Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ar8_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLU 22.A OE2 no hydrogen 2.214 N/A ALA 13.A N HIS 10.A O no hydrogen 3.481 N/A HIS 14.A N PRO 11.A O no hydrogen 3.130 N/A ARG 18.A NH2 GLY 7.A O no hydrogen 2.709 N/A GLU 22.A N ARG 30.A O no hydrogen 2.710 N/A MET 23.A N PHE 2.A O no hydrogen 3.085 N/A ASN 24.A N VAL 27.A O no hydrogen 3.105 N/A VAL 28.A N HIS 364.A O no hydrogen 2.722 N/A GLU 29.A N GLU 22.A O no hydrogen 3.058 N/A GLU 32.A N VAL 20.A O no hydrogen 2.601 N/A GLY 36.A N ASP 384.A OD2 no hydrogen 2.849 N/A HIS 39.A N GLY 36.A O no hydrogen 3.395 N/A ARG 40.A N LEU 38.A O no hydrogen 2.915 N/A GLY 41.A N ARG 385.A O no hydrogen 2.991 N/A THR 42.A N ARG 385.A O no hydrogen 2.501 N/A THR 42.A OG1 ARG 385.A O no hydrogen 2.769 N/A LEU 45.A N GLY 41.A O no hydrogen 3.221 N/A ILE 46.A N THR 42.A O no hydrogen 2.765 N/A TYR 48.A N LEU 45.A O no hydrogen 3.419 N/A LYS 49.A N ILE 46.A O no hydrogen 3.196 N/A TYR 51.A OH SER 335.A OG no hydrogen 2.704 N/A GLN 53.A NE2 THR 50.A OG1 no hydrogen 2.904 N/A ALA 54.A N THR 50.A O no hydrogen 3.049 N/A LEU 55.A N LEU 52.A O no hydrogen 3.279 N/A TYR 57.A OH LEU 45.A O no hydrogen 2.958 N/A PHE 58.A N LEU 55.A O no hydrogen 2.934 N/A ASP 59.A N PRO 56.A O no hydrogen 3.277 N/A ARG 60.A NH1 PRO 56.A O no hydrogen 3.072 N/A LEU 61.A N TYR 57.A O no hydrogen 3.405 N/A VAL 64.A N ASP 62.A O no hydrogen 2.719 N/A SER 65.A N ASP 62.A O no hydrogen 3.207 N/A SER 65.A OG ASP 62.A O no hydrogen 3.551 N/A SER 65.A OG ASP 62.A OD2 no hydrogen 2.658 N/A SER 65.A OG GLN 69.A OE1 no hydrogen 3.276 N/A ALA 68.A N SER 65.A O no hydrogen 2.888 N/A GLN 69.A N MET 66.A O no hydrogen 2.983 N/A GLU 70.A N MET 66.A O no hydrogen 3.451 N/A HIS 71.A NE2 ASP 231.A OD1 no hydrogen 2.717 N/A ALA 72.A N GLN 69.A O no hydrogen 3.275 N/A TYR 73.A OH TYR 51.A O no hydrogen 2.469 N/A SER 74.A N GLU 70.A O no hydrogen 2.912 N/A SER 74.A OG GLU 70.A O no hydrogen 3.170 N/A LEU 75.A N HIS 71.A O no hydrogen 2.904 N/A ALA 76.A N ALA 72.A O no hydrogen 2.907 N/A VAL 77.A N TYR 73.A O no hydrogen 2.948 N/A GLU 78.A N SER 74.A O no hydrogen 2.893 N/A LYS 79.A N LEU 75.A O no hydrogen 2.892 N/A LEU 80.A N ALA 76.A O no hydrogen 2.934 N/A LEU 81.A N GLU 78.A O no hydrogen 3.057 N/A CYS 83.A N GLU 78.A O no hydrogen 3.338 N/A ARG 88.A NH1 PRO 274.A O no hydrogen 3.236 N/A ARG 88.A NH2 ASP 157.A OD1 no hydrogen 3.318 N/A GLN 90.A N PRO 86.A O no hydrogen 3.202 N/A TYR 91.A N LEU 87.A O no hydrogen 2.931 N/A ILE 92.A N ARG 88.A O no hydrogen 2.968 N/A ARG 93.A N ALA 89.A O no hydrogen 2.867 N/A ARG 93.A NH1 GLU 78.A OE2 no hydrogen 2.960 N/A ARG 93.A NH2 GLU 78.A OE1 no hydrogen 3.006 N/A VAL 94.A N GLN 90.A O no hydrogen 2.948 N/A LEU 95.A N TYR 91.A O no hydrogen 2.942 N/A PHE 96.A N ILE 92.A O no hydrogen 2.931 N/A CYS 97.A N ARG 93.A O no hydrogen 2.899 N/A CYS 97.A SG MET 67.A O no hydrogen 3.880 N/A CYS 97.A SG HIS 71.A ND1 no hydrogen 2.945 N/A CYS 97.A SG ARG 93.A O no hydrogen 3.355 N/A GLU 98.A N VAL 94.A O no hydrogen 2.940 N/A ILE 99.A N LEU 95.A O no hydrogen 2.970 N/A THR 100.A N PHE 96.A O no hydrogen 2.918 N/A THR 100.A OG1 CYS 97.A O no hydrogen 2.275 N/A ARG 101.A N CYS 97.A O no hydrogen 2.932 N/A ARG 101.A NH1 GLU 98.A OE1 no hydrogen 3.141 N/A ILE 102.A N GLU 98.A O no hydrogen 2.948 N/A LEU 103.A N ILE 99.A O no hydrogen 2.931 N/A ASN 104.A N THR 100.A O no hydrogen 2.884 N/A ASN 104.A ND2 HIS 105.A ND1 no hydrogen 3.652 N/A ASN 104.A ND2 ASP 377.A OD2 no hydrogen 2.926 N/A HIS 105.A N ARG 101.A O no hydrogen 2.939 N/A HIS 105.A NE2 GLU 258.A OE1 no hydrogen 2.598 N/A LEU 106.A N ILE 102.A O no hydrogen 2.939 N/A LEU 107.A N LEU 103.A O no hydrogen 2.938 N/A ALA 108.A N ASN 104.A O no hydrogen 2.878 N/A LEU 109.A N HIS 105.A O no hydrogen 2.909 N/A THR 110.A N LEU 106.A O no hydrogen 3.001 N/A THR 110.A OG1 LEU 106.A O no hydrogen 3.458 N/A THR 110.A OG1 LEU 107.A O no hydrogen 3.400 N/A THR 111.A N LEU 107.A O no hydrogen 2.895 N/A THR 111.A OG1 LEU 107.A O no hydrogen 2.842 N/A HIS 112.A N ALA 108.A O no hydrogen 2.921 N/A HIS 112.A NE2 THR 371.A OG1 no hydrogen 2.897 N/A ALA 113.A N LEU 109.A O no hydrogen 2.906 N/A MET 114.A N THR 110.A O no hydrogen 2.875 N/A ASP 115.A N THR 111.A O no hydrogen 2.921 N/A VAL 116.A N HIS 112.A O no hydrogen 2.954 N/A GLY 117.A N ALA 113.A O no hydrogen 2.709 N/A ALA 125.A N PRO 121.A O no hydrogen 2.918 N/A PHE 126.A N PHE 122.A O no hydrogen 3.004 N/A GLU 127.A N LEU 123.A O no hydrogen 2.878 N/A GLU 128.A N TRP 124.A O no hydrogen 3.004 N/A ARG 129.A N ALA 125.A O no hydrogen 2.835 N/A GLU 130.A N PHE 126.A O no hydrogen 2.903 N/A LYS 131.A N GLU 128.A O no hydrogen 3.234 N/A LYS 131.A NZ GLU 128.A OE1 no hydrogen 2.944 N/A LYS 131.A NZ GLU 128.A OE2 no hydrogen 3.384 N/A LEU 132.A N ARG 129.A O no hydrogen 3.280 N/A LEU 133.A N ARG 129.A O no hydrogen 2.957 N/A GLU 134.A N GLU 130.A O no hydrogen 2.899 N/A PHE 135.A N LYS 131.A O no hydrogen 3.344 N/A TYR 136.A N LEU 132.A O no hydrogen 2.964 N/A TYR 136.A OH PHE 96.A O no hydrogen 3.151 N/A GLU 137.A N LEU 133.A O no hydrogen 2.870 N/A ARG 138.A N GLU 134.A O no hydrogen 2.953 N/A ARG 138.A N PHE 135.A O no hydrogen 3.060 N/A ARG 138.A NH1 GLY 161.A O no hydrogen 2.422 N/A VAL 139.A N PHE 135.A O no hydrogen 3.282 N/A SER 140.A N TYR 136.A O no hydrogen 3.253 N/A SER 140.A OG TYR 136.A O no hydrogen 2.693 N/A SER 140.A OG ALA 142.A O no hydrogen 3.100 N/A ARG 143.A NH2 GLU 130.A OE1 no hydrogen 3.239 N/A SER 147.A OG ASP 59.A OD2 no hydrogen 3.316 N/A ARG 150.A N GLY 153.A O no hydrogen 3.030 N/A ARG 150.A NE SER 147.A O no hydrogen 3.131 N/A ALA 155.A N PHE 148.A O no hydrogen 2.509 N/A LEU 158.A N ASP 157.A OD1 no hydrogen 2.911 N/A ILE 166.A N LEU 162.A O no hydrogen 2.920 N/A ASP 167.A N CYS 163.A O no hydrogen 2.930 N/A SER 168.A N ARG 164.A O no hydrogen 2.919 N/A SER 168.A OG ASP 165.A O no hydrogen 2.674 N/A PHE 169.A N ASP 165.A O no hydrogen 2.914 N/A THR 170.A N ILE 166.A O no hydrogen 2.932 N/A THR 170.A OG1 ILE 166.A O no hydrogen 3.333 N/A THR 170.A OG1 ASP 167.A O no hydrogen 2.701 N/A GLN 171.A N ASP 167.A O no hydrogen 2.933 N/A GLN 171.A NE2 ASP 167.A OD1 no hydrogen 3.103 N/A GLN 172.A N PHE 169.A O no hydrogen 3.166 N/A GLN 172.A NE2 PHE 169.A O no hydrogen 2.642 N/A PHE 173.A N PHE 169.A O no hydrogen 2.953 N/A SER 175.A OG GLN 172.A O no hydrogen 2.845 N/A ARG 176.A N GLN 172.A O no hydrogen 2.993 N/A ARG 176.A NH1 GLN 172.A OE1 no hydrogen 3.102 N/A ILE 177.A N PHE 173.A O no hydrogen 2.879 N/A ASP 178.A N ALA 174.A O no hydrogen 2.924 N/A GLU 179.A N SER 175.A O no hydrogen 2.904 N/A LEU 180.A N ARG 176.A O no hydrogen 2.947 N/A GLU 181.A N ILE 177.A O no hydrogen 2.852 N/A GLU 182.A N ASP 178.A O no hydrogen 2.902 N/A LEU 184.A N GLU 181.A O no hydrogen 3.109 N/A THR 185.A N GLU 181.A O no hydrogen 2.930 N/A THR 185.A OG1 GLU 181.A O no hydrogen 2.564 N/A ASN 187.A N LEU 184.A O no hydrogen 3.351 N/A ASN 187.A ND2 MET 183.A O no hydrogen 3.575 N/A ARG 188.A N ASN 187.A OD1 no hydrogen 2.634 N/A GLN 192.A N ARG 188.A O no hydrogen 3.259 N/A ARG 193.A N ILE 189.A O no hydrogen 2.938 N/A LEU 194.A N LYS 191.A O no hydrogen 3.209 N/A VAL 195.A N LYS 191.A O no hydrogen 2.846 N/A ASP 196.A N ASP 247.A OD2 no hydrogen 3.497 N/A GLY 198.A N HIS 364.A NE2 no hydrogen 3.353 N/A THR 201.A OG1 GLN 204.A OE1 no hydrogen 3.535 N/A GLN 204.A N THR 201.A OG1 no hydrogen 3.188 N/A ALA 205.A N THR 201.A O no hydrogen 2.851 N/A LYS 206.A N ALA 202.A O no hydrogen 2.918 N/A ASP 207.A N GLN 203.A O no hydrogen 2.888 N/A TRP 208.A N GLN 204.A O no hydrogen 2.908 N/A GLY 209.A N LYS 206.A O no hydrogen 3.314 N/A PHE 210.A N ALA 205.A O no hydrogen 2.967 N/A ARG 216.A N GLY 212.A O no hydrogen 3.316 N/A ARG 216.A NE PRO 241.A O no hydrogen 3.231 N/A ARG 216.A NH1 GLU 323.A OE2 no hydrogen 3.305 N/A GLY 217.A N VAL 213.A O no hydrogen 2.640 N/A SER 218.A N LEU 215.A O no hydrogen 3.415 N/A SER 218.A OG VAL 200.A O no hydrogen 2.925 N/A SER 218.A OG MET 214.A O no hydrogen 3.401 N/A LEU 224.A N GLU 323.A OE1 no hydrogen 3.125 N/A ARG 226.A N ASP 223.A O no hydrogen 3.075 N/A ALA 227.A N ASP 223.A O no hydrogen 2.635 N/A ALA 228.A N LEU 224.A O no hydrogen 2.892 N/A TYR 233.A OH GLU 98.A OE2 no hydrogen 2.767 N/A ASP 237.A N GLN 268.A OE1 no hydrogen 2.968 N/A ASP 239.A N GLN 261.A OE1 no hydrogen 3.255 N/A GLY 243.A N ARG 216.A O no hydrogen 2.973 N/A ARG 245.A N ASP 250.A OD2 no hydrogen 3.100 N/A CYS 248.A SG ILE 197.A O no hydrogen 3.163 N/A TYR 249.A OH THR 185.A O no hydrogen 3.100 N/A ARG 251.A NH2 GLY 198.A O no hydrogen 2.928 N/A TYR 252.A N CYS 248.A O no hydrogen 3.093 N/A CYS 253.A N TYR 249.A O no hydrogen 2.964 N/A CYS 253.A SG TYR 249.A O no hydrogen 3.929 N/A ILE 254.A N ASP 250.A O no hydrogen 2.857 N/A ARG 255.A N ARG 251.A O no hydrogen 2.915 N/A ARG 255.A NH1 THR 375.A O no hydrogen 2.997 N/A ARG 255.A NH2 THR 375.A O no hydrogen 2.339 N/A ILE 256.A N TYR 252.A O no hydrogen 2.996 N/A GLU 257.A N CYS 253.A O no hydrogen 2.941 N/A GLU 258.A N ILE 254.A O no hydrogen 2.826 N/A MET 259.A N ARG 255.A O no hydrogen 2.949 N/A ARG 260.A N ILE 256.A O no hydrogen 3.002 N/A ARG 260.A NH2 ASP 178.A OD1 no hydrogen 2.230 N/A GLN 261.A N GLU 257.A O no hydrogen 2.900 N/A SER 262.A N GLU 258.A O no hydrogen 2.866 N/A SER 262.A OG GLU 98.A OE1 no hydrogen 3.115 N/A SER 262.A OG GLU 258.A O no hydrogen 2.946 N/A LEU 263.A N MET 259.A O no hydrogen 2.960 N/A ARG 264.A N ARG 260.A O no hydrogen 2.982 N/A ILE 265.A N GLN 261.A O no hydrogen 2.894 N/A ILE 266.A N SER 262.A O no hydrogen 2.898 N/A VAL 267.A N LEU 263.A O no hydrogen 2.978 N/A GLN 268.A N ARG 264.A O no hydrogen 2.960 N/A GLN 268.A NE2 ASP 237.A O no hydrogen 2.322 N/A CYS 269.A N ILE 265.A O no hydrogen 2.882 N/A CYS 269.A SG TYR 91.A O no hydrogen 3.946 N/A LEU 270.A N ILE 266.A O no hydrogen 2.894 N/A ASN 271.A N VAL 267.A O no hydrogen 2.966 N/A GLN 272.A N GLN 268.A O no hydrogen 2.903 N/A LYS 279.A NZ PRO 287.A O no hydrogen 3.330 N/A LYS 284.A NZ CYS 286.A O no hydrogen 3.304 N/A CYS 286.A SG ALA 280.A O no hydrogen 3.148 N/A ARG 292.A N SER 289.A O no hydrogen 2.612 N/A MET 293.A N SER 289.A O no hydrogen 2.893 N/A LEU 295.A N ARG 292.A O no hydrogen 3.379 N/A SER 296.A OG GLU 298.A OE1 no hydrogen 3.435 N/A GLU 298.A N GLU 298.A OE1 no hydrogen 3.016 N/A ILE 301.A N MET 297.A O no hydrogen 2.945 N/A HIS 302.A N GLU 298.A O no hydrogen 2.907 N/A HIS 303.A N SER 299.A O no hydrogen 2.906 N/A PHE 304.A N LEU 300.A O no hydrogen 2.928 N/A GLU 305.A N ILE 301.A O no hydrogen 2.919 N/A LEU 306.A N HIS 302.A O no hydrogen 2.891 N/A TYR 307.A N HIS 303.A O no hydrogen 2.943 N/A THR 308.A N PHE 304.A O no hydrogen 2.981 N/A THR 308.A OG1 PHE 304.A O no hydrogen 2.799 N/A GLY 310.A N GLU 305.A O no hydrogen 3.129 N/A SER 317.A N SER 316.A OG no hydrogen 2.655 N/A THR 318.A N LEU 333.A O no hydrogen 3.004 N/A TYR 319.A OH GLU 328.A OE2 no hydrogen 3.057 N/A THR 320.A N VAL 331.A O no hydrogen 3.162 N/A VAL 322.A N PHE 329.A O no hydrogen 2.914 N/A LYS 326.A NZ ASP 62.A OD1 no hydrogen 2.376 N/A LYS 326.A NZ ASP 62.A OD2 no hydrogen 3.062 N/A LYS 326.A NZ ASN 104.A OD1 no hydrogen 2.444 N/A PHE 329.A N VAL 322.A O no hydrogen 3.117 N/A GLY 330.A N ARG 347.A O no hydrogen 3.501 N/A PHE 332.A N LYS 345.A O no hydrogen 2.907 N/A VAL 334.A N ARG 343.A O no hydrogen 2.761 N/A SER 335.A N SER 316.A O no hydrogen 2.724 N/A SER 335.A OG TYR 51.A OH no hydrogen 2.704 N/A SER 335.A OG VAL 313.A O no hydrogen 3.036 N/A SER 338.A OG ARG 340.A O no hydrogen 3.390 N/A ASN 339.A ND2 GLU 309.A O no hydrogen 3.003 N/A ARG 340.A NH1 GLU 47.A O no hydrogen 2.726 N/A TYR 342.A N VAL 334.A O no hydrogen 2.875 N/A ARG 343.A N VAL 334.A O no hydrogen 3.262 N/A ARG 343.A NH2 GLU 43.A OE1 no hydrogen 2.356 N/A LYS 345.A N PHE 332.A O no hydrogen 3.219 N/A ARG 347.A N GLY 330.A O no hydrogen 2.794 N/A ARG 347.A NH1 GLU 328.A O no hydrogen 2.916 N/A ARG 347.A NH2 GLY 209.A O no hydrogen 3.504 N/A PHE 351.A N ALA 348.A O no hydrogen 3.175 N/A HIS 353.A N PRO 349.A O no hydrogen 3.511 N/A SER 354.A N GLY 350.A O no hydrogen 2.879 N/A GLN 355.A N PHE 351.A O no hydrogen 2.978 N/A GLY 356.A N ALA 352.A O no hydrogen 2.942 N/A LEU 357.A N SER 354.A O no hydrogen 3.273 N/A MET 360.A N LEU 357.A O no hydrogen 3.172 N/A SER 361.A N LEU 357.A O no hydrogen 3.103 N/A SER 361.A OG LEU 357.A O no hydrogen 3.475 N/A LYS 362.A NZ GLU 29.A O no hydrogen 2.916 N/A HIS 363.A N VAL 28.A O no hydrogen 3.163 N/A ASP 368.A N MET 365.A O no hydrogen 3.176 N/A VAL 369.A N LEU 366.A O no hydrogen 2.999 N/A THR 371.A OG1 HIS 112.A NE2 no hydrogen 2.897 N/A ILE 373.A N VAL 369.A O no hydrogen 2.909 N/A GLY 374.A N VAL 370.A O no hydrogen 2.891 N/A THR 375.A N THR 371.A O no hydrogen 2.908 N/A GLN 376.A N ILE 372.A O no hydrogen 3.367 N/A ASP 377.A N GLY 374.A O no hydrogen 3.271 N/A ASP 384.A N PHE 380.A O no hydrogen 3.318 N/A ARG 385.A NE GLU 43.A OE2 no hydrogen 2.518 N/A ARG 385.A NH1 GLU 382.A O no hydrogen 3.103 N/A ARG 385.A NH2 GLU 43.A OE2 no hydrogen 3.286 N/A