Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pqg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 9.A N ASP 7.A OD1 no hydrogen 3.430 N/A THR 9.A OG1 ASP 7.A OD1 no hydrogen 3.141 N/A THR 9.A OG1 ASP 7.A OD2 no hydrogen 3.239 N/A GLN 10.A N ASP 7.A O no hydrogen 2.965 N/A LEU 11.A N PRO 8.A O no hydrogen 3.222 N/A TYR 13.A OH GLU 18.A OE1 no hydrogen 2.545 N/A LYS 16.A N ASP 14.A OD1 no hydrogen 2.915 N/A TRP 17.A N ASP 14.A O no hydrogen 3.372 N/A TRP 17.A NE1 SER 80.A OG.A no hydrogen 2.968 N/A GLU 18.A N HIS 15.A O no hydrogen 3.109 N/A PHE 19.A N ALA 94.A O no hydrogen 2.883 N/A ARG 21.A NH1 PRO 100.A O no hydrogen 2.677 N/A ARG 21.A NH2 HIS 97.A O no hydrogen 2.881 N/A ARG 23.A N PRO 20.A O no hydrogen 3.124 N/A LEU 24.A N ARG 21.A O no hydrogen 3.257 N/A SER 25.A N THR 42.A O no hydrogen 2.898 N/A SER 25.A OG THR 42.A O no hydrogen 3.471 N/A GLY 27.A N GLU 40.A O no hydrogen 2.661 N/A LEU 30.A N VAL 38.A O no hydrogen 2.537 N/A GLY 31.A N VAL 38.A O no hydrogen 3.032 N/A GLY 33.A N GLY 36.A O no hydrogen 2.905 N/A LYS 37.A N MET 59.A O no hydrogen 2.866 N/A VAL 38.A N GLY 31.A O no hydrogen 2.837 N/A VAL 39.A N VAL 57.A O no hydrogen 3.007 N/A GLU 40.A N LYS 28.A O no hydrogen 2.775 N/A ALA 41.A N VAL 55.A O no hydrogen 2.853 N/A THR 42.A N SER 25.A O no hydrogen 2.898 N/A ALA 43.A N MET 53.A O no hydrogen 2.689 N/A GLN 44.A N ARG 23.A O no hydrogen 2.914 N/A GLY 45.A N ALA 51.A O no hydrogen 3.196 N/A ALA 51.A N LYS 48.A O no hydrogen 3.248 N/A MET 53.A N ALA 43.A O no hydrogen 2.736 N/A VAL 55.A N ALA 41.A O no hydrogen 2.778 N/A ALA 56.A N ILE 105.A O no hydrogen 3.116 N/A VAL 57.A N VAL 39.A O no hydrogen 2.876 N/A LYS 58.A N VAL 103.A O no hydrogen 2.903 N/A LYS 58.A NZ GLU 75.A OE1 no hydrogen 2.847 N/A LYS 58.A NZ GLU 75.A OE2 no hydrogen 3.393 N/A MET 59.A N LYS 37.A O no hydrogen 2.885 N/A LYS 61.A N PHE 35.A O no hydrogen 2.943 N/A ARG 69.A N HIS 65.A O no hydrogen 3.226 N/A GLU 70.A N SER 66.A O no hydrogen 3.102 N/A ALA 71.A N THR 67.A O no hydrogen 3.078 N/A LEU 72.A N GLU 68.A O no hydrogen 3.154 N/A MET 73.A N ARG 69.A O no hydrogen 3.391 N/A SER 74.A N GLU 70.A O no hydrogen 2.898 N/A SER 74.A OG GLU 70.A O no hydrogen 2.930 N/A GLU 75.A N ALA 71.A O no hydrogen 3.004 N/A LEU 76.A N LEU 72.A O no hydrogen 3.022 N/A LYS 77.A N MET 73.A O no hydrogen 2.949 N/A LYS 77.A NZ THR 9.A O no hydrogen 3.523 N/A LYS 77.A NZ LEU 11.A O no hydrogen 2.904 N/A VAL 78.A N SER 74.A O no hydrogen 2.928 N/A LEU 79.A N GLU 75.A O no hydrogen 2.982 N/A SER 80.A N LEU 76.A O no hydrogen 3.087 N/A SER 80.A OG.B LEU 76.A O no hydrogen 3.372 N/A SER 80.A OG.B LYS 77.A O no hydrogen 2.938 N/A TYR 81.A N LYS 77.A O no hydrogen 2.921 N/A TYR 81.A OH LYS 152.A O no hydrogen 3.385 N/A LEU 82.A N VAL 78.A O no hydrogen 2.743 N/A GLY 83.A N LEU 79.A O no hydrogen 3.340 N/A HIS 85.A N ASN 90.A OD1 no hydrogen 2.834 N/A ASN 87.A N HIS 85.A ND1 no hydrogen 3.053 N/A ASN 87.A ND2 THR 172.A O no hydrogen 3.221 N/A ILE 88.A N HIS 85.A O no hydrogen 3.310 N/A VAL 89.A N ILE 174.A O no hydrogen 2.877 N/A ASN 90.A N GLU 106.A OE1 no hydrogen 2.629 N/A ASN 90.A ND2 HIS 85.A O no hydrogen 2.497 N/A ASN 90.A ND2 GLU 106.A OE1 no hydrogen 3.136 N/A ASN 90.A ND2 GLU 106.A OE2 no hydrogen 3.447 N/A LEU 92.A N ILE 104.A O no hydrogen 2.640 N/A GLY 93.A N ILE 104.A O no hydrogen 2.984 N/A ALA 94.A N TRP 17.A O no hydrogen 2.878 N/A CYS 95.A N LEU 102.A O no hydrogen 2.797 N/A CYS 95.A SG PHE 19.A O no hydrogen 3.188 N/A THR 96.A N GLU 18.A OE2 no hydrogen 2.935 N/A THR 96.A OG1 GLU 18.A OE1 no hydrogen 3.141 N/A HIS 97.A N GLU 18.A OE2 no hydrogen 3.221 N/A GLY 99.A N HIS 97.A O no hydrogen 2.656 N/A LEU 102.A N CYS 95.A O no hydrogen 3.119 N/A VAL 103.A N LYS 58.A O no hydrogen 3.087 N/A ILE 104.A N GLY 93.A O no hydrogen 2.685 N/A ILE 105.A N ALA 56.A O no hydrogen 2.886 N/A GLU 106.A N ASN 90.A O no hydrogen 3.040 N/A TYR 110.A N LEU 166.A O no hydrogen 3.027 N/A GLY 111.A N CYS 108.A O no hydrogen 3.237 N/A LEU 113.A N ILE 164.A O no hydrogen 2.548 N/A ASN 115.A N ASP 112.A OD2 no hydrogen 2.781 N/A ASN 115.A ND2 ASP 112.A OD1 no hydrogen 3.388 N/A ASN 115.A ND2 ASP 112.A OD2 no hydrogen 3.238 N/A PHE 116.A N ASP 112.A O no hydrogen 3.111 N/A LEU 117.A N LEU 113.A O no hydrogen 2.985 N/A ARG 118.A N LEU 114.A O no hydrogen 3.284 N/A ARG 118.A NE GLY 227.A O no hydrogen 2.877 N/A ARG 118.A NH2 GLY 227.A O no hydrogen 3.357 N/A ARG 119.A N ASN 115.A O no hydrogen 3.102 N/A LYS 120.A N PHE 116.A O no hydrogen 3.161 N/A ARG 121.A NE LEU 226.A O no hydrogen 3.172 N/A VAL 125.A N LEU 130.A O no hydrogen 3.201 N/A THR 131.A OG1 HIS 134.A ND1 no hydrogen 2.609 N/A LEU 132.A N PRO 126.A O no hydrogen 3.421 N/A LEU 136.A N LEU 132.A O no hydrogen 3.087 N/A SER 137.A N GLU 133.A O no hydrogen 3.109 N/A PHE 138.A N HIS 134.A O no hydrogen 2.896 N/A SER 139.A N LEU 135.A O no hydrogen 3.062 N/A SER 139.A OG LEU 135.A O no hydrogen 3.136 N/A SER 139.A OG LEU 136.A O no hydrogen 2.724 N/A TYR 140.A N LEU 136.A O no hydrogen 3.009 N/A GLN 141.A N SER 137.A O no hydrogen 2.833 N/A GLN 141.A NE2 SER 137.A O no hydrogen 3.413 N/A GLN 141.A NE2 SER 137.A OG no hydrogen 2.835 N/A GLN 141.A NE2 ASN 170.A O no hydrogen 3.106 N/A VAL 142.A N PHE 138.A O no hydrogen 3.044 N/A ALA 143.A N SER 139.A O no hydrogen 3.184 N/A LYS 144.A N TYR 140.A O no hydrogen 3.151 N/A GLY 145.A N GLN 141.A O no hydrogen 3.118 N/A MET 146.A N VAL 142.A O no hydrogen 2.945 N/A ALA 147.A N ALA 143.A O no hydrogen 2.741 N/A PHE 148.A N LYS 144.A O no hydrogen 2.791 N/A LEU 149.A N GLY 145.A O no hydrogen 2.855 N/A ALA 150.A N MET 146.A O no hydrogen 2.764 N/A SER 151.A N ALA 147.A O no hydrogen 2.823 N/A SER 151.A OG ALA 147.A O no hydrogen 3.241 N/A SER 151.A OG PHE 148.A O no hydrogen 2.415 N/A LYS 152.A N LEU 149.A O no hydrogen 2.878 N/A LYS 152.A NZ LEU 82.A O no hydrogen 2.815 N/A ASN 153.A N ALA 150.A O no hydrogen 3.080 N/A CYS 154.A N LEU 149.A O no hydrogen 3.102 N/A CYS 154.A SG.A ILE 155.A O no hydrogen 3.704 N/A CYS 154.A SG.A ARG 181.A O no hydrogen 3.771 N/A CYS 154.A SG.B LYS 152.A O no hydrogen 3.381 N/A CYS 154.A SG.B ASP 182.A OD1 no hydrogen 3.610 N/A ILE 155.A N ARG 181.A O no hydrogen 3.025 N/A HIS 156.A N ASP 212.A OD2 no hydrogen 2.667 N/A HIS 156.A NE2 CYS 175.A O no hydrogen 2.874 N/A ARG 157.A N ASP 212.A OD1 no hydrogen 3.019 N/A ARG 157.A NE LEU 179.A O no hydrogen 2.861 N/A ARG 157.A NH1 ASP 189.A OD1 no hydrogen 3.340 N/A ASP 158.A N HIS 156.A ND1 no hydrogen 3.115 N/A ALA 161.A N GLU 222.A OE1 no hydrogen 3.035 N/A ARG 162.A NH2 ASP 158.A OD1 no hydrogen 3.398 N/A ASN 163.A N ALA 160.A O no hydrogen 2.950 N/A ASN 163.A ND2 ASP 158.A O no hydrogen 2.794 N/A ASN 163.A ND2 ASP 158.A OD2 no hydrogen 3.037 N/A ILE 164.A N ALA 161.A O no hydrogen 3.161 N/A LEU 165.A N LYS 173.A O no hydrogen 2.837 N/A LEU 166.A N GLY 111.A O no hydrogen 2.875 N/A THR 167.A N ILE 171.A O no hydrogen 2.904 N/A HIS 168.A N THR 167.A OG1 no hydrogen 2.575 N/A THR 172.A N GLN 141.A OE1 no hydrogen 2.926 N/A THR 172.A OG1 GLN 141.A OE1 no hydrogen 3.554 N/A LYS 173.A N LEU 165.A O no hydrogen 2.812 N/A LYS 173.A NZ GLU 86.A O no hydrogen 2.451 N/A LYS 173.A NZ ILE 88.A O no hydrogen 3.001 N/A LYS 173.A NZ GLU 106.A OE1 no hydrogen 3.282 N/A ILE 174.A N ASN 87.A O no hydrogen 2.881 N/A CYS 175.A N ASN 163.A O no hydrogen 3.111 N/A CYS 175.A SG ASN 163.A O no hydrogen 3.252 N/A PHE 177.A N GLU 75.A OE2 no hydrogen 3.165 N/A GLY 178.A N ASP 176.A OD1 no hydrogen 3.475 N/A ALA 180.A N PHE 177.A O no hydrogen 3.272 N/A ARG 181.A N ILE 155.A O no hydrogen 3.085 N/A ARG 181.A NE TYR 187.A OH no hydrogen 3.547 N/A ARG 181.A NH1 GLY 178.A O no hydrogen 3.329 N/A ARG 181.A NH1 ALA 180.A O no hydrogen 2.629 N/A ILE 183.A N ASN 153.A O no hydrogen 3.014 N/A TYR 187.A N TYR 207.A O no hydrogen 2.871 N/A ASP 189.A N SER 205.A O no hydrogen 2.960 N/A LYS 195.A NZ PRO 230.A O no hydrogen 3.164 N/A LYS 195.A NZ TYR 231.A O no hydrogen 3.173 N/A LYS 195.A NZ MET 234.A O no hydrogen 2.652 N/A TRP 196.A N PRO 193.A O no hydrogen 3.101 N/A TRP 196.A NE1 GLU 222.A OE1 no hydrogen 2.844 N/A MET 197.A N VAL 194.A O no hydrogen 3.062 N/A GLU 200.A N GLU 200.A OE1 no hydrogen 2.806 N/A SER 201.A N ALA 198.A O no hydrogen 2.937 N/A SER 201.A OG VAL 206.A O no hydrogen 2.862 N/A ILE 202.A N ALA 198.A O no hydrogen 3.133 N/A PHE 203.A N PRO 199.A O no hydrogen 2.903 N/A ASN 204.A N GLU 200.A O no hydrogen 3.015 N/A SER 205.A N SER 201.A O no hydrogen 3.061 N/A VAL 206.A N GLU 200.A O no hydrogen 3.408 N/A TYR 207.A N TYR 187.A O no hydrogen 2.582 N/A THR 208.A N SER 211.A OG no hydrogen 3.030 N/A THR 208.A OG1 GLU 210.A OE1 no hydrogen 3.176 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 2.745 N/A SER 211.A N THR 208.A OG1 no hydrogen 2.897 N/A SER 211.A OG THR 208.A O no hydrogen 3.070 N/A ASP 212.A N THR 208.A O no hydrogen 3.280 N/A VAL 213.A N PHE 209.A O no hydrogen 3.221 N/A TRP 214.A N GLU 210.A O no hydrogen 2.991 N/A SER 215.A N SER 211.A O no hydrogen 3.126 N/A SER 215.A OG TRP 196.A O no hydrogen 2.548 N/A SER 215.A OG SER 211.A O no hydrogen 3.518 N/A TYR 216.A N ASP 212.A O no hydrogen 2.804 N/A TYR 216.A OH SER 139.A O no hydrogen 2.697 N/A GLY 217.A N VAL 213.A O no hydrogen 3.002 N/A ILE 218.A N TRP 214.A O no hydrogen 3.048 N/A PHE 219.A N SER 215.A O no hydrogen 2.875 N/A LEU 220.A N TYR 216.A O no hydrogen 2.855 N/A TRP 221.A N GLY 217.A O no hydrogen 3.248 N/A TRP 221.A NE1 SER 251.A O no hydrogen 3.168 N/A GLU 222.A N ILE 218.A O no hydrogen 3.042 N/A LEU 223.A N PHE 219.A O no hydrogen 2.791 N/A PHE 224.A N LEU 220.A O no hydrogen 2.991 N/A SER 225.A N TRP 221.A O no hydrogen 3.035 N/A SER 225.A OG TRP 221.A O no hydrogen 2.889 N/A SER 225.A OG GLU 222.A O no hydrogen 3.364 N/A LEU 226.A N LEU 223.A O no hydrogen 3.330 N/A GLY 227.A N GLU 222.A O no hydrogen 2.960 N/A SER 228.A N SER 225.A OG no hydrogen 3.202 N/A SER 228.A OG.A SER 229.A O no hydrogen 3.344 N/A SER 228.A OG.B SER 225.A O no hydrogen 3.445 N/A MET 234.A N TYR 231.A O no hydrogen 3.129 N/A PHE 240.A N ASP 237.A OD1 no hydrogen 3.030 N/A TYR 241.A N ASP 237.A O no hydrogen 3.304 N/A LYS 242.A N SER 238.A O no hydrogen 3.244 N/A LYS 242.A NZ GLU 246.A OE2 no hydrogen 2.636 N/A MET 243.A N LYS 239.A O no hydrogen 3.011 N/A ILE 244.A N PHE 240.A O no hydrogen 3.071 N/A LYS 245.A N TYR 241.A O no hydrogen 3.045 N/A GLU 246.A N LYS 242.A O no hydrogen 2.933 N/A GLY 247.A N MET 243.A O no hydrogen 2.957 N/A GLY 247.A N ILE 244.A O no hydrogen 3.056 N/A PHE 248.A N MET 243.A O no hydrogen 2.704 N/A ARG 249.A NE TRP 268.A O no hydrogen 2.794 N/A ARG 249.A NH1 ILE 244.A O no hydrogen 3.226 N/A ARG 249.A NH1 PHE 248.A O no hydrogen 2.667 N/A ARG 249.A NH2 TRP 268.A O no hydrogen 3.247 N/A SER 252.A OG PRO 253.A O no hydrogen 3.309 N/A ALA 256.A N PRO 253.A O no hydrogen 3.191 N/A TYR 261.A N PRO 257.A O no hydrogen 2.920 N/A TYR 261.A OH MET 250.A O no hydrogen 2.877 N/A ASP 262.A N ALA 258.A O no hydrogen 2.897 N/A ILE 263.A N GLU 259.A O no hydrogen 3.329 N/A MET 264.A N MET 260.A O no hydrogen 3.178 N/A LYS 265.A N TYR 261.A O no hydrogen 3.052 N/A THR 266.A N ASP 262.A O no hydrogen 3.244 N/A THR 266.A OG1 ILE 263.A O no hydrogen 2.761 N/A CYS 267.A N ILE 263.A O no hydrogen 2.850 N/A CYS 267.A SG VAL 213.A O no hydrogen 3.419 N/A CYS 267.A SG ILE 263.A O no hydrogen 3.244 N/A TRP 268.A N MET 264.A O no hydrogen 2.982 N/A ASP 269.A N THR 266.A O no hydrogen 3.357 N/A ASP 271.A N ASP 269.A OD1 no hydrogen 2.675 N/A ASP 273.A N ASP 271.A OD1 no hydrogen 3.077 N/A LYS 274.A N ASP 271.A O no hydrogen 3.118 N/A ARG 275.A N PRO 272.A O no hydrogen 3.087 N/A ARG 275.A NE ASP 269.A O no hydrogen 2.880 N/A ARG 275.A NH1 GLU 200.A OE2 no hydrogen 2.808 N/A ARG 275.A NH1 GLU 210.A O no hydrogen 3.072 N/A ARG 275.A NH2 GLU 200.A OE1 no hydrogen 2.947 N/A ARG 275.A NH2 ASP 269.A O no hydrogen 3.150 N/A THR 277.A N GLN 280.A OE1 no hydrogen 3.056 N/A GLN 280.A N THR 277.A OG1 no hydrogen 3.124 N/A ILE 281.A N THR 277.A O no hydrogen 2.983 N/A VAL 282.A N PHE 278.A O no hydrogen 3.040 N/A GLN 283.A N LYS 279.A O no hydrogen 3.407 N/A ASP 284.A N GLN 280.A O no hydrogen 3.030 N/A ILE 285.A N ILE 281.A O no hydrogen 2.940 N/A GLU 286.A N VAL 282.A O no hydrogen 2.662 N/A LYS 287.A N GLN 283.A O no hydrogen 2.901 N/A GLN 288.A N ASP 284.A O no hydrogen 3.062 N/A ILE 289.A N ILE 285.A O no hydrogen 3.016 N/A SER 290.A N GLU 286.A O no hydrogen 3.296 N/A SER 290.A OG GLU 286.A O no hydrogen 3.426 N/A SER 290.A OG LYS 287.A O no hydrogen 2.696 N/A GLU 291.A N LYS 287.A O no hydrogen 3.096 N/A SER 292.A N GLN 288.A O no hydrogen 2.845 N/A SER 292.A N ILE 289.A O no hydrogen 3.175 N/A