU 45.A O no hydrogen 2.967 N/A ARG 49.A NH1 GLN 12.A O no hydrogen 2.972 N/A ARG 49.A NH2 LEU 11.A O no hydrogen 2.325 N/A GLU 50.A N ALA 46.A O no hydrogen 2.900 N/A HIS 51.A N LYS 47.A O no hydrogen 2.875 N/A LYS 52.A N PHE 48.A O no hydrogen 2.964 N/A THR 53.A N ARG 49.A O no hydrogen 2.971 N/A THR 53.A OG1 ARG 49.A O no hydrogen 3.145 N/A PHE 54.A N GLU 50.A O no hydrogen 2.875 N/A ALA 55.A N HIS 51.A O no hydrogen 2.883 N/A ARG 56.A N LYS 52.A O no hydrogen 2.993 N/A LYS 57.A N THR 53.A O no hydrogen 2.950 N/A LEU 58.A N PHE 54.A O no hydrogen 2.873 N/A THR 59.A N ALA 55.A O no hydrogen 2.919 N/A THR 59.A OG1 ALA 55.A O no hydrogen 2.678 N/A ARG 60.A N ARG 56.A O no hydrogen 2.940 N/A ALA 61.A N LYS 57.A O no hydrogen 2.933 N/A LEU 62.A N LEU 58.A O no hydrogen 2.925 N/A GLY 63.A N THR 59.A O no hydrogen 2.896 N/A ARG 64.A N ARG 60.A O no hydrogen 2.925 N/A ARG 64.A NE GLU 66.A OE2 no hydrogen 3.047 N/A GLY 65.A N LEU 62.A O no hydrogen 3.115 N/A GLU 66.A N ALA 61.A O no hydrogen 3.009 N/A ALA 70.A N GLU 66.A O no hydrogen 2.909 N/A LYS 71.A N VAL 67.A O no hydrogen 2.897 N/A ARG 72.A N SER 68.A O no hydrogen 2.924 N/A LEU 73.A N SER 69.A O no hydrogen 2.886 N/A GLU 74.A N ALA 70.A O no hydrogen 2.920 N/A GLU 75.A N LYS 71.A O no hydrogen 2.916 N/A ASN 76.A N ARG 72.A O no hydrogen 2.904 N/A ILE 86.A N LEU 82.A O no hydrogen 2.884 N/A LYS 87.A N ASP 83.A O no hydrogen 2.926 N/A GLU 88.A N HIS 84.A O no hydrogen 2.892 N/A ARG 89.A N ILE 85.A O no hydrogen 2.914 N/A TYR 90.A N ILE 86.A O no hydrogen 2.902 N/A TYR 90.A OH ASP 99.A OD2 no hydrogen 2.403 N/A ALA 96.A N SER 92.A O no hydrogen 2.931 N/A ILE 97.A N PHE 93.A O no hydrogen 2.905 N/A ARG 98.A N PRO 94.A O no hydrogen 2.872 N/A ARG 98.A NE PRO 94.A O no hydrogen 2.870 N/A ASP 99.A N ASP 95.A O no hydrogen 2.933 N/A ASP 99.A N ALA 96.A O no hydrogen 3.167 N/A ASP 102.A N ASP 101.A OD1 no hydrogen 2.496 N/A LEU 104.A N ILE 100.A O no hydrogen 2.890 N/A ASN 105.A N ASP 101.A O no hydrogen 2.953 N/A MET 106.A N ASP 102.A O no hydrogen 2.908 N/A LEU 107.A N ALA 103.A O no hydrogen 2.897 N/A PHE 108.A N LEU 104.A O no hydrogen 2.934 N/A LEU 109.A N ASN 105.A O no hydrogen 2.942 N/A PHE 110.A N MET 106.A O no hydrogen 2.901 N/A SER 111.A N LEU 107.A O no hydrogen 2.894 N/A SER 111.A OG LEU 107.A O no hydrogen 3.160 N/A SER 111.A OG PHE 108.A O no hydrogen 2.614 N/A ASN 112.A N PHE 108.A O no hydrogen 2.937 N/A ASN 112.A ND2 PHE 171.A O no hydrogen 3.057 N/A ASN 112.A ND2 GLU 175.A OE2 no hydrogen 2.488 N/A LEU 113.A N LEU 109.A O no hydrogen 2.916 N/A SER 115.A OG SER 121.A OG no hydrogen 2.828 N/A THR 116.A N VAL 119.A O no hydrogen 3.148 N/A ASN 117.A N THR 116.A OG1 no hydrogen 2.545 N/A SER 121.A OG SER 115.A OG no hydrogen 2.828 N/A ILE 123.A N SER 120.A OG no hydrogen 3.309 N/A ILE 124.A N SER 120.A O no hydrogen 2.957 N/A ASN 125.A N SER 121.A O no hydrogen 2.865 N/A ASP 126.A N LYS 122.A O no hydrogen 2.922 N/A ALA 127.A N ILE 123.A O no hydrogen 2.932 N/A GLN 128.A N ILE 124.A O no hydrogen 2.897 N/A GLN 128.A NE2 ASN 132.A OD1 no hydrogen 2.923 N/A LYS 129.A N ASN 125.A O no hydrogen 2.885 N/A ILE 130.A N ASP 126.A O no hydrogen 2.950 N/A CYS 131.A N ALA 127.A O no hydrogen 2.922 N/A CYS 131.A SG ALA 127.A O no hydrogen 3.148 N/A ASN 132.A N GLN 128.A O no hydrogen 2.874 N/A GLN 133.A N LYS 129.A O no hydrogen 2.916 N/A TRP 134.A N ILE 130.A O no hydrogen 2.950 N/A LEU 135.A N CYS 131.A O no hydrogen 2.907 N/A ALA 136.A N ASN 132.A O no hydrogen 2.871 N/A TYR 137.A N GLN 133.A O no hydrogen 2.940 N/A VAL 138.A N TRP 134.A O no hydrogen 2.934 N/A ALA 139.A N LEU 135.A O no hydrogen 2.885 N/A LYS 140.A N ALA 136.A O no hydrogen 2.889 N/A GLU 141.A N TYR 137.A O no hydrogen 2.943 N/A ARG 142.A N VAL 138.A O no hydrogen 2.893 N/A ARG 142.A N ALA 139.A O no hydrogen 3.279 N/A ARG 142.A NE SER 267.A O no hydrogen 3.449 N/A ARG 142.A NH2 ALA 242.A O no hydrogen 2.359 N/A ARG 145.A N GLN 157.A O no hydrogen 2.885 N/A ARG 145.A NH1 VAL 144.A O no hydrogen 2.782 N/A LYS 146.A N GLN 157.A O no hydrogen 2.917 N/A LYS 146.A NZ ASN 314.A O no hydrogen 3.245 N/A PHE 148.A N TYR 155.A O no hydrogen 2.927 N/A SER 150.A N GLY 153.A O no hydrogen 2.848 N/A SER 150.A OG GLY 153.A O no hydrogen 3.120 N/A GLY 153.A N SER 150.A OG no hydrogen 3.323 N/A VAL 154.A N VAL 169.A O no hydrogen 2.915 N/A TYR 155.A N PHE 148.A O no hydrogen 2.847 N/A TYR 156.A N TRP 167.A O no hydrogen 2.906 N/A GLN 157.A N LYS 146.A O no hydrogen 2.886 N/A ALA 158.A N VAL 165.A O no hydrogen 2.918 N/A ASN 159.A N LEU 143.A O no hydrogen 2.968 N/A ILE 160.A N GLU 163.A O no hydrogen 2.670 N/A GLU 163.A N ILE 160.A O no hydrogen 3.056 N/A VAL 165.A N ALA 158.A O no hydrogen 2.884 N/A TRP 167.A N TYR 156.A O no hydrogen 2.910 N/A LEU 168.A N ASN 105.A OD1 no hydrogen 2.880 N/A VAL 169.A N VAL 154.A O no hydrogen 2.877 N/A LYS 172.A NZ ASP 259.A OD2 no hydrogen 3.063 N/A SER 179.A OG SER 179.A O no hydrogen 2.579 N/A ARG 184.A N ASP 182.A OD1 no hydrogen 3.296 N/A ARG 184.A NE ASP 182.A OD1 no hydrogen 3.215 N/A ARG 184.A NE ASP 182.A OD2 no hydrogen 3.028 N/A ARG 184.A NH2 ASP 182.A OD2 no hydrogen 3.085 N/A LEU 187.A N PHE 183.A O no hydrogen 2.869 N/A THR 188.A N ARG 184.A O no hydrogen 2.944 N/A THR 188.A OG1 ARG 184.A O no hydrogen 2.967 N/A PHE 189.A N ILE 185.A O no hydrogen 2.930 N/A LEU 190.A N MET 186.A O no hydrogen 2.828 N/A GLU 191.A N LEU 187.A O no hydrogen 2.920 N/A PHE 192.A N THR 188.A O no hydrogen 3.011 N/A TYR 193.A N PHE 189.A O no hydrogen 2.843 N/A SER 194.A N LEU 190.A O no hydrogen 2.826 N/A SER 194.A OG LEU 190.A O no hydrogen 2.564 N/A THR 195.A N GLU 191.A O no hydrogen 2.992 N/A THR 195.A OG1 GLU 191.A O no hydrogen 3.082 N/A LEU 196.A N PHE 192.A O no hydrogen 2.958 N/A LEU 197.A N TYR 193.A O no hydrogen 2.835 N/A HIS 198.A N SER 194.A O no hydrogen 2.879 N/A PHE 199.A N THR 195.A O no hydrogen 3.037 N/A VAL 200.A N LEU 196.A O no hydrogen 2.910 N/A LEU 201.A N LEU 197.A O no hydrogen 2.816 N/A TYR 202.A N HIS 198.A O no hydrogen 2.945 N/A LYS 203.A N PHE 199.A O no hydrogen 2.923 N/A LEU 204.A N VAL 200.A O no hydrogen 2.903 N/A TYR 205.A N LEU 201.A O no hydrogen 2.891 N/A THR 206.A N TYR 202.A O no hydrogen 2.916 N/A THR 206.A OG1 TYR 202.A O no hydrogen 2.926 N/A THR 206.A OG1 LYS 203.A O no hydrogen 2.644 N/A ASP 207.A N LYS 203.A O no hydrogen 2.887 N/A SER 208.A N LEU 204.A O no hydrogen 2.909 N/A SER 208.A OG GLU 141.A OE2 no hydrogen 3.430 N/A GLY 209.A N THR 206.A O no hydrogen 3.089 N/A ILE 211.A N GLU 233.A O no hydrogen 2.791 N/A TYR 212.A OH GLN 133.A OE1 no hydrogen 3.342 N/A TYR 212.A OH HIS 198.A ND1 no hydrogen 3.219 N/A LYS 219.A NZ ASP 217.A OD2 no hydrogen 2.407 N/A ASP 221.A N ASP 217.A O no hydrogen 2.895 N/A LYS 222.A N LEU 218.A O no hydrogen 2.914 N/A ILE 223.A N LYS 219.A O no hydrogen 2.908 N/A ILE 224.A N LYS 220.A O no hydrogen 2.902 N/A SER 228.A N GLU 262.A OE2 no hydrogen 3.250 N/A SER 229.A OG ILE 224.A O no hydrogen 2.905 N/A SER 229.A OG GLY 226.A O no hydrogen 3.464 N/A ILE 231.A N LYS 215.A O no hydrogen 3.208 N/A SER 234.A OG GLY 209.A O no hydrogen 3.405 N/A ARG 235.A N SER 234.A OG no hydrogen 2.564 N/A SER 243.A OG PRO 240.A O no hydrogen 2.722 N/A LEU 244.A N VAL 241.A O no hydrogen 3.212 N/A SER 246.A OG SER 243.A O no hydrogen 3.247 N/A VAL 249.A N THR 285.A OG1 no hydrogen 3.122 N/A PHE 250.A N ASN 271.A O no hydrogen 2.881 N/A TYR 251.A N HIS 286.A O no hydrogen 2.886 N/A VAL 252.A N ILE 273.A O no hydrogen 2.932 N/A SER 253.A N ILE 288.A O no hydrogen 2.924 N/A SER 253.A OG GLU 255.A OE1 no hydrogen 2.669 N/A SER 253.A OG GLU 255.A OE2 no hydrogen 2.938 N/A GLU 255.A N GLU 255.A OE1 no hydrogen 2.689 N/A LEU 261.A N PRO 257.A O no hydrogen 2.957 N/A GLU 262.A N ILE 258.A O no hydrogen 2.857 N/A PHE 263.A N ASP 259.A O no hydrogen 2.925 N/A LEU 264.A N ILE 260.A O no hydrogen 2.954 N/A ILE 265.A N LEU 261.A O no hydrogen 2.902 N/A LEU 266.A N GLU 262.A O no hydrogen 2.909 N/A SER 267.A N PHE 263.A O no hydrogen 2.901 N/A CYS 268.A N LEU 264.A O no hydrogen 2.904 N/A CYS 268.A SG VAL 241.A O no hydrogen 3.252 N/A GLY 269.A N LEU 266.A O no hydrogen 3.413 N/A GLY 270.A N ILE 265.A O no hydrogen 2.941 N/A ASN 271.A N PHE 248.A O no hydrogen 2.907 N/A ILE 273.A N PHE 250.A O no hydrogen 2.891 N/A MET 278.A N GLU 275.A O no hydrogen 3.322 N/A ASP 279.A N ALA 276.A O no hydrogen 3.120 N/A THR 285.A N VAL 249.A O no hydrogen 2.954 N/A THR 285.A OG1 VAL 249.A O no hydrogen 2.608 N/A THR 285.A OG1 HIS 286.A ND1 no hydrogen 2.884 N/A HIS 286.A N VAL 249.A O no hydrogen 2.923 N/A HIS 286.A ND1 THR 285.A OG1 no hydrogen 2.884 N/A GLN 287.A N THR 302.A O no hydrogen 2.874 N/A ILE 288.A N TYR 251.A O no hydrogen 2.879 N/A VAL 289.A N ILE 304.A O no hydrogen 2.923 N/A ASP 290.A N GLU 255.A OE2 no hydrogen 2.916 N/A ARG 301.A N VAL 298.A O no hydrogen 3.263 N/A THR 302.A N THR 285.A O no hydrogen 2.924 N/A ILE 304.A N GLN 287.A O no hydrogen 2.886 N/A GLN 307.A NE2 PRO 331.A O no hydrogen 2.570 N/A TRP 308.A N GLN 305.A O no hydrogen 3.094 N/A TRP 308.A NE1 VAL 319.A O no hydrogen 2.705 N/A ASP 311.A N GLN 307.A O no hydrogen 2.910 N/A CYS 312.A N TRP 308.A O no hydrogen 2.907 N/A CYS 312.A SG TRP 308.A O no hydrogen 3.139 N/A ILE 313.A N ILE 309.A O no hydrogen 2.911 N/A ASN 314.A N PHE 310.A O no hydrogen 2.928 N/A ASN 314.A ND2 VAL 147.A O no hydrogen 3.534 N/A ASN 314.A ND2 PHE 310.A O no hydrogen 2.340 N/A LYS 315.A N ASP 311.A O no hydrogen 2.885 N/A GLY 316.A N CYS 312.A O no hydrogen 2.896 N/A TYR 324.A N ALA 321.A O no hydrogen 3.267 N/A TYR 324.A OH ASP 311.A OD2 no hydrogen 2.295 N/A GLU 328.A N LEU 325.A O no hydrogen 3.020 N/A SER 335.A OG TRP 337.A O no hydrogen 2.748 N/A TRP 337.A NE1 GLN 157.A OE1 no hydrogen 3.037 N/A