Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5dnd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N ARG 64.A O no hydrogen 2.892 N/A ARG 2.A NE GLY 158.A O no hydrogen 2.898 N/A ARG 2.A NH1 ALA 157.A O no hydrogen 3.350 N/A HIS 3.A N GLN 101.A OE1 no hydrogen 2.729 N/A LEU 4.A N LEU 66.A O no hydrogen 2.866 N/A LEU 5.A N GLY 102.A O no hydrogen 3.176 N/A LEU 6.A N THR 68.A O no hydrogen 2.804 N/A ILE 7.A N VAL 104.A O no hydrogen 2.773 N/A TYR 8.A N LEU 70.A O no hydrogen 2.894 N/A TYR 8.A OH GLY 25.A O no hydrogen 2.613 N/A THR 9.A N ILE 106.A O no hydrogen 3.094 N/A THR 9.A OG1 ILE 106.A O no hydrogen 2.736 N/A GLY 11.A N LEU 76.A O no hydrogen 3.055 N/A GLY 14.A N GLY 11.A O no hydrogen 3.119 N/A MET 15.A N THR 12.A O no hydrogen 3.035 N/A GLN 16.A N VAL 23.A O no hydrogen 2.966 N/A LYS 18.A N VAL 21.A O no hydrogen 2.931 N/A VAL 21.A N LYS 18.A O no hydrogen 3.383 N/A VAL 23.A N GLN 16.A O no hydrogen 2.961 N/A GLY 27.A N GLU 71.A OE2 no hydrogen 2.976 N/A LEU 28.A N GLU 71.A OE1 no hydrogen 3.104 N/A LEU 31.A N GLY 27.A O no hydrogen 3.386 N/A LEU 32.A N LEU 28.A O no hydrogen 2.932 N/A ARG 33.A N VAL 29.A O no hydrogen 3.089 N/A ARG 33.A NE ASP 51.A O no hydrogen 3.408 N/A ARG 33.A NH2 ASP 51.A O no hydrogen 2.732 N/A THR 34.A N LEU 31.A O no hydrogen 2.997 N/A THR 34.A OG1 LEU 31.A O no hydrogen 2.614 N/A LEU 35.A N LEU 32.A O no hydrogen 3.182 N/A PHE 38.A N LEU 35.A O no hydrogen 2.923 N/A HIS 39.A N LEU 35.A O no hydrogen 2.886 N/A ASP 40.A N ALA 55.A O no hydrogen 2.776 N/A PHE 43.A N ASP 40.A OD1 no hydrogen 3.139 N/A ALA 44.A N ASP 40.A O no hydrogen 3.109 N/A GLN 45.A N LYS 41.A O no hydrogen 3.115 N/A ALA 46.A N GLU 42.A O no hydrogen 2.947 N/A GLN 47.A N PHE 43.A O no hydrogen 3.110 N/A GLY 48.A N GLN 45.A O no hydrogen 2.846 N/A LEU 49.A N ALA 44.A O no hydrogen 3.006 N/A ALA 53.A N PRO 50.A O no hydrogen 3.193 N/A LEU 54.A N TYR 67.A O no hydrogen 2.834 N/A ALA 55.A N HIS 39.A ND1 no hydrogen 3.194 N/A LEU 56.A N VAL 65.A O no hydrogen 2.948 N/A ARG 64.A NE LEU 56.A O no hydrogen 3.307 N/A LEU 66.A N ARG 2.A O no hydrogen 2.970 N/A TYR 67.A N LEU 54.A O no hydrogen 2.877 N/A TYR 67.A OH PHE 38.A O no hydrogen 2.644 N/A THR 68.A N LEU 4.A O no hydrogen 2.954 N/A THR 68.A OG1 TYR 100.A OH no hydrogen 3.393 N/A LEU 70.A N LEU 6.A O no hydrogen 2.855 N/A CYS 72.A N TYR 8.A O no hydrogen 3.027 N/A LEU 76.A N THR 9.A O no hydrogen 2.953 N/A SER 78.A OG THR 111.A OG1 no hydrogen 3.427 N/A SER 79.A N ASP 77.A OD1 no hydrogen 2.987 N/A SER 79.A OG ASP 77.A OD1 no hydrogen 3.299 N/A SER 79.A OG ASP 110.A OD2 no hydrogen 2.862 N/A ASP 80.A N ASP 77.A O no hydrogen 2.908 N/A MET 81.A N SER 78.A O no hydrogen 3.089 N/A THR 82.A N ASP 85.A OD2 no hydrogen 3.163 N/A THR 82.A OG1 ASP 85.A OD2 no hydrogen 3.469 N/A TRP 86.A N THR 82.A O no hydrogen 3.233 N/A TRP 86.A NE1 HIS 107.A NE2 no hydrogen 3.111 N/A ILE 87.A N ILE 83.A O no hydrogen 2.890 N/A ARG 88.A N ASP 84.A O no hydrogen 3.056 N/A ARG 88.A NH2 ASP 85.A OD1 no hydrogen 2.856 N/A ILE 89.A N ASP 85.A O no hydrogen 3.153 N/A ALA 90.A N TRP 86.A O no hydrogen 2.974 N/A LYS 91.A N ILE 87.A O no hydrogen 2.954 N/A ILE 92.A N ARG 88.A O no hydrogen 3.040 N/A ILE 93.A N ILE 89.A O no hydrogen 3.051 N/A GLU 94.A N ALA 90.A O no hydrogen 2.862 N/A ARG 95.A N LYS 91.A O no hydrogen 2.897 N/A HIS 96.A N ILE 92.A O no hydrogen 3.194 N/A HIS 96.A ND1 GLN 99.A OE1 no hydrogen 3.071 N/A TYR 97.A N GLU 94.A O no hydrogen 3.214 N/A TYR 97.A OH HIS 127.A ND1 no hydrogen 2.735 N/A GLN 99.A N HIS 96.A O no hydrogen 3.149 N/A TYR 100.A OH THR 68.A OG1 no hydrogen 3.393 N/A GLN 101.A N HIS 3.A O no hydrogen 2.751 N/A PHE 103.A N PRO 129.A O no hydrogen 2.752 N/A VAL 104.A N LEU 5.A O no hydrogen 3.034 N/A VAL 105.A N ILE 131.A O no hydrogen 2.813 N/A ILE 106.A N ILE 7.A O no hydrogen 2.884 N/A HIS 107.A N THR 133.A O no hydrogen 2.891 N/A HIS 107.A ND1 GLY 108.A O no hydrogen 2.661 N/A THR 111.A N SER 78.A OG no hydrogen 3.012 N/A THR 111.A OG1 SER 78.A O no hydrogen 2.699 N/A MET 112.A N ALA 109.A O no hydrogen 3.254 N/A GLY 115.A N THR 111.A O no hydrogen 3.020 N/A ALA 116.A N MET 112.A O no hydrogen 2.761 N/A SER 117.A N ALA 113.A O no hydrogen 3.070 N/A SER 117.A OG ALA 113.A O no hydrogen 3.042 N/A MET 118.A N SER 114.A O no hydrogen 2.853 N/A LEU 119.A N GLY 115.A O no hydrogen 2.974 N/A SER 120.A N ALA 116.A O no hydrogen 2.972 N/A PHE 121.A N SER 117.A O no hydrogen 3.370 N/A PHE 121.A N MET 118.A O no hydrogen 3.036 N/A MET 122.A N MET 118.A O no hydrogen 2.976 N/A LEU 123.A N LEU 119.A O no hydrogen 3.022 N/A GLU 124.A N MET 122.A O no hydrogen 3.136 N/A GLU 124.A N VAL 221.A O no hydrogen 3.099 N/A ASN 125.A ND2 PRO 219.A O no hydrogen 2.928 N/A HIS 127.A N TYR 97.A OH no hydrogen 2.846 N/A HIS 127.A ND1 TYR 97.A OH no hydrogen 2.735 N/A HIS 127.A NE2 LYS 215.A O no hydrogen 2.995 N/A HIS 127.A NE2 ASP 218.A O no hydrogen 2.824 N/A LYS 128.A NZ TYR 97.A O no hydrogen 2.751 N/A LYS 128.A NZ TYR 100.A O no hydrogen 2.824 N/A VAL 130.A N GLU 164.A O no hydrogen 3.260 N/A ILE 131.A N PHE 103.A O no hydrogen 2.775 N/A LEU 132.A N CYS 166.A O no hydrogen 2.885 N/A THR 133.A N VAL 105.A O no hydrogen 3.047 N/A THR 133.A OG1 ASN 149.A O no hydrogen 3.498 N/A THR 133.A OG1 PHE 168.A O no hydrogen 2.743 N/A GLN 136.A N ASP 145.A OD1 no hydrogen 3.162 N/A GLN 136.A N ASP 145.A OD2 no hydrogen 2.872 N/A GLN 136.A NE2 ASP 183.A O no hydrogen 3.542 N/A GLN 136.A NE2 LYS 186.A O no hydrogen 2.996 N/A VAL 137.A N ASP 145.A OD1 no hydrogen 3.000 N/A ILE 139.A N LEU 13.A O no hydrogen 2.807 N/A ARG 140.A NE GLN 16.A OE1 no hydrogen 3.226 N/A VAL 141.A N PRO 138.A O no hydrogen 3.119 N/A ASN 144.A ND2 VAL 141.A O no hydrogen 2.613 N/A ASP 145.A N ASP 145.A OD1 no hydrogen 2.668 N/A ARG 147.A N ASN 144.A OD1 no hydrogen 3.028 N/A ARG 147.A NH1 LEU 142.A O no hydrogen 2.940 N/A ARG 147.A NH2 LEU 142.A O no hydrogen 2.738 N/A ASN 149.A N ASP 145.A O no hydrogen 3.182 N/A ASN 149.A ND2 GLY 134.A O no hydrogen 2.998 N/A LEU 150.A N ALA 146.A O no hydrogen 2.910 N/A LEU 151.A N ARG 147.A O no hydrogen 3.070 N/A GLY 152.A N GLU 148.A O no hydrogen 2.946 N/A ALA 153.A N ASN 149.A O no hydrogen 3.062 N/A LEU 154.A N LEU 150.A O no hydrogen 3.020 N/A LEU 155.A N LEU 151.A O no hydrogen 2.863 N/A VAL 156.A N GLY 152.A O no hydrogen 2.883 N/A ALA 157.A N ALA 153.A O no hydrogen 3.013 N/A GLY 158.A N LEU 154.A O no hydrogen 2.815 N/A GLN 159.A N LEU 155.A O no hydrogen 3.078 N/A TYR 160.A N VAL 156.A O no hydrogen 3.176 N/A GLU 164.A N ILE 162.A O no hydrogen 2.799 N/A CYS 166.A N VAL 130.A O no hydrogen 2.974 N/A CYS 166.A SG GLU 164.A O no hydrogen 3.660 N/A LEU 167.A N PHE 174.A O no hydrogen 2.955 N/A PHE 168.A N LEU 132.A O no hydrogen 2.894 N/A MET 169.A N GLN 172.A O no hydrogen 3.099 N/A ASN 170.A N ASN 149.A OD1 no hydrogen 2.909 N/A GLN 172.A N MET 169.A O no hydrogen 3.062 N/A LEU 173.A N ALA 198.A O no hydrogen 2.869 N/A PHE 174.A N LEU 167.A O no hydrogen 2.783 N/A ARG 175.A NE GLU 164.A OE1 no hydrogen 2.628 N/A ARG 175.A NH1 GLY 348.A O no hydrogen 3.022 N/A ARG 175.A NH2 GLU 164.A OE2 no hydrogen 2.912 N/A ARG 175.A NH2 LEU 210.A O no hydrogen 2.890 N/A GLY 176.A N VAL 165.A O no hydrogen 2.941 N/A ASN 177.A ND2 SER 120.A OG no hydrogen 2.869 N/A ASN 177.A ND2 ARG 347.A O no hydrogen 2.996 N/A ARG 178.A N ARG 175.A O no hydrogen 2.914 N/A ARG 178.A NE GLY 348.A O no hydrogen 2.866 N/A ARG 178.A NH1 ASP 314.A OD2 no hydrogen 2.990 N/A ARG 178.A NH2 GLY 348.A O no hydrogen 3.351 N/A ARG 178.A NH2 THR 351.A OG1 no hydrogen 2.886 N/A VAL 179.A N GLY 176.A O no hydrogen 3.494 N/A THR 180.A N CYS 191.A O no hydrogen 2.984 N/A THR 180.A OG1 GLU 318.A OE2 no hydrogen 2.692 N/A LYS 181.A NZ ASP 183.A O no hydrogen 3.109 N/A VAL 182.A N ALA 189.A O no hydrogen 2.865 N/A ASP 183.A N ALA 189.A O no hydrogen 3.323 N/A SER 184.A OG GLN 185.A OE1 no hydrogen 3.054 N/A GLN 185.A N ASP 183.A OD1 no hydrogen 3.051 N/A LYS 186.A N ASP 183.A OD1 no hydrogen 3.093 N/A CYS 191.A N THR 180.A O no hydrogen 3.114 N/A SER 192.A OG LEU 194.A O no hydrogen 2.657 N/A LEU 197.A N LEU 173.A O no hydrogen 2.750 N/A ALA 198.A N LEU 173.A O no hydrogen 3.220 N/A THR 199.A N THR 205.A O no hydrogen 2.898 N/A THR 199.A OG1 GLN 172.A OE1 no hydrogen 3.149 N/A VAL 200.A N SER 171.A O no hydrogen 2.952 N/A GLY 201.A N ASP 203.A O no hydrogen 2.869 N/A THR 205.A N THR 199.A O no hydrogen 2.898 N/A ALA 207.A N LEU 197.A O no hydrogen 2.886 N/A LEU 210.A N ALA 207.A O no hydrogen 2.856 N/A VAL 211.A N ALA 207.A O no hydrogen 3.234 N/A ARG 212.A N GLU 164.A OE2 no hydrogen 3.041 N/A LYS 215.A NZ ASN 125.A OD1 no hydrogen 2.706 N/A LYS 217.A NZ ASP 218.A OD2 no hydrogen 3.065 N/A ASP 218.A N LYS 215.A O no hydrogen 3.221 N/A VAL 221.A N GLU 124.A O no hydrogen 3.130 N/A HIS 223.A N MET 122.A O no hydrogen 2.970 N/A HIS 223.A NE2 GLU 124.A OE1 no hydrogen 2.731 N/A ASN 225.A ND2 GLY 329.A O no hydrogen 2.990 N/A GLU 227.A N SER 325.A O no hydrogen 2.872 N/A HIS 228.A ND1 MET 226.A O no hydrogen 3.024 N/A HIS 228.A NE2 ASP 84.A OD1 no hydrogen 2.856 N/A ASP 229.A N GLU 227.A OE2 no hydrogen 3.053 N/A VAL 230.A N HIS 228.A O no hydrogen 2.908 N/A ALA 231.A N GLY 254.A O no hydrogen 3.031 N/A LEU 233.A N VAL 256.A O no hydrogen 2.808 N/A ARG 234.A NE GLU 258.A OE1 no hydrogen 2.695 N/A ARG 234.A NH2 GLU 258.A OE1 no hydrogen 3.042 N/A ARG 234.A NH2 GLU 258.A OE2 no hydrogen 3.420 N/A LEU 235.A N GLU 258.A O no hydrogen 3.098 N/A ILE 239.A N TYR 236.A O no hydrogen 3.036 N/A LEU 243.A N PRO 240.A O no hydrogen 3.020 N/A VAL 244.A N PRO 240.A O no hydrogen 3.190 N/A ARG 245.A N ALA 241.A O no hydrogen 2.822 N/A ARG 245.A NH1 GLU 274.A OE2 no hydrogen 2.853 N/A ALA 246.A N SER 242.A O no hydrogen 3.221 N/A PHE 247.A N LEU 243.A O no hydrogen 3.075 N/A LEU 248.A N VAL 244.A O no hydrogen 3.042 N/A GLN 249.A NE2 ARG 245.A O no hydrogen 3.034 N/A LEU 252.A N GLN 249.A O no hydrogen 3.284 N/A LYS 253.A N ASP 229.A O no hydrogen 2.953 N/A LYS 253.A NZ ASP 229.A OD2 no hydrogen 3.563 N/A LYS 253.A NZ PRO 251.A O no hydrogen 3.154 N/A GLY 254.A N ASP 229.A O no hydrogen 3.414 N/A VAL 255.A N ILE 284.A O no hydrogen 3.002 N/A VAL 256.A N ALA 231.A O no hydrogen 2.823 N/A LEU 257.A N VAL 286.A O no hydrogen 2.817 N/A GLU 258.A N LEU 233.A O no hydrogen 2.962 N/A THR 259.A N CYS 288.A O no hydrogen 2.785 N/A THR 259.A OG1 ASN 287.A OD1 no hydrogen 2.629 N/A THR 259.A OG1 CYS 288.A O no hydrogen 3.110 N/A PHE 260.A N ASN 264.A O no hydrogen 2.861 N/A GLY 263.A N PHE 260.A O no hydrogen 2.960 N/A ASN 264.A N PHE 260.A O no hydrogen 2.841 N/A ASN 264.A ND2 SER 262.A OG no hydrogen 3.423 N/A GLY 265.A N THR 302.A O no hydrogen 2.910 N/A LYS 268.A NZ ILE 239.A O no hydrogen 3.005 N/A LEU 271.A N LYS 268.A O no hydrogen 3.275 N/A LEU 272.A N LYS 268.A O no hydrogen 3.248 N/A GLN 273.A N PRO 269.A O no hydrogen 2.765 N/A GLU 274.A N ASP 270.A O no hydrogen 3.252 N/A LEU 275.A N LEU 271.A O no hydrogen 3.291 N/A ARG 276.A N LEU 272.A O no hydrogen 3.000 N/A ALA 277.A N GLN 273.A O no hydrogen 2.829 N/A ALA 278.A N GLU 274.A O no hydrogen 3.049 N/A ALA 279.A N LEU 275.A O no hydrogen 2.975 N/A GLN 280.A N ARG 276.A O no hydrogen 3.012 N/A ARG 281.A N ALA 277.A O no hydrogen 3.215 N/A ARG 281.A NH2 LEU 248.A O no hydrogen 2.990 N/A GLY 282.A N ALA 279.A O no hydrogen 2.974 N/A LEU 283.A N ALA 278.A O no hydrogen 3.085 N/A ILE 284.A N LYS 253.A O no hydrogen 3.166 N/A MET 285.A N ASN 308.A O no hydrogen 2.962 N/A VAL 286.A N VAL 255.A O no hydrogen 2.965 N/A ASN 287.A N VAL 310.A O no hydrogen 2.932 N/A ASN 287.A ND2 GLY 263.A O no hydrogen 3.197 N/A ASN 287.A ND2 LEU 304.A O no hydrogen 3.170 N/A CYS 288.A N LEU 257.A O no hydrogen 2.982 N/A SER 289.A OG GLY 261.A O no hydrogen 2.603 N/A GLN 290.A N THR 259.A O no hydrogen 2.877 N/A GLN 290.A NE2 LEU 235.A O no hydrogen 2.745 N/A GLN 290.A NE2 GLU 258.A O no hydrogen 3.017 N/A CYS 291.A N SER 289.A OG no hydrogen 2.971 N/A SER 295.A OG VAL 296.A O no hydrogen 3.263 N/A VAL 296.A N LEU 313.A O no hydrogen 3.030 N/A THR 297.A N SER 262.A O no hydrogen 2.837 N/A THR 297.A OG1 PRO 298.A O no hydrogen 3.275 N/A TYR 300.A N SER 303.A OG no hydrogen 3.192 N/A SER 303.A N TYR 300.A O no hydrogen 3.290 N/A SER 303.A OG ASN 264.A OD1 no hydrogen 3.274 N/A SER 303.A OG TYR 300.A O no hydrogen 2.907 N/A LEU 304.A N GLY 263.A O no hydrogen 3.192 N/A ASN 308.A ND2 LEU 283.A O no hydrogen 3.059 N/A ILE 309.A N GLY 306.A O no hydrogen 2.827 N/A VAL 310.A N MET 285.A O no hydrogen 2.876 N/A GLY 312.A N ASN 287.A O no hydrogen 2.847 N/A LEU 313.A N SER 311.A OG no hydrogen 3.107 N/A MET 315.A N GLY 312.A O no hydrogen 2.957 N/A SER 317.A OG GLU 258.A OE2 no hydrogen 2.485 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.851 N/A ALA 319.A N THR 316.A OG1 no hydrogen 2.954 N/A ALA 320.A N THR 316.A O no hydrogen 2.966 N/A LEU 321.A N SER 317.A O no hydrogen 2.947 N/A ALA 322.A N GLU 318.A O no hydrogen 3.189 N/A LYS 323.A N ALA 319.A O no hydrogen 2.857 N/A LYS 323.A NZ LEU 342.A O no hydrogen 3.042 N/A LYS 323.A NZ LYS 344.A O no hydrogen 2.963 N/A LYS 323.A NZ GLU 349.A OE2 no hydrogen 2.741 N/A LEU 324.A N ALA 320.A O no hydrogen 2.861 N/A SER 325.A N LEU 321.A O no hydrogen 2.912 N/A SER 325.A OG GLU 227.A O no hydrogen 2.624 N/A TYR 326.A N ALA 322.A O no hydrogen 2.899 N/A VAL 327.A N LYS 323.A O no hydrogen 2.902 N/A LEU 328.A N LEU 324.A O no hydrogen 3.031 N/A GLY 329.A N SER 325.A O no hydrogen 3.172 N/A GLY 329.A N TYR 326.A O no hydrogen 3.158 N/A LEU 330.A N VAL 327.A O no hydrogen 3.258 N/A ARG 337.A N SER 334.A OG no hydrogen 3.039 N/A ARG 337.A NH1 GLU 340.A OE1 no hydrogen 3.043 N/A ARG 338.A N SER 334.A O no hydrogen 3.007 N/A ARG 338.A NH1 LEU 330.A O no hydrogen 2.923 N/A ARG 338.A NH2 LEU 330.A O no hydrogen 2.874 N/A GLN 339.A N LEU 335.A O no hydrogen 3.095 N/A GLN 339.A NE2 ASN 308.A OD1 no hydrogen 3.549 N/A GLU 340.A N GLU 336.A O no hydrogen 3.134 N/A LEU 341.A N ARG 337.A O no hydrogen 3.066 N/A LEU 342.A N ARG 338.A O no hydrogen 3.061 N/A ALA 343.A N GLN 339.A O no hydrogen 3.204 N/A LYS 344.A N LEU 341.A O no hydrogen 2.993 N/A LEU 346.A N GLU 349.A OE2 no hydrogen 3.118 N/A ARG 347.A N GLU 349.A OE1 no hydrogen 2.644 N/A ARG 347.A NE SER 120.A O no hydrogen 2.871 N/A ARG 347.A NH1 LEU 346.A O no hydrogen 3.119 N/A ARG 347.A NH2 PHE 121.A O no hydrogen 2.952 N/A ARG 347.A NH2 TYR 326.A OH no hydrogen 3.172 N/A GLY 348.A N ASP 345.A OD1 no hydrogen 2.760 N/A GLU 349.A N GLU 349.A OE1 no hydrogen 2.748 N/A THR 351.A N ASP 314.A OD1 no hydrogen 2.823 N/A THR 351.A OG1 ASP 314.A OD2 no hydrogen 2.914 N/A