Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xwx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N GLN 41.A O no hydrogen 2.962 N/A TYR 3.A N THR 93.A O no hydrogen 2.916 N/A SER 5.A N GLU 91.A O no hydrogen 2.820 N/A SER 5.A OG GLU 91.A OE2 no hydrogen 2.574 N/A SER 5.A OG THR 93.A OG1 no hydrogen 2.714 N/A VAL 7.A N GLU 91.A OE2 no hydrogen 2.914 N/A GLU 8.A N GLU 91.A OE1 no hydrogen 2.870 N/A GLY 10.A N GLU 91.A OE1 no hydrogen 3.087 N/A VAL 11.A N THR 89.A O no hydrogen 2.871 N/A GLU 13.A N GLU 13.A OE1 no hydrogen 2.708 N/A GLY 14.A N VAL 4.A O no hydrogen 3.070 N/A ARG 15.A N VAL 173.A O no hydrogen 2.858 N/A ARG 15.A NE ASP 175.A OD2 no hydrogen 2.943 N/A ARG 15.A NH2 ASP 175.A OD1 no hydrogen 2.875 N/A THR 17.A OG1 VAL 4.A O no hydrogen 2.576 N/A LEU 18.A N GLY 14.A O no hydrogen 3.184 N/A LEU 18.A N ARG 15.A O no hydrogen 3.209 N/A CYS 19.A N VAL 16.A O no hydrogen 3.002 N/A CYS 19.A SG ARG 15.A O no hydrogen 3.736 N/A LYS 20.A N THR 17.A O no hydrogen 2.954 N/A PHE 21.A N THR 17.A O no hydrogen 2.810 N/A ALA 23.A N GLU 28.A O no hydrogen 2.855 N/A ASN 24.A N GLU 13.A OE2 no hydrogen 2.946 N/A THR 26.A OG1 GLU 28.A OE2 no hydrogen 2.674 N/A GLY 27.A N ALA 23.A O no hydrogen 3.087 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.315 N/A ASN 30.A N LEU 18.A O no hydrogen 2.878 N/A THR 31.A OG1 HIS 32.A ND1 no hydrogen 2.921 N/A HIS 32.A ND1 THR 31.A OG1 no hydrogen 2.921 N/A CYS 33.A SG THR 31.A O no hydrogen 3.748 N/A ILE 36.A N LEU 66.A O no hydrogen 3.101 N/A GLN 37.A N GLY 34.A O no hydrogen 3.027 N/A TYR 38.A N ALA 35.A O no hydrogen 3.122 N/A GLU 39.A N ILE 36.A O no hydrogen 2.973 N/A GLN 41.A N GLN 41.A OE1 no hydrogen 2.871 N/A SER 42.A N GLU 39.A O no hydrogen 3.035 N/A SER 42.A OG GLU 39.A OE1 no hydrogen 2.935 N/A GLY 45.A N SER 169.A O no hydrogen 2.819 N/A ASP 47.A N ALA 167.A O no hydrogen 3.091 N/A THR 52.A N GLY 48.A O no hydrogen 2.956 N/A THR 52.A OG1 GLY 48.A O no hydrogen 3.229 N/A ARG 55.A N GLU 63.A OE2 no hydrogen 2.902 N/A GLY 57.A N LEU 118.A O no hydrogen 3.008 N/A LYS 58.A N ARG 55.A O no hydrogen 2.793 N/A SER 61.A N ASP 71.A OD1 no hydrogen 3.060 N/A SER 61.A OG LYS 58.A O no hydrogen 3.471 N/A SER 61.A OG ASP 71.A OD1 no hydrogen 3.334 N/A SER 61.A OG ASP 71.A OD2 no hydrogen 2.646 N/A ALA 62.A N ILE 59.A O no hydrogen 3.067 N/A GLU 63.A N LYS 58.A O no hydrogen 3.201 N/A GLU 63.A N SER 61.A OG no hydrogen 3.206 N/A SER 64.A N SER 61.A O no hydrogen 2.899 N/A LEU 66.A N SER 64.A OG no hydrogen 3.127 N/A ALA 67.A N SER 64.A O no hydrogen 3.302 N/A LEU 70.A N ALA 67.A O no hydrogen 2.991 N/A ASP 71.A N ALA 68.A O no hydrogen 3.263 N/A GLU 72.A N ALA 69.A O no hydrogen 3.278 N/A THR 74.A OG1 ASP 76.A OD1 no hydrogen 3.148 N/A ALA 75.A N ASN 115.A OD1 no hydrogen 2.857 N/A ARG 77.A NE GLU 72.A OE1 no hydrogen 3.066 N/A ARG 77.A NH1 THR 31.A O no hydrogen 3.165 N/A ARG 77.A NH1 ARG 77.A O no hydrogen 3.154 N/A ARG 77.A NH2 THR 31.A O no hydrogen 2.826 N/A TRP 78.A NE1 GLU 72.A O no hydrogen 2.966 N/A LYS 80.A NZ ALA 75.A O no hydrogen 3.060 N/A LYS 80.A NZ TRP 78.A O no hydrogen 2.677 N/A ARG 81.A N ASP 175.A O no hydrogen 2.903 N/A ARG 81.A NE GLU 13.A OE1 no hydrogen 2.866 N/A ILE 83.A N LYS 177.A O no hydrogen 3.114 N/A GLN 84.A NE2 ASP 179.A OD2 no hydrogen 2.812 N/A GLY 86.A N VAL 148.A O no hydrogen 2.717 N/A GLN 88.A N CYS 146.A O no hydrogen 2.791 N/A GLN 88.A NE2 GLN 84.A O no hydrogen 3.118 N/A GLN 88.A NE2 GLN 84.A OE1 no hydrogen 3.020 N/A THR 89.A OG1 ASN 9.A O no hydrogen 2.423 N/A PHE 90.A N HIS 144.A O no hydrogen 2.869 N/A TRP 92.A N VAL 142.A O no hydrogen 3.000 N/A TRP 92.A NE1 TYR 105.A OH no hydrogen 2.951 N/A THR 93.A N TYR 3.A O no hydrogen 2.804 N/A THR 93.A OG1 SER 5.A OG no hydrogen 2.714 N/A PHE 94.A N LYS 140.A O no hydrogen 2.788 N/A THR 95.A N HIS 1.A O no hydrogen 2.790 N/A THR 95.A OG1 HIS 1.A O no hydrogen 3.514 N/A ALA 96.A N HIS 1.A O no hydrogen 3.314 N/A ASN 97.A ND2 GLN 137.A OE1 no hydrogen 2.854 N/A THR 100.A N VAL 136.A O no hydrogen 2.860 N/A THR 100.A OG1 HIS 98.A O no hydrogen 3.107 N/A LYS 101.A N ASP 162.A O no hydrogen 2.837 N/A TRP 103.A N VAL 131.A O no hydrogen 2.894 N/A LYS 104.A N VAL 160.A O no hydrogen 2.907 N/A LYS 104.A NZ ASP 102.A OD2 no hydrogen 3.259 N/A TYR 105.A N CYS 129.A O no hydrogen 2.807 N/A TYR 105.A OH HIS 144.A ND1 no hydrogen 2.769 N/A TYR 106.A N LEU 158.A O no hydrogen 2.962 N/A THR 108.A N VAL 156.A O no hydrogen 3.077 N/A THR 108.A OG1 GLN 155.A OE1 no hydrogen 2.836 N/A THR 108.A OG1 VAL 156.A O no hydrogen 3.464 N/A LYS 109.A N ALA 122.A O no hydrogen 2.810 N/A LYS 109.A NZ ASP 121.A O no hydrogen 3.190 N/A TRP 112.A N LYS 109.A O no hydrogen 2.845 N/A TRP 112.A NE1 TYR 154.A O no hydrogen 3.019 N/A ASN 113.A ND2 GLN 116.A OE1 no hydrogen 3.219 N/A ASN 115.A N ASN 113.A OD1 no hydrogen 2.857 N/A GLN 116.A N ASN 113.A O no hydrogen 3.045 N/A ARG 120.A N ASP 56.A OD1 no hydrogen 3.021 N/A ARG 120.A NE PRO 50.A O no hydrogen 2.872 N/A ARG 120.A NH1 PRO 54.A O no hydrogen 2.974 N/A ARG 120.A NH1 ASP 56.A OD1 no hydrogen 2.842 N/A ARG 120.A NH2 PRO 50.A O no hydrogen 3.347 N/A ARG 120.A NH2 THR 52.A O no hydrogen 2.811 N/A ARG 120.A NH2 PRO 54.A O no hydrogen 2.821 N/A ALA 122.A N SER 119.A O no hydrogen 2.966 N/A PHE 123.A N ARG 120.A O no hydrogen 3.071 N/A ASP 124.A N ILE 107.A O no hydrogen 3.069 N/A ASN 126.A N ASP 124.A OD1 no hydrogen 3.059 N/A PHE 128.A N TYR 105.A O no hydrogen 2.781 N/A CYS 129.A N TYR 105.A O no hydrogen 3.503 N/A CYS 129.A SG GLU 145.A O no hydrogen 3.849 N/A VAL 131.A N TRP 103.A O no hydrogen 2.835 N/A GLY 133.A N LYS 101.A O no hydrogen 2.776 N/A VAL 136.A N GLY 133.A O no hydrogen 3.391 N/A ARG 141.A NH1 GLU 8.A OE1 no hydrogen 3.044 N/A VAL 142.A N TRP 92.A O no hydrogen 3.177 N/A HIS 144.A N PHE 90.A O no hydrogen 2.689 N/A HIS 144.A ND1 TYR 105.A OH no hydrogen 2.769 N/A CYS 146.A N GLN 88.A O no hydrogen 2.855 N/A VAL 148.A N GLY 86.A O no hydrogen 2.849 N/A ARG 151.A NE THR 108.A O no hydrogen 2.966 N/A ARG 151.A NH1 GLU 150.A O no hydrogen 2.928 N/A ARG 151.A NH2 THR 108.A O no hydrogen 2.922 N/A TYR 154.A OH GLN 73.A OE1 no hydrogen 3.229 N/A TYR 154.A OH ASP 175.A OD1 no hydrogen 2.767 N/A GLN 155.A N VAL 176.A O no hydrogen 2.983 N/A GLN 155.A NE2 GLU 152.A O no hydrogen 2.967 N/A VAL 156.A N THR 108.A OG1 no hydrogen 3.060 N/A ILE 157.A N ILE 174.A O no hydrogen 2.949 N/A LEU 158.A N TYR 106.A O no hydrogen 2.811 N/A ALA 159.A N ASN 172.A O no hydrogen 2.962 N/A VAL 160.A N LYS 104.A O no hydrogen 2.829 N/A TRP 161.A N PHE 170.A O no hydrogen 2.821 N/A TRP 161.A NE1 THR 100.A OG1 no hydrogen 2.734 N/A ASP 162.A N ASP 102.A O no hydrogen 2.851 N/A VAL 163.A N ALA 168.A O no hydrogen 3.214 N/A GLY 164.A N VAL 99.A O no hydrogen 2.834 N/A SER 169.A N GLY 45.A O no hydrogen 2.915 N/A SER 169.A OG ASP 162.A OD1 no hydrogen 2.838 N/A PHE 170.A N TRP 161.A O no hydrogen 2.807 N/A TYR 171.A N VAL 43.A O no hydrogen 3.073 N/A TYR 171.A OH PRO 46.A O no hydrogen 2.650 N/A ASN 172.A N ALA 159.A O no hydrogen 2.871 N/A ILE 174.A N ILE 157.A O no hydrogen 2.720 N/A VAL 176.A N GLN 155.A O no hydrogen 3.070 N/A LYS 177.A N ARG 81.A O no hydrogen 2.990 N/A PHE 178.A N GLY 153.A O no hydrogen 2.909 N/A ASP 179.A N ILE 83.A O no hydrogen 3.021 N/A ASP 181.A N ASP 181.A OD1 no hydrogen 2.471 N/A ASN 183.A N LEU 267.A O no hydrogen 2.816 N/A ASN 183.A ND2 GLU 269.A OE2 no hydrogen 3.291 N/A ALA 185.A N ILE 265.A O no hydrogen 2.866 N/A ILE 188.A N ASN 263.A O no hydrogen 2.826 N/A LEU 194.A N THR 226.A O no hydrogen 2.872 N/A SER 195.A N ASP 198.A OD2 no hydrogen 2.913 N/A GLY 197.A N ILE 220.A O no hydrogen 2.817 N/A ASP 198.A N SER 195.A O no hydrogen 2.945 N/A THR 199.A N GLN 281.A O no hydrogen 2.773 N/A VAL 200.A N LEU 218.A O no hydrogen 3.170 N/A TYR 201.A N GLY 279.A O no hydrogen 3.066 N/A THR 202.A N THR 216.A O no hydrogen 3.051 N/A ARG 203.A N GLU 277.A O no hydrogen 2.848 N/A ARG 203.A NE GLU 210.A OE1 no hydrogen 3.280 N/A ARG 203.A NE GLU 210.A OE2 no hydrogen 3.296 N/A ARG 203.A NH2 GLU 210.A OE1 no hydrogen 3.117 N/A PHE 205.A N SER 275.A O no hydrogen 2.961 N/A ASP 206.A N GLY 209.A O no hydrogen 2.804 N/A ASP 208.A N ASP 206.A OD1 no hydrogen 2.805 N/A GLY 209.A N ASP 206.A O no hydrogen 3.072 N/A ASN 211.A N VAL 204.A O no hydrogen 2.743 N/A ASN 211.A ND2 ASP 206.A OD2 no hydrogen 2.849 N/A ALA 213.A N ASN 211.A OD1 no hydrogen 3.020 N/A TYR 214.A N ASN 211.A O no hydrogen 3.210 N/A ARG 215.A N PRO 212.A O no hydrogen 3.321 N/A THR 216.A N THR 202.A OG1 no hydrogen 2.875 N/A LEU 218.A N VAL 200.A O no hydrogen 2.975 N/A ILE 220.A N ASP 198.A O no hydrogen 2.864 N/A LEU 225.A N SER 222.A O no hydrogen 3.018 N/A LEU 225.A N SER 222.A OG no hydrogen 3.327 N/A THR 226.A N GLU 223.A O no hydrogen 3.185 N/A THR 226.A OG1 GLU 223.A O no hydrogen 2.651 N/A ALA 228.A N ASP 193.A OD1 no hydrogen 3.087 N/A GLN 230.A N LYS 227.A O no hydrogen 2.789 N/A TRP 231.A N LYS 227.A O no hydrogen 3.045 N/A TRP 231.A NE1 MET 192.A O no hydrogen 3.129 N/A SER 232.A N ALA 228.A O no hydrogen 3.049 N/A SER 232.A OG GLY 261.A O no hydrogen 2.664 N/A TYR 233.A N ASN 229.A O no hydrogen 3.214 N/A ALA 234.A N GLN 230.A O no hydrogen 3.058 N/A LEU 235.A N TRP 231.A O no hydrogen 2.909 N/A ALA 236.A N SER 232.A O no hydrogen 3.047 N/A THR 237.A N TYR 233.A O no hydrogen 2.964 N/A THR 237.A OG1 TYR 233.A O no hydrogen 2.854 N/A LYS 238.A N ALA 234.A O no hydrogen 2.938 N/A LYS 238.A NZ GLU 217.A O no hydrogen 2.611 N/A ILE 239.A N LEU 235.A O no hydrogen 2.963 N/A ASN 240.A N ALA 236.A O no hydrogen 3.261 N/A ASN 240.A ND2 ALA 248.A O no hydrogen 2.987 N/A GLN 241.A N THR 237.A O no hydrogen 2.986 N/A THR 242.A N LYS 238.A O no hydrogen 3.030 N/A THR 242.A N ILE 239.A O no hydrogen 3.284 N/A THR 242.A OG1 LYS 238.A O no hydrogen 2.825 N/A GLN 243.A N ILE 239.A O no hydrogen 2.956 N/A GLN 243.A NE2 THR 216.A OG1 no hydrogen 3.027 N/A GLN 246.A NE2 TYR 214.A O no hydrogen 3.069 N/A ARG 247.A N TYR 266.A O no hydrogen 3.147 N/A ARG 247.A NH1 GLN 243.A O no hydrogen 2.997 N/A ARG 247.A NH1 GLN 246.A O no hydrogen 2.924 N/A ALA 248.A N ASN 240.A OD1 no hydrogen 2.888 N/A GLY 249.A N PRO 264.A O no hydrogen 3.018 N/A GLN 250.A N VAL 257.A O no hydrogen 2.894 N/A GLN 250.A NE2 ASP 76.A O no hydrogen 3.321 N/A GLN 250.A NE2 THR 262.A O no hydrogen 3.180 N/A ASN 252.A N GLN 255.A O no hydrogen 3.030 N/A VAL 257.A N GLN 250.A O no hydrogen 2.921 N/A VAL 259.A N ASN 263.A OD1 no hydrogen 2.869 N/A ASN 263.A N ILE 188.A O no hydrogen 2.926 N/A ASN 263.A ND2 SER 232.A OG no hydrogen 3.152 N/A ASN 263.A ND2 VAL 259.A O no hydrogen 2.855 N/A ILE 265.A N GLY 186.A O no hydrogen 2.809 N/A TYR 266.A N ARG 247.A O no hydrogen 2.808 N/A LEU 267.A N ASN 183.A O no hydrogen 2.680 N/A LYS 268.A N GLN 245.A O no hydrogen 3.019 N/A GLU 269.A N ASP 181.A O no hydrogen 2.775 N/A SER 271.A N LYS 268.A O no hydrogen 2.999 N/A SER 271.A OG LYS 268.A O no hydrogen 2.622 N/A LEU 273.A N SER 271.A OG no hydrogen 3.167 N/A LYS 274.A N PHE 205.A O no hydrogen 2.635 N/A VAL 276.A N ALA 185.A O no hydrogen 2.937 N/A GLU 277.A N ARG 203.A O no hydrogen 3.063 N/A GLY 279.A N TYR 201.A O no hydrogen 2.951 N/A GLN 281.A N THR 199.A O no hydrogen 2.706 N/A SER 290.A N GLN 316.A O no hydrogen 3.022 N/A THR 292.A N GLU 314.A O no hydrogen 3.033 N/A SER 294.A N THR 312.A O no hydrogen 2.804 N/A ALA 297.A N TYR 300.A OH no hydrogen 3.127 N/A TYR 300.A N MET 382.A O no hydrogen 2.718 N/A ILE 302.A N VAL 384.A O no hydrogen 2.821 N/A LEU 309.A N LEU 350.A O no hydrogen 2.776 N/A LEU 311.A N ILE 348.A O no hydrogen 2.893 N/A THR 312.A N SER 294.A O no hydrogen 2.740 N/A LEU 313.A N LYS 346.A O no hydrogen 2.906 N/A GLU 314.A N THR 292.A O no hydrogen 3.005 N/A ALA 315.A N GLU 344.A O no hydrogen 2.961 N/A GLN 316.A N SER 290.A O no hydrogen 2.686 N/A GLN 316.A NE2 GLU 288.A O no hydrogen 3.305 N/A GLY 317.A N ASP 342.A OD1 no hydrogen 2.629 N/A MET 319.A N MET 340.A O no hydrogen 3.107 N/A SER 320.A N LYS 367.A O no hydrogen 2.814 N/A ALA 321.A N GLN 338.A O no hydrogen 3.073 N/A GLU 322.A N ARG 365.A O no hydrogen 2.952 N/A LEU 323.A N TRP 336.A O no hydrogen 2.831 N/A THR 324.A N VAL 363.A O no hydrogen 2.996 N/A VAL 325.A N ALA 334.A O no hydrogen 2.917 N/A TYR 326.A N MET 361.A O no hydrogen 3.016 N/A ASN 327.A N LYS 331.A O no hydrogen 3.038 N/A HIS 329.A N ASN 327.A OD1 no hydrogen 2.696 N/A LYS 331.A N ASN 327.A OD1 no hydrogen 3.081 N/A LYS 331.A NZ GLU 354.A OE1 no hydrogen 3.375 N/A LYS 331.A NZ GLU 354.A OE2 no hydrogen 3.526 N/A LEU 333.A N VAL 325.A O no hydrogen 2.742 N/A SER 335.A OG LEU 323.A O no hydrogen 3.243 N/A TRP 336.A N LEU 323.A O no hydrogen 2.870 N/A GLN 338.A N ALA 321.A O no hydrogen 3.179 N/A GLN 338.A NE2 ALA 339.A O no hydrogen 2.994 N/A MET 340.A N MET 319.A O no hydrogen 2.840 N/A THR 341.A N GLU 344.A OE1 no hydrogen 2.955 N/A GLY 343.A N ALA 315.A O no hydrogen 2.888 N/A GLU 344.A N THR 341.A O no hydrogen 2.956 N/A LYS 346.A N LEU 313.A O no hydrogen 2.927 N/A ILE 348.A N LEU 311.A O no hydrogen 3.044 N/A THR 349.A OG1 ASP 310.A OD1 no hydrogen 3.075 N/A LEU 350.A N LEU 309.A O no hydrogen 2.728 N/A LEU 352.A N ILE 307.A O no hydrogen 3.014 N/A SER 353.A N LEU 333.A O no hydrogen 2.850 N/A SER 353.A OG LEU 333.A O no hydrogen 3.303 N/A GLY 358.A N LEU 383.A O no hydrogen 2.951 N/A HIS 360.A N PHE 381.A O no hydrogen 2.665 N/A HIS 360.A ND1 GLY 358.A O no hydrogen 2.943 N/A MET 361.A N TYR 326.A O no hydrogen 3.019 N/A LEU 362.A N LEU 379.A O no hydrogen 2.814 N/A VAL 363.A N THR 324.A O no hydrogen 2.927 N/A SER 364.A N GLN 377.A O no hydrogen 2.802 N/A ARG 365.A N GLU 322.A O no hydrogen 2.756 N/A ARG 365.A NE GLU 322.A O no hydrogen 3.341 N/A ARG 365.A NH2 GLU 322.A O no hydrogen 3.381 N/A ARG 365.A NH2 THR 324.A OG1 no hydrogen 2.542 N/A ARG 365.A NH2 VAL 363.A O no hydrogen 3.542 N/A ILE 366.A N ASP 375.A O no hydrogen 2.887 N/A LYS 367.A N SER 320.A O no hydrogen 2.928 N/A ASP 368.A N ASN 372.A O no hydrogen 3.133 N/A GLY 371.A N ASP 368.A O no hydrogen 2.694 N/A ASN 372.A N ASP 368.A OD1 no hydrogen 2.907 N/A ASN 372.A ND2 ASP 368.A OD2 no hydrogen 2.548 N/A ASN 372.A ND2 GLN 374.A OE1 no hydrogen 3.628 N/A GLN 374.A N ILE 366.A O no hydrogen 2.776 N/A GLN 377.A N SER 364.A O no hydrogen 2.938 N/A LEU 379.A N LEU 362.A O no hydrogen 2.799 N/A PHE 381.A N HIS 360.A O no hydrogen 2.912 N/A MET 382.A N LYS 298.A O no hydrogen 3.087 N/A LEU 383.A N GLY 358.A O no hydrogen 2.912 N/A VAL 384.A N TYR 300.A O no hydrogen 2.750 N/A