Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pqi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N GLU 5.A OE1 no hydrogen 2.927 N/A TYR 6.A N GLY 3.A O no hydrogen 3.087 N/A TYR 8.A OH ASP 182.A OD2 no hydrogen 2.380 N/A MET 12.A N ASP 10.A OD1 no hydrogen 3.190 N/A GLN 13.A N ASP 10.A O no hydrogen 3.037 N/A LEU 14.A N PRO 11.A O no hydrogen 3.266 N/A TYR 16.A OH GLU 21.A OE1 no hydrogen 2.709 N/A ARG 19.A N ASP 17.A OD1 no hydrogen 2.969 N/A TRP 20.A N ASP 17.A O no hydrogen 3.193 N/A GLU 21.A N SER 18.A O no hydrogen 3.008 N/A PHE 22.A N ALA 97.A O no hydrogen 2.849 N/A ARG 24.A NH1 PRO 103.A O no hydrogen 2.887 N/A ARG 24.A NH2 LYS 100.A O no hydrogen 2.459 N/A ARG 24.A NH2 PRO 103.A O no hydrogen 3.525 N/A GLY 26.A N PRO 23.A O no hydrogen 3.138 N/A VAL 28.A N THR 45.A O no hydrogen 3.004 N/A GLY 30.A N GLU 43.A O no hydrogen 2.544 N/A ARG 31.A NH2 TYR 110.A OH no hydrogen 3.459 N/A LEU 33.A N VAL 41.A O no hydrogen 2.663 N/A GLY 34.A N VAL 41.A O no hydrogen 3.033 N/A GLY 36.A N GLY 39.A O no hydrogen 2.691 N/A LYS 40.A N MET 62.A O no hydrogen 2.943 N/A VAL 41.A N GLY 34.A O no hydrogen 2.737 N/A VAL 42.A N VAL 60.A O no hydrogen 2.827 N/A GLU 43.A N ARG 31.A O no hydrogen 2.783 N/A GLY 44.A N VAL 58.A O no hydrogen 2.690 N/A THR 45.A N VAL 28.A O no hydrogen 3.023 N/A ALA 46.A N MET 56.A O no hydrogen 3.002 N/A TYR 47.A N GLY 26.A O no hydrogen 2.857 N/A GLY 48.A N PRO 54.A O no hydrogen 2.689 N/A SER 52.A OG SER 50.A OG no hydrogen 2.631 N/A GLN 53.A N SER 50.A OG no hydrogen 3.012 N/A MET 56.A N ALA 46.A O no hydrogen 3.202 N/A LYS 57.A NZ GLU 43.A OE2 no hydrogen 3.232 N/A VAL 58.A N GLY 44.A O no hydrogen 2.740 N/A ALA 59.A N ILE 108.A O no hydrogen 3.013 N/A VAL 60.A N VAL 42.A O no hydrogen 2.711 N/A LYS 61.A N ILE 106.A O no hydrogen 2.752 N/A LYS 61.A NZ GLU 78.A OE1 no hydrogen 3.073 N/A LYS 61.A NZ GLU 78.A OE2 no hydrogen 2.898 N/A LYS 61.A NZ ASP 176.A OD1 no hydrogen 3.045 N/A MET 62.A N LYS 40.A O no hydrogen 2.947 N/A LYS 64.A N PHE 38.A O no hydrogen 3.273 N/A LYS 64.A NZ GLY 36.A O no hydrogen 2.659 N/A ALA 67.A N LYS 64.A O no hydrogen 2.814 N/A SER 70.A N ARG 68.A O no hydrogen 2.426 N/A GLN 73.A N SER 69.A O no hydrogen 2.724 N/A LEU 75.A N GLU 71.A O no hydrogen 3.106 N/A MET 76.A N LYS 72.A O no hydrogen 3.309 N/A SER 77.A N GLN 73.A O no hydrogen 3.093 N/A SER 77.A OG GLN 73.A O no hydrogen 3.127 N/A GLU 78.A N ALA 74.A O no hydrogen 2.636 N/A LEU 79.A N LEU 75.A O no hydrogen 3.187 N/A LYS 80.A N MET 76.A O no hydrogen 3.178 N/A LYS 80.A NZ LEU 14.A O no hydrogen 2.808 N/A ILE 81.A N SER 77.A O no hydrogen 3.159 N/A MET 82.A N GLU 78.A O no hydrogen 3.277 N/A THR 83.A N LEU 79.A O no hydrogen 2.999 N/A THR 83.A OG1 LEU 79.A O no hydrogen 2.909 N/A THR 83.A OG1 LYS 80.A O no hydrogen 2.778 N/A HIS 84.A N LYS 80.A O no hydrogen 3.176 N/A LEU 85.A N ILE 81.A O no hydrogen 2.926 N/A HIS 88.A N ASN 93.A OD1 no hydrogen 2.953 N/A ASN 90.A N HIS 88.A ND1 no hydrogen 3.084 N/A ASN 90.A ND2 GLN 141.A OE1 no hydrogen 2.823 N/A ASN 90.A ND2 VAL 172.A O no hydrogen 2.603 N/A ILE 91.A N HIS 88.A O no hydrogen 3.386 N/A VAL 92.A N ILE 174.A O no hydrogen 2.947 N/A ASN 93.A N GLU 109.A OE1 no hydrogen 2.801 N/A ASN 93.A ND2 HIS 88.A O no hydrogen 2.897 N/A ASN 93.A ND2 GLU 109.A OE1 no hydrogen 3.092 N/A LEU 95.A N ILE 107.A O no hydrogen 2.778 N/A GLY 96.A N ILE 107.A O no hydrogen 3.409 N/A ALA 97.A N TRP 20.A O no hydrogen 2.910 N/A CYS 98.A N TYR 105.A O no hydrogen 2.899 N/A CYS 98.A SG PHE 22.A O no hydrogen 3.263 N/A THR 99.A N GLU 21.A OE2 no hydrogen 2.901 N/A THR 99.A OG1 GLU 21.A OE1 no hydrogen 2.578 N/A THR 99.A OG1 GLU 21.A OE2 no hydrogen 3.401 N/A LYS 100.A N GLU 21.A OE2 no hydrogen 3.278 N/A TYR 105.A N CYS 98.A O no hydrogen 3.060 N/A ILE 106.A N LYS 61.A O no hydrogen 2.965 N/A ILE 107.A N GLY 96.A O no hydrogen 2.898 N/A ILE 108.A N ALA 59.A O no hydrogen 2.884 N/A GLU 109.A N ASN 93.A O no hydrogen 3.298 N/A TYR 113.A N LEU 166.A O no hydrogen 2.961 N/A LEU 116.A N VAL 164.A O no hydrogen 2.862 N/A ASN 118.A N ASP 115.A OD2 no hydrogen 3.502 N/A ASN 118.A ND2 ASP 115.A OD1 no hydrogen 2.856 N/A TYR 119.A N ASP 115.A O no hydrogen 2.997 N/A LEU 120.A N LEU 116.A O no hydrogen 3.048 N/A HIS 121.A N VAL 117.A O no hydrogen 3.234 N/A HIS 121.A NE2 GLY 222.A O no hydrogen 2.710 N/A LYS 122.A N ASN 118.A O no hydrogen 3.190 N/A ASN 123.A N TYR 119.A O no hydrogen 3.396 N/A ARG 124.A NE LEU 221.A O no hydrogen 3.482 N/A SER 126.A OG ASN 123.A O no hydrogen 2.567 N/A PHE 127.A N ASN 123.A O no hydrogen 3.414 N/A THR 131.A N ASP 134.A OD2 no hydrogen 2.860 N/A LEU 136.A N LEU 132.A O no hydrogen 3.168 N/A SER 137.A N LEU 133.A O no hydrogen 3.005 N/A SER 137.A OG TYR 288.A OH no hydrogen 2.722 N/A PHE 138.A N ASP 134.A O no hydrogen 2.924 N/A THR 139.A N LEU 135.A O no hydrogen 2.919 N/A THR 139.A OG1 LEU 135.A O no hydrogen 2.973 N/A TYR 140.A N LEU 136.A O no hydrogen 2.839 N/A GLN 141.A N SER 137.A O no hydrogen 3.047 N/A GLN 141.A NE2 SER 137.A O no hydrogen 3.601 N/A GLN 141.A NE2 SER 137.A OG no hydrogen 3.161 N/A GLN 141.A NE2 LYS 170.A O no hydrogen 3.253 N/A VAL 142.A N PHE 138.A O no hydrogen 3.221 N/A ALA 143.A N THR 139.A O no hydrogen 3.429 N/A ARG 144.A N TYR 140.A O no hydrogen 3.101 N/A ARG 144.A NH1 TYR 140.A OH no hydrogen 2.537 N/A ARG 144.A NH1 GLU 293.A OE2 no hydrogen 3.273 N/A GLY 145.A N GLN 141.A O no hydrogen 2.938 N/A MET 146.A N VAL 142.A O no hydrogen 2.868 N/A GLU 147.A N ALA 143.A O no hydrogen 2.977 N/A PHE 148.A N ARG 144.A O no hydrogen 3.012 N/A LEU 149.A N GLY 145.A O no hydrogen 2.995 N/A ALA 150.A N MET 146.A O no hydrogen 2.804 N/A SER 151.A N GLU 147.A O no hydrogen 2.965 N/A SER 151.A OG GLU 147.A O no hydrogen 3.491 N/A SER 151.A OG PHE 148.A O no hydrogen 2.610 N/A LYS 152.A N PHE 148.A O no hydrogen 3.222 N/A LYS 152.A N LEU 149.A O no hydrogen 2.994 N/A ASN 153.A N ALA 150.A O no hydrogen 2.966 N/A CYS 154.A N LEU 149.A O no hydrogen 2.899 N/A VAL 155.A N ARG 181.A O no hydrogen 2.820 N/A HIS 156.A N ASP 207.A OD2 no hydrogen 2.914 N/A HIS 156.A NE2 CYS 175.A O no hydrogen 2.938 N/A ARG 157.A N ASP 207.A OD1 no hydrogen 3.121 N/A ARG 157.A NH1 LEU 179.A O no hydrogen 2.762 N/A ASP 158.A N HIS 156.A ND1 no hydrogen 3.207 N/A ALA 161.A N GLU 217.A OE1 no hydrogen 3.089 N/A ASN 163.A ND2 ASP 158.A O no hydrogen 3.039 N/A ASN 163.A ND2 ASP 158.A OD2 no hydrogen 3.109 N/A VAL 164.A N ALA 161.A O no hydrogen 3.254 N/A LEU 165.A N LYS 173.A O no hydrogen 2.816 N/A LEU 166.A N GLY 114.A O no hydrogen 2.949 N/A ALA 167.A N ILE 171.A O no hydrogen 3.029 N/A LYS 170.A N ALA 167.A O no hydrogen 3.081 N/A LYS 170.A NZ TYR 119.A OH no hydrogen 2.669 N/A VAL 172.A N GLN 141.A OE1 no hydrogen 2.765 N/A LYS 173.A N LEU 165.A O no hydrogen 2.881 N/A LYS 173.A NZ LEU 89.A O no hydrogen 2.530 N/A ILE 174.A N ASN 90.A O no hydrogen 2.802 N/A CYS 175.A N ASN 163.A O no hydrogen 3.122 N/A PHE 177.A N GLU 78.A OE2 no hydrogen 3.313 N/A ALA 180.A N PHE 177.A O no hydrogen 3.203 N/A ARG 181.A N VAL 155.A O no hydrogen 2.946 N/A ARG 181.A NH1 ALA 180.A O no hydrogen 2.944 N/A ILE 183.A N ASN 153.A O no hydrogen 3.062 N/A LYS 190.A NZ PRO 225.A O no hydrogen 3.019 N/A LYS 190.A NZ TYR 226.A O no hydrogen 3.098 N/A LYS 190.A NZ MET 229.A O no hydrogen 3.080 N/A TRP 191.A N PRO 188.A O no hydrogen 2.980 N/A TRP 191.A NE1 GLU 217.A OE1 no hydrogen 2.729 N/A MET 192.A N VAL 189.A O no hydrogen 2.964 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.580 N/A SER 196.A OG LEU 201.A O no hydrogen 2.740 N/A ILE 197.A N ALA 193.A O no hydrogen 2.954 N/A PHE 198.A N PRO 194.A O no hydrogen 2.705 N/A ASP 199.A N GLU 195.A O no hydrogen 2.900 N/A LEU 201.A N GLU 195.A O no hydrogen 3.120 N/A THR 203.A N SER 206.A OG no hydrogen 2.719 N/A LEU 205.A N THR 203.A OG1 no hydrogen 3.124 N/A SER 206.A N THR 203.A O no hydrogen 3.012 N/A SER 206.A N THR 203.A OG1 no hydrogen 3.235 N/A SER 206.A OG THR 203.A O no hydrogen 2.592 N/A ASP 207.A N THR 203.A O no hydrogen 3.157 N/A VAL 208.A N THR 204.A O no hydrogen 3.245 N/A TRP 209.A N LEU 205.A O no hydrogen 3.428 N/A SER 210.A N SER 206.A O no hydrogen 3.267 N/A SER 210.A OG TRP 191.A O no hydrogen 2.492 N/A SER 210.A OG SER 206.A O no hydrogen 3.186 N/A TYR 211.A N ASP 207.A O no hydrogen 2.689 N/A TYR 211.A OH THR 139.A O no hydrogen 2.739 N/A GLY 212.A N VAL 208.A O no hydrogen 3.018 N/A ILE 213.A N TRP 209.A O no hydrogen 3.193 N/A LEU 214.A N SER 210.A O no hydrogen 2.849 N/A LEU 215.A N TYR 211.A O no hydrogen 2.870 N/A TRP 216.A N GLY 212.A O no hydrogen 3.024 N/A TRP 216.A NE1 ALA 246.A O no hydrogen 3.038 N/A GLU 217.A N ILE 213.A O no hydrogen 3.029 N/A ILE 218.A N LEU 214.A O no hydrogen 2.987 N/A PHE 219.A N LEU 215.A O no hydrogen 3.136 N/A SER 220.A N TRP 216.A O no hydrogen 2.921 N/A SER 220.A OG TRP 216.A O no hydrogen 2.660 N/A SER 220.A OG GLU 217.A O no hydrogen 3.085 N/A LEU 221.A N ILE 218.A O no hydrogen 3.023 N/A GLY 222.A N GLU 217.A O no hydrogen 2.791 N/A GLY 223.A N SER 220.A OG no hydrogen 3.064 N/A MET 229.A N TYR 226.A O no hydrogen 3.118 N/A THR 234.A OG1 ASP 232.A OD1 no hydrogen 2.630 N/A PHE 235.A N ASP 232.A OD1 no hydrogen 3.069 N/A TYR 236.A N ASP 232.A O no hydrogen 2.938 N/A ASN 237.A N SER 233.A O no hydrogen 2.977 N/A LYS 238.A N THR 234.A O no hydrogen 3.005 N/A ILE 239.A N PHE 235.A O no hydrogen 3.010 N/A LYS 240.A N TYR 236.A O no hydrogen 3.071 N/A SER 241.A N ASN 237.A O no hydrogen 2.873 N/A SER 241.A OG ASN 237.A O no hydrogen 2.528 N/A GLY 242.A N LYS 238.A O no hydrogen 3.013 N/A TYR 243.A N LYS 238.A O no hydrogen 2.752 N/A ARG 244.A NE TRP 263.A O no hydrogen 2.969 N/A ARG 244.A NH1 ILE 239.A O no hydrogen 3.353 N/A ARG 244.A NH1 TYR 243.A O no hydrogen 2.709 N/A ARG 244.A NH2 TRP 263.A O no hydrogen 3.009 N/A VAL 255.A N THR 252.A OG1 no hydrogen 3.295 N/A TYR 256.A N THR 252.A O no hydrogen 2.952 N/A TYR 256.A OH MET 245.A O no hydrogen 2.758 N/A GLU 257.A N SER 253.A O no hydrogen 2.840 N/A ILE 258.A N VAL 255.A O no hydrogen 3.077 N/A MET 259.A N VAL 255.A O no hydrogen 3.377 N/A VAL 260.A N TYR 256.A O no hydrogen 3.034 N/A LYS 261.A N GLU 257.A O no hydrogen 3.226 N/A CYS 262.A N ILE 258.A O no hydrogen 2.966 N/A CYS 262.A SG ILE 258.A O no hydrogen 3.262 N/A TRP 263.A N MET 259.A O no hydrogen 2.925 N/A TRP 263.A N VAL 260.A O no hydrogen 3.224 N/A ASN 264.A N LYS 261.A O no hydrogen 3.284 N/A GLU 266.A N ASN 264.A OD1 no hydrogen 2.772 N/A LYS 269.A N GLU 266.A O no hydrogen 2.921 N/A LYS 269.A NZ GLU 266.A OE1 no hydrogen 2.642 N/A ARG 270.A N PRO 267.A O no hydrogen 3.400 N/A ARG 270.A NE ASN 264.A O no hydrogen 2.779 N/A ARG 270.A NH1 GLU 195.A OE2 no hydrogen 2.691 N/A ARG 270.A NH1 LEU 205.A O no hydrogen 3.151 N/A ARG 270.A NH2 GLU 195.A OE1 no hydrogen 3.196 N/A ARG 270.A NH2 GLU 195.A OE2 no hydrogen 3.458 N/A ARG 270.A NH2 ASN 264.A O no hydrogen 3.113 N/A HIS 275.A N SER 272.A OG no hydrogen 2.913 N/A LEU 276.A N SER 272.A O no hydrogen 2.729 N/A SER 277.A N PHE 273.A O no hydrogen 3.035 N/A SER 277.A OG PHE 273.A O no hydrogen 3.301 N/A SER 277.A OG TYR 274.A O no hydrogen 2.417 N/A GLU 278.A N TYR 274.A O no hydrogen 3.038 N/A ILE 279.A N HIS 275.A O no hydrogen 2.967 N/A VAL 280.A N LEU 276.A O no hydrogen 3.134 N/A GLU 281.A N SER 277.A O no hydrogen 3.023 N/A ASN 282.A N GLU 278.A O no hydrogen 3.355 N/A ASN 282.A N ILE 279.A O no hydrogen 3.153 N/A LEU 283.A N VAL 280.A O no hydrogen 3.069 N/A LEU 284.A N GLU 281.A O no hydrogen 3.447 N/A TYR 288.A N PRO 285.A O no hydrogen 3.295 N/A TYR 288.A OH SER 137.A OG no hydrogen 2.722 N/A LYS 289.A NZ TYR 140.A OH no hydrogen 2.911 N/A LYS 289.A NZ GLU 281.A OE1 no hydrogen 3.317 N/A LYS 289.A NZ GLU 293.A OE2 no hydrogen 3.224 N/A SER 291.A N GLN 287.A O no hydrogen 2.874 N/A TYR 292.A N TYR 288.A O no hydrogen 2.832 N/A TYR 292.A N LYS 289.A O no hydrogen 3.267 N/A TYR 292.A OH ASN 90.A OD1 no hydrogen 2.799 N/A GLU 293.A N LYS 289.A O no hydrogen 3.243 N/A LYS 294.A N LYS 290.A O no hydrogen 3.263 N/A HIS 296.A N TYR 292.A O no hydrogen 2.755 N/A LEU 297.A N GLU 293.A O no hydrogen 2.874 N/A ASP 298.A N LYS 294.A O no hydrogen 3.131 N/A PHE 299.A N ILE 295.A O no hydrogen 3.204 N/A