Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8yy8_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLN 3.A OE1 no hydrogen 2.721 N/A GLN 6.A N ASP 2.A O no hydrogen 2.936 N/A GLU 7.A N GLN 3.A O no hydrogen 2.862 N/A ALA 8.A N LEU 4.A O no hydrogen 2.903 N/A GLU 9.A N ARG 5.A O no hydrogen 2.919 N/A GLN 10.A N GLN 6.A O no hydrogen 2.913 N/A LEU 11.A N GLU 7.A O no hydrogen 2.862 N/A LYS 12.A N ALA 8.A O no hydrogen 2.916 N/A LYS 12.A NZ GLU 9.A OE2 no hydrogen 3.320 N/A ASN 13.A N GLU 9.A O no hydrogen 2.913 N/A GLN 14.A N GLN 10.A O no hydrogen 2.883 N/A ILE 15.A N LEU 11.A O no hydrogen 2.893 N/A ARG 16.A N LYS 12.A O no hydrogen 2.915 N/A ARG 16.A NE ASP 17.A OD1 no hydrogen 2.979 N/A ARG 16.A NH2 ASP 17.A OD1 no hydrogen 2.905 N/A ASP 17.A N ASN 13.A O no hydrogen 2.894 N/A ALA 18.A N GLN 14.A O no hydrogen 2.887 N/A ARG 19.A N ILE 15.A O no hydrogen 2.921 N/A ARG 19.A NE ASP 255.A OD2 no hydrogen 3.129 N/A ARG 19.A NH2 THR 218.A O no hydrogen 2.962 N/A ARG 19.A NH2 ASP 255.A OD2 no hydrogen 3.053 N/A LYS 20.A N ARG 16.A O no hydrogen 2.884 N/A ALA 21.A N ASP 17.A O no hydrogen 2.908 N/A CYS 22.A N ARG 19.A O no hydrogen 3.168 N/A CYS 22.A SG ALA 18.A O no hydrogen 3.347 N/A ALA 23.A N LYS 20.A O no hydrogen 3.201 N/A ASP 24.A N CYS 22.A O no hydrogen 2.977 N/A THR 26.A N GLN 29.A OE1 no hydrogen 3.323 N/A THR 26.A OG1 SER 28.A OG no hydrogen 3.153 N/A THR 26.A OG1 GLN 29.A OE1 no hydrogen 3.249 N/A SER 28.A OG THR 26.A OG1 no hydrogen 3.153 N/A GLN 29.A N THR 26.A O no hydrogen 3.318 N/A ILE 30.A N THR 26.A O no hydrogen 3.400 N/A THR 31.A N LEU 27.A O no hydrogen 2.914 N/A THR 31.A OG1 LEU 27.A O no hydrogen 2.739 N/A THR 31.A OG1 LEU 297.A O no hydrogen 2.463 N/A ARG 39.A NH1 GLY 38.A O no hydrogen 3.316 N/A ILE 40.A N ALA 302.A O no hydrogen 3.309 N/A ARG 43.A NH1 MET 42.A O no hydrogen 3.094 N/A ARG 43.A NH2 GLN 41.A OE1 no hydrogen 3.011 N/A ARG 45.A N ILE 335.A O no hydrogen 2.874 N/A ARG 45.A NH2 ASN 337.A OXT no hydrogen 3.483 N/A ARG 46.A N ILE 335.A O no hydrogen 3.426 N/A ARG 46.A NE TYR 82.A O no hydrogen 3.502 N/A ARG 46.A NH2 TYR 82.A O no hydrogen 3.412 N/A LEU 48.A N LEU 333.A O no hydrogen 2.637 N/A HIS 51.A NE2 SER 69.A OG no hydrogen 2.379 N/A LEU 52.A N ASP 73.A OD2 no hydrogen 3.072 N/A ILE 55.A N SER 328.A O no hydrogen 3.262 N/A TYR 56.A N ALA 70.A O no hydrogen 2.944 N/A HIS 59.A N VAL 68.A O no hydrogen 3.287 N/A TRP 60.A NE1 GLY 316.A O no hydrogen 2.705 N/A GLY 61.A N LEU 66.A O no hydrogen 2.883 N/A THR 62.A OG1 PRO 104.A O no hydrogen 2.517 N/A SER 64.A N GLY 61.A O no hydrogen 3.190 N/A SER 64.A OG ASP 320.A OD1 no hydrogen 3.025 N/A ARG 65.A NE ASP 80.A OD1 no hydrogen 2.960 N/A ARG 65.A NE ASP 80.A OD2 no hydrogen 3.319 N/A ARG 65.A NH2 ASP 80.A OD2 no hydrogen 3.262 N/A LEU 67.A N TRP 79.A O no hydrogen 2.942 N/A VAL 68.A N HIS 59.A O no hydrogen 3.270 N/A SER 69.A N ILE 77.A O no hydrogen 2.919 N/A SER 69.A OG HIS 51.A NE2 no hydrogen 2.379 N/A ALA 70.A N ALA 57.A O no hydrogen 3.188 N/A SER 71.A N LYS 75.A O no hydrogen 2.974 N/A SER 71.A OG ALA 53.A O no hydrogen 3.570 N/A SER 71.A OG LYS 54.A O no hydrogen 3.295 N/A GLN 72.A N LYS 54.A O no hydrogen 3.239 N/A GLN 72.A NE2 VAL 97.A O no hydrogen 2.312 N/A GLY 74.A N SER 71.A O no hydrogen 3.400 N/A LYS 75.A N ASP 73.A OD1 no hydrogen 3.172 N/A LEU 76.A N ILE 90.A O no hydrogen 2.937 N/A ILE 77.A N SER 69.A O no hydrogen 2.892 N/A ILE 78.A N HIS 88.A O no hydrogen 2.858 N/A TRP 79.A N LEU 67.A O no hydrogen 2.845 N/A TRP 79.A NE1 SER 69.A OG no hydrogen 2.725 N/A ASP 80.A N ASN 85.A O no hydrogen 2.619 N/A SER 81.A N ARG 65.A O no hydrogen 3.031 N/A SER 81.A OG ARG 65.A O no hydrogen 2.392 N/A THR 84.A OG1 THR 83.A O no hydrogen 2.589 N/A ASN 85.A N ASP 80.A O no hydrogen 3.250 N/A ASN 85.A ND2 THR 83.A OG1 no hydrogen 2.790 N/A LYS 86.A NZ ARG 49.A O no hydrogen 3.031 N/A HIS 88.A N ILE 78.A O no hydrogen 2.972 N/A ILE 90.A N LEU 76.A O no hydrogen 2.871 N/A ARG 93.A NE GLU 135.A OE2 no hydrogen 3.252 N/A VAL 97.A N SER 95.A O no hydrogen 2.888 N/A MET 98.A N GLY 112.A O no hydrogen 2.874 N/A THR 99.A N GLY 112.A O no hydrogen 3.291 N/A CYS 100.A SG ALA 57.A O no hydrogen 3.217 N/A CYS 100.A SG VAL 68.A O no hydrogen 3.928 N/A ALA 101.A N ALA 110.A O no hydrogen 3.112 N/A TYR 102.A N HIS 59.A ND1 no hydrogen 3.049 N/A ALA 103.A N TYR 108.A O no hydrogen 3.183 N/A SER 105.A OG ASP 151.A OD1 no hydrogen 2.640 N/A SER 105.A OG ASP 151.A OD2 no hydrogen 3.167 N/A GLY 106.A N ALA 103.A O no hydrogen 2.975 N/A ASN 107.A N SER 105.A OG no hydrogen 3.366 N/A ASN 107.A ND2 ASP 151.A OD2 no hydrogen 3.215 N/A VAL 109.A N TYR 121.A O no hydrogen 2.920 N/A ALA 110.A N ALA 101.A O no hydrogen 2.783 N/A CYS 111.A N SER 119.A O no hydrogen 2.929 N/A CYS 111.A SG SER 119.A O no hydrogen 3.931 N/A LEU 114.A N TRP 96.A O no hydrogen 3.099 N/A ASN 116.A N GLY 113.A O no hydrogen 3.351 N/A ILE 117.A N ASP 115.A OD1 no hydrogen 3.495 N/A CYS 118.A N LEU 136.A O no hydrogen 2.903 N/A CYS 118.A SG CYS 111.A O no hydrogen 3.751 N/A SER 119.A N CYS 111.A O no hydrogen 2.866 N/A ILE 120.A N ARG 134.A O no hydrogen 2.855 N/A TYR 121.A N VAL 109.A O no hydrogen 2.862 N/A ASN 122.A N ARG 131.A O no hydrogen 3.441 N/A LEU 123.A N ASN 107.A O no hydrogen 2.709 N/A LYS 124.A N ASN 107.A O no hydrogen 3.364 N/A THR 125.A N LEU 123.A O no hydrogen 3.070 N/A THR 125.A OG1 ASN 129.A O no hydrogen 2.328 N/A GLY 128.A N THR 125.A O no hydrogen 3.379 N/A ARG 131.A NE GLU 127.A OE1 no hydrogen 3.393 N/A ARG 131.A NH2 GLU 127.A OE1 no hydrogen 2.845 N/A SER 133.A N ILE 120.A O no hydrogen 2.815 N/A SER 133.A OG ILE 120.A O no hydrogen 2.402 N/A ARG 134.A N ILE 120.A O no hydrogen 2.959 N/A ARG 134.A NE ILE 168.A O no hydrogen 2.730 N/A LEU 136.A N CYS 118.A O no hydrogen 2.879 N/A THR 140.A N ASP 160.A OD2 no hydrogen 2.801 N/A THR 140.A OG1 ASP 160.A OD2 no hydrogen 3.416 N/A TYR 142.A OH ASP 183.A OD2 no hydrogen 2.385 N/A LEU 143.A N GLY 113.A O no hydrogen 2.971 N/A SER 144.A N SER 157.A O no hydrogen 2.922 N/A SER 144.A OG SER 157.A O no hydrogen 3.366 N/A SER 144.A OG SER 157.A OG no hydrogen 3.341 N/A SER 144.A OG VAL 184.A O no hydrogen 2.417 N/A CYS 145.A N SER 157.A O no hydrogen 3.443 N/A CYS 145.A SG LEU 187.A O no hydrogen 3.325 N/A CYS 146.A N THR 99.A OG1 no hydrogen 3.146 N/A ARG 147.A N VAL 155.A O no hydrogen 3.143 N/A ARG 147.A NH1 CYS 146.A O no hydrogen 2.782 N/A LEU 149.A N GLN 153.A O no hydrogen 2.898 N/A ASP 150.A N GLN 153.A O no hydrogen 3.331 N/A ASN 152.A N ASP 150.A OD1 no hydrogen 2.682 N/A GLN 153.A N ASP 150.A OD1 no hydrogen 2.886 N/A GLN 153.A NE2 ASP 150.A OD2 no hydrogen 2.946 N/A ILE 154.A N TRP 166.A O no hydrogen 2.978 N/A VAL 155.A N ARG 147.A O no hydrogen 3.088 N/A THR 156.A N ALA 164.A O no hydrogen 2.902 N/A THR 156.A OG1 ALA 164.A O no hydrogen 3.423 N/A SER 157.A N CYS 145.A O no hydrogen 2.936 N/A SER 157.A OG SER 144.A OG no hydrogen 3.341 N/A SER 157.A OG CYS 145.A O no hydrogen 3.512 N/A SER 158.A OG GLY 141.A O no hydrogen 2.722 N/A SER 158.A OG TYR 142.A O no hydrogen 3.195 N/A SER 158.A OG ASP 160.A OD1 no hydrogen 3.349 N/A THR 161.A OG1 ASP 160.A O no hydrogen 2.611 N/A THR 162.A OG1 ASP 160.A O no hydrogen 3.322 N/A CYS 163.A N PHE 177.A O no hydrogen 2.917 N/A ALA 164.A N THR 156.A O no hydrogen 2.904 N/A LEU 165.A N THR 175.A O no hydrogen 2.867 N/A TRP 166.A N ILE 154.A O no hydrogen 2.844 N/A TRP 166.A NE1 THR 156.A OG1 no hydrogen 2.609 N/A ASP 167.A N GLN 172.A O no hydrogen 3.375 N/A ILE 168.A N ASN 152.A O no hydrogen 2.669 N/A THR 170.A N ASP 167.A OD1 no hydrogen 2.945 N/A GLY 171.A N ASP 167.A O no hydrogen 2.838 N/A THR 174.A N LEU 165.A O no hydrogen 2.793 N/A THR 174.A OG1 LEU 165.A O no hydrogen 2.849 N/A THR 175.A N LEU 165.A O no hydrogen 2.981 N/A THR 176.A OG1 GLN 173.A OE1 no hydrogen 3.092 N/A PHE 177.A N CYS 163.A O no hydrogen 2.868 N/A HIS 180.A NE2 SER 198.A OG no hydrogen 2.686 N/A THR 181.A N ASP 202.A OD2 no hydrogen 2.783 N/A GLY 182.A N ASP 202.A OD2 no hydrogen 3.193 N/A VAL 184.A N SER 158.A O no hydrogen 3.227 N/A MET 185.A N GLY 199.A O no hydrogen 2.907 N/A SER 186.A N GLY 199.A O no hydrogen 3.433 N/A SER 188.A N VAL 197.A O no hydrogen 3.072 N/A ALA 190.A N LEU 195.A O no hydrogen 3.234 N/A THR 193.A N ALA 190.A O no hydrogen 3.117 N/A THR 193.A OG1 ASP 192.A O no hydrogen 2.625 N/A ARG 194.A NE ASP 192.A OD2 no hydrogen 3.324 N/A ARG 194.A NH2 ASP 192.A OD2 no hydrogen 3.051 N/A PHE 196.A N TRP 208.A O no hydrogen 2.974 N/A VAL 197.A N SER 188.A O no hydrogen 3.071 N/A SER 198.A N LYS 206.A O no hydrogen 2.905 N/A SER 198.A OG HIS 180.A NE2 no hydrogen 2.686 N/A SER 198.A OG LYS 206.A O no hydrogen 3.514 N/A GLY 199.A N SER 186.A O no hydrogen 2.996 N/A ALA 200.A N SER 204.A O no hydrogen 3.502 N/A CYS 201.A N ASP 183.A O no hydrogen 2.903 N/A CYS 201.A SG ASP 183.A O no hydrogen 3.584 N/A CYS 201.A SG ASP 183.A OD1 no hydrogen 3.135 N/A SER 204.A OG ASP 202.A OD1 no hydrogen 2.817 N/A ALA 205.A N PHE 219.A O no hydrogen 2.900 N/A LYS 206.A N SER 198.A O no hydrogen 2.885 N/A LYS 206.A NZ THR 218.A OG1 no hydrogen 3.004 N/A LEU 207.A N GLN 217.A O no hydrogen 2.865 N/A TRP 208.A N PHE 196.A O no hydrogen 2.851 N/A TRP 208.A NE1 SER 198.A OG no hydrogen 2.652 N/A ASP 209.A N MET 214.A O no hydrogen 3.256 N/A VAL 210.A N ARG 194.A O no hydrogen 2.949 N/A ARG 211.A N ASP 209.A OD1 no hydrogen 2.944 N/A GLU 212.A N ASP 209.A OD1 no hydrogen 3.125 N/A GLY 213.A N ASP 209.A O no hydrogen 2.926 N/A CYS 215.A SG GLN 217.A O no hydrogen 3.277 N/A CYS 215.A SG THR 218.A OG1 no hydrogen 3.369 N/A ARG 216.A NE ASP 209.A OD2 no hydrogen 2.870 N/A ARG 216.A NH2 ASP 209.A OD2 no hydrogen 2.875 N/A GLN 217.A N LEU 207.A O no hydrogen 2.968 N/A GLN 217.A NE2 LEU 252.A O no hydrogen 2.605 N/A GLN 217.A NE2 ASP 255.A OD1 no hydrogen 2.408 N/A PHE 219.A N ALA 205.A O no hydrogen 2.851 N/A HIS 222.A NE2 THR 240.A OG1 no hydrogen 2.568 N/A GLU 223.A N ASP 244.A OD2 no hydrogen 3.158 N/A ASP 225.A N SER 224.A OG no hydrogen 2.593 N/A ILE 226.A N ALA 200.A O no hydrogen 3.129 N/A ASN 227.A N GLY 241.A O no hydrogen 2.893 N/A ASN 227.A ND2 ASP 243.A OD1 no hydrogen 2.686 N/A ASN 227.A ND2 ILE 270.A O no hydrogen 3.146 N/A ALA 228.A N GLY 241.A O no hydrogen 3.262 N/A CYS 230.A N ALA 239.A O no hydrogen 2.958 N/A CYS 230.A SG PHE 231.A O no hydrogen 3.517 N/A PHE 231.A N SER 188.A OG no hydrogen 3.009 N/A PHE 232.A N ALA 237.A O no hydrogen 2.732 N/A GLY 235.A N PHE 232.A O no hydrogen 2.914 N/A ASN 236.A N ASN 234.A OD1 no hydrogen 3.007 N/A PHE 238.A N PHE 250.A O no hydrogen 2.951 N/A ALA 239.A N CYS 230.A O no hydrogen 2.911 N/A THR 240.A N ARG 248.A O no hydrogen 2.849 N/A THR 240.A OG1 HIS 222.A NE2 no hydrogen 2.568 N/A THR 240.A OG1 ARG 248.A O no hydrogen 3.385 N/A GLY 241.A N ALA 228.A O no hydrogen 2.999 N/A ASP 243.A N ASP 225.A O no hydrogen 3.120 N/A THR 246.A OG1 ASP 244.A O no hydrogen 3.334 N/A CYS 247.A N TYR 261.A O no hydrogen 2.923 N/A ARG 248.A N THR 240.A O no hydrogen 2.906 N/A ARG 248.A NE GLU 257.A OE2 no hydrogen 2.646 N/A ARG 248.A NH1 HIS 222.A ND1 no hydrogen 3.191 N/A LEU 249.A N MET 259.A O no hydrogen 2.876 N/A PHE 250.A N PHE 238.A O no hydrogen 2.879 N/A ASP 251.A N GLN 256.A O no hydrogen 3.218 N/A LEU 252.A N ASN 236.A O no hydrogen 3.147 N/A ALA 254.A N ASP 251.A OD2 no hydrogen 2.518 N/A ASP 255.A N ASP 251.A O no hydrogen 3.109 N/A LEU 258.A N LEU 249.A O no hydrogen 2.639 N/A MET 259.A N LEU 249.A O no hydrogen 3.006 N/A TYR 261.A N CYS 247.A O no hydrogen 2.843 N/A TYR 261.A OH ALA 296.A O no hydrogen 2.781 N/A HIS 263.A ND1 ASP 264.A O no hydrogen 3.062 N/A CYS 268.A SG GLY 269.A O no hydrogen 4.012 N/A ILE 270.A N SER 242.A O no hydrogen 2.733 N/A THR 271.A N GLY 285.A O no hydrogen 2.897 N/A THR 271.A OG1 GLY 285.A O no hydrogen 3.462 N/A THR 271.A OG1 VAL 312.A O no hydrogen 2.298 N/A THR 271.A OG1 SER 313.A O no hydrogen 3.055 N/A SER 274.A N LEU 283.A O no hydrogen 2.898 N/A SER 276.A N LEU 281.A O no hydrogen 3.038 N/A ARG 280.A NE ASP 295.A OD1 no hydrogen 3.126 N/A ARG 280.A NH2 ASP 35.A O no hydrogen 2.842 N/A ARG 280.A NH2 ASP 295.A OD2 no hydrogen 3.478 N/A LEU 281.A N SER 276.A OG no hydrogen 3.256 N/A LEU 282.A N TRP 294.A O no hydrogen 2.926 N/A LEU 283.A N SER 274.A O no hydrogen 2.783 N/A ALA 284.A N ASN 292.A O no hydrogen 2.923 N/A GLY 285.A N SER 272.A O no hydrogen 2.951 N/A TYR 286.A N ASN 290.A O no hydrogen 2.915 N/A ASP 287.A N GLY 269.A O no hydrogen 3.079 N/A ASN 290.A ND2 ASP 288.A O no hydrogen 2.325 N/A ASN 292.A N ALA 284.A O no hydrogen 2.880 N/A VAL 293.A N GLY 303.A O no hydrogen 2.855 N/A TRP 294.A N LEU 282.A O no hydrogen 2.850 N/A ASP 295.A N ASP 300.A O no hydrogen 2.918 N/A ALA 296.A N ARG 280.A O no hydrogen 2.777 N/A LEU 297.A N ASP 295.A OD1 no hydrogen 2.999 N/A LYS 298.A N ASP 295.A OD1 no hydrogen 3.056 N/A LYS 298.A NZ THR 31.A O no hydrogen 2.421 N/A LYS 298.A NZ ILE 34.A O no hydrogen 3.159 N/A ALA 299.A N ASP 295.A O no hydrogen 2.913 N/A ALA 302.A N VAL 293.A O no hydrogen 2.845 N/A GLY 303.A N VAL 293.A O no hydrogen 2.960 N/A LEU 305.A N CYS 291.A O no hydrogen 2.755 N/A HIS 308.A NE2 THR 326.A OG1 no hydrogen 2.525 N/A ASP 309.A N ASP 330.A OD2 no hydrogen 2.990 N/A ARG 311.A N ASN 310.A OD1 no hydrogen 2.965 N/A VAL 312.A N TYR 286.A O no hydrogen 3.154 N/A SER 313.A N GLY 327.A O no hydrogen 2.874 N/A SER 313.A OG ILE 55.A O no hydrogen 3.168 N/A CYS 314.A N GLY 327.A O no hydrogen 2.932 N/A CYS 314.A SG GLY 327.A O no hydrogen 3.659 N/A LEU 315.A N SER 272.A OG no hydrogen 2.722 N/A GLY 316.A N ALA 325.A O no hydrogen 2.919 N/A THR 318.A N ALA 323.A O no hydrogen 3.271 N/A THR 318.A OG1 ASP 320.A OD1 no hydrogen 2.654 N/A GLY 321.A N THR 318.A O no hydrogen 2.975 N/A MET 322.A N THR 318.A OG1 no hydrogen 2.671 N/A MET 322.A N ASP 320.A OD1 no hydrogen 3.306 N/A VAL 324.A N TRP 336.A O no hydrogen 2.910 N/A ALA 325.A N GLY 316.A O no hydrogen 2.891 N/A THR 326.A N LYS 334.A O no hydrogen 2.878 N/A THR 326.A OG1 HIS 308.A NE2 no hydrogen 2.525 N/A GLY 327.A N CYS 314.A O no hydrogen 2.891 N/A SER 328.A OG HIS 308.A ND1 no hydrogen 2.514 N/A SER 328.A OG ASP 330.A OD1 no hydrogen 2.225 N/A TRP 329.A N ARG 311.A O no hydrogen 2.972 N/A SER 331.A OG ALA 53.A O no hydrogen 2.713 N/A LEU 333.A N LEU 48.A O no hydrogen 3.118 N/A LYS 334.A N THR 326.A O no hydrogen 2.920 N/A LYS 334.A NZ THR 47.A OG1 no hydrogen 3.038 N/A ILE 335.A N ARG 46.A O no hydrogen 2.873 N/A TRP 336.A N VAL 324.A O no hydrogen 2.846 N/A