Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q0x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 ASP 48.A OD1 no hydrogen 3.338 N/A HIS 9.A N MET 25.A O no hydrogen 2.854 N/A PHE 11.A N VAL 23.A O no hydrogen 3.035 N/A TYR 13.A N ILE 21.A O no hydrogen 3.065 N/A TYR 13.A OH ASP 86.A O no hydrogen 2.858 N/A LYS 15.A N CYS 19.A O no hydrogen 3.172 N/A LYS 15.A NZ SER 75.A O no hydrogen 2.941 N/A TYR 18.A N ASP 16.A O no hydrogen 2.704 N/A TYR 18.A N ASP 16.A OD1 no hydrogen 2.586 N/A CYS 19.A N ASP 16.A O no hydrogen 3.276 N/A CYS 19.A SG.A ASP 16.A OD2 no hydrogen 3.055 N/A ILE 21.A N TYR 13.A O no hydrogen 3.007 N/A VAL 23.A N PHE 11.A O no hydrogen 2.809 N/A PHE 24.A N GLN 65.A O no hydrogen 2.938 N/A MET 25.A N HIS 9.A O no hydrogen 2.899 N/A MET 26.A N PHE 63.A O no hydrogen 2.822 N/A ALA 30.A N ASN 27.A O no hydrogen 3.468 N/A ARG 32.A NE ASP 60.A O no hydrogen 3.197 N/A ARG 32.A NH1 GLU 102.A OE1 no hydrogen 3.091 N/A ARG 32.A NH1 ASP 288.A OD1 no hydrogen 3.156 N/A ARG 32.A NH2 ASP 60.A OD1 no hydrogen 2.803 N/A ARG 32.A NH2 ASP 288.A OD2 no hydrogen 3.187 N/A CYS 33.A N GLU 102.A O no hydrogen 3.118 N/A VAL 34.A N ALA 62.A O no hydrogen 2.907 N/A LEU 35.A N ALA 104.A O no hydrogen 2.899 N/A TRP 36.A N VAL 64.A O no hydrogen 2.850 N/A TRP 36.A NE1 THR 108.A OG1 no hydrogen 2.906 N/A VAL 37.A N PHE 106.A O no hydrogen 2.994 N/A GLY 39.A N GLU 42.A OE1 no hydrogen 2.667 N/A GLN 40.A NE2 SER 70.A O no hydrogen 2.828 N/A GLN 40.A NE2 THR 181.A OG1 no hydrogen 3.136 N/A GLU 42.A N GLY 39.A O no hydrogen 3.136 N/A SER 43.A OG LEU 44.A O no hydrogen 2.873 N/A LEU 44.A N GLU 67.A OE1 no hydrogen 2.955 N/A LEU 45.A N GLN 65.A OE1 no hydrogen 2.639 N/A TYR 49.A OH HIS 276.A ND1 no hydrogen 2.773 N/A PHE 50.A N PHE 47.A O no hydrogen 3.064 N/A THR 51.A N ASP 48.A O no hydrogen 3.137 N/A THR 51.A OG1 ASP 48.A O no hydrogen 2.930 N/A LEU 53.A N TYR 49.A O no hydrogen 2.773 N/A ALA 54.A N PHE 50.A O no hydrogen 2.927 N/A GLU 55.A N THR 51.A O no hydrogen 3.097 N/A GLU 56.A N ASN 52.A O no hydrogen 2.870 N/A LEU 57.A N LEU 53.A O no hydrogen 2.872 N/A GLN 58.A N GLU 55.A O no hydrogen 3.299 N/A ASP 60.A N LEU 57.A O no hydrogen 2.858 N/A TRP 61.A N LEU 57.A O no hydrogen 2.911 N/A ALA 62.A N ARG 32.A O no hydrogen 2.888 N/A PHE 63.A N MET 26.A O no hydrogen 3.001 N/A VAL 64.A N VAL 34.A O no hydrogen 2.804 N/A GLN 65.A N PHE 24.A O no hydrogen 2.982 N/A VAL 66.A N TRP 36.A O no hydrogen 3.336 N/A SER 70.A N ASP 83.A OD1 no hydrogen 3.236 N/A SER 70.A OG ASP 83.A OD1 no hydrogen 3.373 N/A SER 70.A OG ASP 83.A OD2 no hydrogen 2.333 N/A GLY 71.A N VAL 68.A O no hydrogen 2.891 N/A LYS 72.A N PRO 69.A O no hydrogen 3.072 N/A GLY 74.A N GLU 167.A OE2 no hydrogen 2.722 N/A GLN 78.A N SER 75.A OG no hydrogen 3.308 N/A GLN 78.A NE2 ASP 83.A OD1 no hydrogen 2.626 N/A GLN 78.A NE2 ASP 86.A OD2 no hydrogen 2.918 N/A HIS 80.A NE2 GLU 117.A OE1 no hydrogen 3.067 N/A HIS 82.A N ASP 79.A OD1 no hydrogen 3.140 N/A HIS 82.A ND1 ASP 79.A OD1 no hydrogen 2.738 N/A ASP 83.A N ASP 79.A O no hydrogen 3.250 N/A ALA 84.A N HIS 80.A O no hydrogen 2.986 N/A GLU 85.A N ALA 81.A O no hydrogen 2.999 N/A ASP 86.A N HIS 82.A O no hydrogen 2.946 N/A VAL 87.A N ASP 83.A O no hydrogen 2.927 N/A ASP 88.A N ALA 84.A O no hydrogen 2.811 N/A ASP 89.A N GLU 85.A O no hydrogen 2.986 N/A LEU 90.A N ASP 86.A O no hydrogen 3.181 N/A ILE 91.A N VAL 87.A O no hydrogen 2.938 N/A GLY 92.A N ASP 88.A O no hydrogen 2.971 N/A ILE 93.A N ASP 89.A O no hydrogen 3.058 N/A LEU 94.A N LEU 90.A O no hydrogen 2.808 N/A LEU 95.A N ILE 91.A O no hydrogen 2.936 N/A ARG 96.A N GLY 92.A O no hydrogen 3.016 N/A ASP 97.A N ILE 93.A O no hydrogen 2.727 N/A HIS 98.A N LEU 94.A O no hydrogen 3.128 N/A MET 100.A N LEU 94.A O no hydrogen 3.365 N/A ASN 101.A N ARG 31.A O no hydrogen 2.674 N/A VAL 103.A N SER 127.A O no hydrogen 2.824 N/A ALA 104.A N CYS 33.A O no hydrogen 2.885 N/A LEU 105.A N ARG 130.A O no hydrogen 2.904 N/A PHE 106.A N LEU 35.A O no hydrogen 2.778 N/A ALA 107.A N ILE 132.A O no hydrogen 2.972 N/A THR 108.A N VAL 37.A O no hydrogen 3.191 N/A THR 108.A OG1 GLU 42.A OE1 no hydrogen 2.781 N/A THR 108.A OG1 GLU 42.A OE2 no hydrogen 3.504 N/A GLY 111.A N THR 108.A O no hydrogen 3.019 N/A THR 112.A N SER 109.A O no hydrogen 3.401 N/A THR 112.A OG1 SER 109.A O no hydrogen 3.138 N/A THR 112.A OG1 PRO 191.A O no hydrogen 3.409 N/A GLN 113.A N THR 110.A O no hydrogen 3.196 N/A GLN 113.A NE2 ARG 184.A O no hydrogen 3.179 N/A GLN 113.A NE2 GLY 188.A O no hydrogen 2.794 N/A LEU 114.A N GLY 111.A O no hydrogen 2.987 N/A VAL 115.A N GLY 111.A O no hydrogen 3.372 N/A PHE 116.A N THR 112.A O no hydrogen 3.305 N/A GLU 117.A N GLN 113.A O no hydrogen 3.521 N/A LEU 118.A N LEU 114.A O no hydrogen 2.791 N/A LEU 119.A N VAL 115.A O no hydrogen 2.841 N/A GLU 120.A N PHE 116.A O no hydrogen 3.289 N/A ASN 121.A N GLU 117.A O no hydrogen 3.186 N/A ASN 121.A N LEU 118.A O no hydrogen 3.012 N/A ASN 121.A ND2 GLU 117.A O no hydrogen 3.543 N/A ASN 121.A ND2 GLU 120.A OE1 no hydrogen 3.295 N/A SER 122.A N LEU 118.A O no hydrogen 2.625 N/A SER 122.A OG ASP 88.A OD1 no hydrogen 2.515 N/A SER 122.A OG ASP 88.A OD2 no hydrogen 3.510 N/A ALA 123.A N ASP 88.A OD2 no hydrogen 2.917 N/A HIS 124.A N SER 122.A OG no hydrogen 2.808 N/A HIS 124.A ND1 ASP 88.A OD1 no hydrogen 3.243 N/A LYS 125.A NZ GLU 120.A O no hydrogen 2.917 N/A SER 127.A N HIS 124.A O no hydrogen 2.941 N/A ILE 128.A N LYS 125.A O no hydrogen 3.357 N/A THR 129.A N VAL 103.A O no hydrogen 3.000 N/A THR 129.A OG1 GLU 102.A OE2 no hydrogen 2.448 N/A ARG 130.A NE THR 129.A O no hydrogen 3.034 N/A ARG 130.A NH1 ASP 288.A OD1 no hydrogen 3.135 N/A ARG 130.A NH2 GLU 287.A O no hydrogen 3.423 N/A VAL 131.A N PRO 219.A O no hydrogen 3.000 N/A ILE 132.A N LEU 105.A O no hydrogen 2.703 N/A LEU 133.A N LEU 221.A O no hydrogen 2.916 N/A HIS 134.A N ALA 107.A O no hydrogen 2.989 N/A HIS 134.A NE2 ASP 260.A OD2 no hydrogen 2.729 N/A GLY 135.A N MET 223.A O no hydrogen 2.937 N/A VAL 137.A N ALA 225.A O no hydrogen 2.862 N/A CYS 138.A N GLN 194.A OE1 no hydrogen 2.875 N/A CYS 138.A SG ASP 139.A O no hydrogen 3.695 N/A GLU 141.A N ASP 139.A OD1 no hydrogen 2.951 N/A ASN 142.A N ASP 139.A O no hydrogen 2.919 N/A LEU 144.A N ASN 142.A OD1 no hydrogen 3.122 N/A PHE 145.A N ASN 142.A O no hydrogen 2.835 N/A THR 146.A N ASN 142.A O no hydrogen 3.146 N/A THR 146.A OG1 PRO 143.A O no hydrogen 3.425 N/A GLY 149.A N THR 146.A OG1 no hydrogen 3.296 N/A CYS 150.A N THR 146.A O no hydrogen 3.018 N/A CYS 150.A SG PHE 145.A O no hydrogen 3.733 N/A CYS 150.A SG THR 146.A O no hydrogen 3.457 N/A ALA 151.A N PRO 147.A O no hydrogen 3.128 N/A ALA 152.A N GLU 148.A O no hydrogen 2.709 N/A ARG 153.A N GLY 149.A O no hydrogen 2.961 N/A ARG 153.A NE HIS 175.A O no hydrogen 3.341 N/A LYS 154.A N CYS 150.A O no hydrogen 2.906 N/A LYS 154.A NZ GLU 158.A OE2 no hydrogen 3.308 N/A GLU 155.A N ALA 151.A O no hydrogen 3.027 N/A HIS 156.A N ALA 152.A O no hydrogen 2.953 N/A HIS 156.A NE2 ALA 171.A O no hydrogen 2.839 N/A VAL 157.A N ARG 153.A O no hydrogen 3.039 N/A GLU 158.A N LYS 154.A O no hydrogen 3.229 N/A LYS 159.A N GLU 155.A O no hydrogen 3.054 N/A LEU 160.A N HIS 156.A O no hydrogen 3.189 N/A MET 161.A N VAL 157.A O no hydrogen 2.968 N/A ALA 162.A N GLU 158.A O no hydrogen 3.183 N/A GLU 163.A N LYS 159.A O no hydrogen 3.204 N/A GLY 164.A N MET 161.A O no hydrogen 3.306 N/A ARG 165.A N LEU 160.A O no hydrogen 2.816 N/A ARG 165.A NE GLU 163.A OE1 no hydrogen 3.403 N/A ARG 165.A NH1 ASP 168.A OD2 no hydrogen 3.089 N/A ASP 168.A N ARG 165.A O no hydrogen 2.965 N/A ALA 171.A N ASP 168.A O no hydrogen 3.155 N/A MET 172.A N SER 169.A O no hydrogen 3.003 N/A TYR 176.A N MET 172.A O no hydrogen 2.937 N/A TYR 176.A OH GLU 195.A OE1 no hydrogen 3.287 N/A TYR 176.A OH GLU 195.A OE2 no hydrogen 2.781 N/A ILE 178.A N ASP 177.A OD1 no hydrogen 2.776 N/A THR 181.A N GLN 40.A OE1 no hydrogen 3.203 N/A ALA 183.A N GLY 166.A O no hydrogen 2.909 N/A ARG 184.A N THR 181.A O no hydrogen 3.058 N/A ARG 184.A N THR 181.A OG1 no hydrogen 3.349 N/A ARG 184.A NE GLN 113.A OE1 no hydrogen 2.984 N/A ARG 184.A NH1 SER 70.A OG no hydrogen 3.092 N/A ARG 184.A NH2 GLN 113.A OE1 no hydrogen 2.948 N/A LEU 185.A N THR 181.A O no hydrogen 3.319 N/A ALA 186.A N PRO 182.A O no hydrogen 2.827 N/A GLY 188.A N LEU 185.A O no hydrogen 3.290 N/A THR 192.A N GLU 195.A OE1 no hydrogen 3.045 N/A THR 192.A OG1 TYR 176.A OH no hydrogen 3.375 N/A THR 192.A OG1 GLU 195.A OE1 no hydrogen 2.561 N/A GLN 194.A N THR 192.A OG1 no hydrogen 3.330 N/A GLN 194.A NE2 CYS 138.A O no hydrogen 2.956 N/A GLN 194.A NE2 ASN 199.A OD1 no hydrogen 2.872 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.945 N/A ALA 196.A N THR 192.A O no hydrogen 3.068 N/A VAL 197.A N LEU 193.A O no hydrogen 2.881 N/A TRP 198.A N LEU 193.A O no hydrogen 2.943 N/A TRP 198.A NE1 TYR 230.A OH no hydrogen 3.112 N/A ASN 199.A N GLN 194.A O no hydrogen 2.848 N/A CYS 201.A N VAL 197.A O no hydrogen 3.004 N/A CYS 201.A SG VAL 240.A O no hydrogen 3.764 N/A ILE 202.A N TRP 198.A O no hydrogen 2.962 N/A ARG 203.A N ASN 199.A O no hydrogen 2.948 N/A ARG 203.A NH1 PHE 145.A O no hydrogen 2.894 N/A ARG 203.A NH2 PRO 140.A O no hydrogen 2.991 N/A ARG 203.A NH2 GLU 141.A OE2 no hydrogen 3.228 N/A ARG 203.A NH2 PHE 145.A O no hydrogen 3.063 N/A LYS 204.A N CYS 201.A O no hydrogen 3.291 N/A GLU 205.A N PRO 200.A O no hydrogen 2.788 N/A VAL 208.A N GLU 205.A O no hydrogen 3.253 N/A ARG 210.A N ASP 207.A O no hydrogen 3.214 N/A ARG 211.A N VAL 208.A O no hydrogen 3.028 N/A ARG 211.A NE ASP 207.A O no hydrogen 3.491 N/A SER 212.A N LEU 209.A O no hydrogen 3.143 N/A SER 212.A OG ALA 196.A O no hydrogen 2.804 N/A SER 212.A OG LEU 209.A O no hydrogen 3.347 N/A VAL 213.A N SER 212.A OG no hydrogen 2.693 N/A GLY 214.A N LEU 209.A O no hydrogen 2.841 N/A VAL 215.A N SER 212.A O no hydrogen 3.165 N/A ILE 216.A N VAL 213.A O no hydrogen 3.109 N/A LYS 217.A NZ GLY 214.A O no hydrogen 2.879 N/A LEU 220.A N ARG 252.A O no hydrogen 2.973 N/A LEU 221.A N VAL 131.A O no hydrogen 2.964 N/A LEU 222.A N THR 254.A O no hydrogen 2.835 N/A MET 223.A N LEU 133.A O no hydrogen 2.725 N/A LEU 224.A N SER 256.A O no hydrogen 2.801 N/A ALA 225.A N GLY 135.A O no hydrogen 3.001 N/A HIS 226.A ND1 ASN 227.A O no hydrogen 2.847 N/A ASN 227.A ND2 CYS 262.A O no hydrogen 2.599 N/A GLN 229.A N ASN 227.A OD1 no hydrogen 3.064 N/A TYR 230.A N ASN 227.A O no hydrogen 3.002 N/A SER 233.A N GLU 236.A OE1 no hydrogen 2.909 N/A SER 233.A OG GLU 236.A OE1 no hydrogen 2.718 N/A GLU 236.A N SER 233.A OG no hydrogen 3.326 N/A VAL 237.A N SER 233.A O no hydrogen 3.023 N/A GLY 238.A N ASP 234.A O no hydrogen 2.854 N/A THR 239.A N GLU 235.A O no hydrogen 2.829 N/A THR 239.A OG1 GLU 235.A O no hydrogen 3.107 N/A VAL 240.A N GLU 236.A O no hydrogen 3.022 N/A LEU 241.A N VAL 237.A O no hydrogen 2.921 N/A GLU 242.A N GLY 238.A O no hydrogen 2.893 N/A GLY 243.A N THR 239.A O no hydrogen 2.881 N/A VAL 244.A N VAL 240.A O no hydrogen 3.007 N/A ARG 245.A N LEU 241.A O no hydrogen 3.013 N/A ASP 246.A N GLU 242.A O no hydrogen 3.028 N/A HIS 247.A ND1 GLY 243.A O no hydrogen 2.985 N/A THR 248.A N VAL 244.A O no hydrogen 2.937 N/A THR 248.A OG1 VAL 244.A O no hydrogen 2.627 N/A GLY 249.A N VAL 213.A O no hydrogen 3.188 N/A ARG 252.A NE GLU 287.A OE1 no hydrogen 2.673 N/A ARG 252.A NH2 GLU 287.A OE1 no hydrogen 3.398 N/A ARG 252.A NH2 GLU 287.A OE2 no hydrogen 3.216 N/A VAL 253.A N ASN 251.A O no hydrogen 3.032 N/A THR 254.A N LEU 220.A O no hydrogen 2.796 N/A SER 256.A N LEU 222.A O no hydrogen 2.888 N/A PHE 258.A N LEU 224.A O no hydrogen 2.777 N/A ASN 259.A N GLU 275.A OE1 no hydrogen 2.907 N/A ASN 259.A ND2 GLU 275.A OE2 no hydrogen 2.498 N/A THR 261.A N LYS 270.A O no hydrogen 2.696 N/A CYS 262.A SG ASP 260.A O no hydrogen 3.718 N/A ASP 263.A N ARG 267.A O no hydrogen 3.059 N/A LEU 265.A N ASP 263.A OD1 no hydrogen 2.809 N/A ARG 266.A NE ASP 177.A OD2 no hydrogen 2.711 N/A ARG 266.A NH1 VAL 136.A O no hydrogen 3.076 N/A ARG 266.A NH1 THR 192.A OG1 no hydrogen 3.092 N/A ARG 266.A NH2 TYR 176.A OH no hydrogen 2.933 N/A ARG 266.A NH2 ASP 177.A OD1 no hydrogen 3.127 N/A ARG 267.A N ASP 263.A OD1 no hydrogen 3.127 N/A LEU 269.A N THR 261.A O no hydrogen 2.677 N/A LYS 270.A N THR 261.A O no hydrogen 3.097 N/A ALA 272.A N ASP 260.A OD1 no hydrogen 2.815 N/A HIS 276.A N ALA 272.A O no hydrogen 2.966 N/A HIS 276.A ND1 TYR 49.A OH no hydrogen 2.773 N/A HIS 276.A NE2 ASP 260.A OD1 no hydrogen 2.699 N/A HIS 276.A NE2 ASP 260.A OD2 no hydrogen 3.082 N/A VAL 277.A N GLU 273.A O no hydrogen 3.084 N/A ALA 278.A N SER 274.A O no hydrogen 3.120 N/A ALA 279.A N GLU 275.A O no hydrogen 2.882 N/A ILE 280.A N HIS 276.A O no hydrogen 3.004 N/A LEU 281.A N VAL 277.A O no hydrogen 2.992 N/A GLN 282.A N ALA 278.A O no hydrogen 2.998 N/A PHE 283.A N ALA 279.A O no hydrogen 2.994 N/A LEU 284.A N ILE 280.A O no hydrogen 3.024 N/A ALA 285.A N LEU 281.A O no hydrogen 2.870 N/A ASP 286.A N GLN 282.A O no hydrogen 2.756 N/A GLU 287.A N PHE 283.A O no hydrogen 3.071 N/A ASP 288.A N LEU 284.A O no hydrogen 3.206 N/A GLU 289.A N ALA 285.A O no hydrogen 3.103 N/A PHE 290.A N ASP 286.A O no hydrogen 2.911 N/A ARG 291.A N GLU 287.A O no hydrogen 3.046 N/A ARG 291.A NH1 GLU 102.A OE1 no hydrogen 3.036 N/A ARG 291.A NH2 GLU 102.A OE1 no hydrogen 3.447 N/A ARG 291.A NH2 GLU 102.A OE2 no hydrogen 2.906 N/A THR 292.A N ASP 288.A O no hydrogen 3.124 N/A THR 292.A OG1 ASP 288.A O no hydrogen 2.710 N/A GLU 293.A N PHE 290.A O no hydrogen 3.250 N/A