Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6iw4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N SER 44.A OG no hydrogen 2.577 N/A HIS 2.A ND1 GLN 142.A OE1 no hydrogen 3.114 N/A HIS 2.A NE2 HIS 144.A NE2 no hydrogen 3.005 N/A CYS 3.A N ASP 42.A OD2 no hydrogen 3.036 N/A CYS 3.A SG VAL 31.A O no hydrogen 3.496 N/A ILE 6.A N CYS 3.A O no hydrogen 3.345 N/A ARG 9.A NE THR 32.A OG1 no hydrogen 3.075 N/A ARG 9.A NH1 GLU 362.A OE2 no hydrogen 2.783 N/A ARG 9.A NH2 THR 32.A OG1 no hydrogen 3.096 N/A ARG 9.A NH2 GLU 362.A OE1 no hydrogen 3.478 N/A ARG 9.A NH2 GLU 362.A OE2 no hydrogen 3.252 N/A ASP 10.A N CYS 30.A O no hydrogen 3.095 N/A ILE 12.A N THR 32.A O no hydrogen 3.096 N/A GLY 14.A N MET 34.A O no hydrogen 2.365 N/A VAL 21.A N VAL 281.A O no hydrogen 2.908 N/A ALA 23.A N CYS 279.A O no hydrogen 2.910 N/A LEU 25.A N VAL 277.A O no hydrogen 2.857 N/A GLN 27.A NE2 LEU 272.A O no hydrogen 2.419 N/A GLN 27.A NE2 GLY 274.A O no hydrogen 3.117 N/A LYS 29.A NZ ASP 8.A OD2 no hydrogen 2.819 N/A CYS 30.A N ASP 8.A O no hydrogen 2.965 N/A VAL 31.A N ILE 43.A O no hydrogen 2.914 N/A THR 32.A N ASP 10.A O no hydrogen 2.872 N/A THR 32.A OG1 ASP 42.A OD1 no hydrogen 2.721 N/A VAL 33.A N LEU 41.A O no hydrogen 2.855 N/A MET 34.A N ILE 12.A O no hydrogen 2.807 N/A SER 40.A OG VAL 346.A O no hydrogen 2.746 N/A LEU 41.A N VAL 33.A O no hydrogen 2.894 N/A ASP 42.A N GLN 142.A O no hydrogen 2.853 N/A ILE 43.A N VAL 31.A O no hydrogen 2.914 N/A SER 44.A N ARG 140.A O no hydrogen 2.964 N/A GLU 46.A N VAL 138.A O no hydrogen 2.930 N/A ALA 49.A N GLN 136.A O no hydrogen 3.153 N/A ILE 50.A N TYR 270.A O no hydrogen 2.979 N/A VAL 56.A N LEU 127.A O no hydrogen 2.617 N/A ARG 57.A N LEU 127.A O no hydrogen 2.958 N/A VAL 59.A N MET 125.A O no hydrogen 2.901 N/A CYS 60.A N PRO 216.A O no hydrogen 2.998 N/A CYS 60.A SG ASN 62.A O no hydrogen 3.443 N/A CYS 60.A SG LYS 123.A O no hydrogen 3.798 N/A TYR 61.A N LYS 123.A O no hydrogen 2.988 N/A ASN 62.A N LYS 123.A O no hydrogen 2.967 N/A VAL 64.A N THR 120.A O no hydrogen 3.157 N/A THR 66.A N LYS 118.A O no hydrogen 3.127 N/A THR 66.A OG1 LYS 118.A O no hydrogen 3.525 N/A LYS 69.A N CYS 116.A O no hydrogen 2.887 N/A ASN 71.A N VAL 114.A O no hydrogen 2.898 N/A LYS 73.A N SER 112.A O no hydrogen 2.988 N/A LYS 73.A NZ THR 77.A O no hydrogen 3.265 N/A THR 77.A N CYS 74.A O no hydrogen 3.017 N/A THR 77.A OG1 CYS 74.A O no hydrogen 2.809 N/A THR 77.A OG1 PRO 75.A O no hydrogen 3.453 N/A ALA 80.A N SER 112.A OG no hydrogen 3.086 N/A HIS 81.A N ASN 71.A OD1 no hydrogen 2.918 N/A LEU 82.A N GLU 85.A OE1 no hydrogen 3.044 N/A ASN 90.A ND2 GLU 84.A O no hydrogen 2.900 N/A ALA 91.A N ALA 117.A O no hydrogen 2.894 N/A CYS 92.A SG GLU 84.A O no hydrogen 3.758 N/A CYS 92.A SG GLU 85.A O no hydrogen 3.946 N/A LYS 93.A N ALA 115.A O no hydrogen 2.893 N/A ARG 94.A NE GLU 85.A OE2 no hydrogen 3.268 N/A ARG 94.A NH1 GLU 79.A OE1 no hydrogen 3.097 N/A THR 95.A N ILE 113.A O no hydrogen 2.939 N/A TYR 96.A OH GLU 79.A OE1 no hydrogen 2.911 N/A SER 97.A N GLY 111.A O no hydrogen 2.907 N/A SER 97.A OG ALA 239.A O no hydrogen 2.764 N/A ARG 99.A N GLY 109.A O no hydrogen 2.928 N/A ARG 99.A NE ASN 103.A OD1 no hydrogen 2.979 N/A ARG 99.A NH2 ASN 103.A O no hydrogen 2.723 N/A GLY 100.A N ASN 103.A OD1 no hydrogen 3.440 N/A TRP 101.A NE1 GLY 106.A O no hydrogen 2.563 N/A ASN 103.A N GLY 100.A O no hydrogen 3.326 N/A CYS 105.A N ASN 103.A O no hydrogen 2.990 N/A GLY 109.A N ARG 99.A O no hydrogen 2.914 N/A LYS 110.A NZ ASP 98.A OD1 no hydrogen 2.657 N/A GLY 111.A N SER 97.A O no hydrogen 2.881 N/A ILE 113.A N THR 95.A O no hydrogen 2.902 N/A VAL 114.A N ASN 71.A O no hydrogen 2.952 N/A ALA 115.A N LYS 93.A O no hydrogen 3.005 N/A CYS 116.A N LYS 69.A O no hydrogen 2.900 N/A CYS 116.A SG GLU 84.A O no hydrogen 3.723 N/A ALA 117.A N ALA 91.A O no hydrogen 2.939 N/A LYS 118.A N THR 66.A O no hydrogen 2.636 N/A LYS 118.A NZ ASP 89.A OD1 no hydrogen 3.404 N/A PHE 119.A N ASP 89.A O no hydrogen 3.016 N/A THR 120.A N VAL 64.A O no hydrogen 3.472 N/A CYS 121.A SG ASN 62.A O no hydrogen 3.851 N/A CYS 121.A SG LYS 123.A O no hydrogen 3.579 N/A LYS 123.A N ASN 62.A O no hydrogen 2.938 N/A LYS 123.A NZ GLU 199.A OE1 no hydrogen 2.821 N/A MET 125.A N VAL 59.A O no hydrogen 2.858 N/A SER 126.A N GLU 197.A O no hydrogen 2.948 N/A LEU 127.A N ARG 57.A O no hydrogen 2.888 N/A PHE 128.A N ILE 195.A O no hydrogen 2.897 N/A GLU 129.A N ALA 54.A O no hydrogen 2.890 N/A THR 133.A N ASP 131.A OD1 no hydrogen 3.370 N/A THR 133.A OG1 ASP 131.A OD1 no hydrogen 2.610 N/A LYS 134.A N ASP 131.A O no hydrogen 2.939 N/A ILE 135.A N GLN 132.A O no hydrogen 3.483 N/A GLN 136.A N ALA 49.A O no hydrogen 3.235 N/A TYR 137.A N PHE 161.A O no hydrogen 2.948 N/A VAL 138.A N THR 47.A O no hydrogen 2.981 N/A ILE 139.A N LEU 159.A O no hydrogen 2.896 N/A ARG 140.A N SER 44.A O no hydrogen 2.853 N/A ALA 141.A N LYS 157.A O no hydrogen 2.886 N/A GLN 142.A N ASP 42.A O no hydrogen 2.929 N/A HIS 144.A N SER 40.A O no hydrogen 2.784 N/A HIS 144.A NE2 GLU 362.A OE1 no hydrogen 3.017 N/A ALA 147.A N VAL 145.A O no hydrogen 2.567 N/A ASN 151.A N LYS 148.A O no hydrogen 3.120 N/A TRP 152.A N GLN 149.A O no hydrogen 2.928 N/A THR 154.A N ASN 151.A O no hydrogen 2.934 N/A THR 154.A OG1 ASN 151.A O no hydrogen 3.371 N/A ASP 155.A N TRP 152.A O no hydrogen 3.448 N/A LYS 157.A N ALA 141.A O no hydrogen 2.923 N/A LYS 157.A NZ ASP 155.A O no hydrogen 3.491 N/A LEU 159.A N ILE 139.A O no hydrogen 2.941 N/A PHE 161.A N TYR 137.A O no hydrogen 2.907 N/A ASP 162.A N SER 165.A OG no hydrogen 3.425 N/A GLN 168.A N LEU 180.A O no hydrogen 2.923 N/A GLN 168.A NE2 LYS 160.A O no hydrogen 2.886 N/A VAL 170.A N ALA 178.A O no hydrogen 2.891 N/A PHE 172.A N GLY 176.A O no hydrogen 2.899 N/A TYR 175.A N PHE 172.A O no hydrogen 3.398 N/A LYS 177.A N ALA 285.A O no hydrogen 3.220 N/A LYS 177.A NZ GLU 169.A OE2 no hydrogen 3.037 N/A ALA 178.A N VAL 170.A O no hydrogen 2.894 N/A THR 179.A N LYS 282.A O no hydrogen 3.364 N/A LEU 180.A N GLN 168.A O no hydrogen 2.910 N/A GLU 181.A N ARG 280.A O no hydrogen 3.018 N/A GLN 183.A N SER 278.A O no hydrogen 2.882 N/A GLN 185.A N HIS 276.A O no hydrogen 2.988 N/A SER 193.A OG GLY 191.A O no hydrogen 2.688 N/A SER 193.A OG ASN 192.A O no hydrogen 2.506 N/A TYR 194.A N VAL 205.A O no hydrogen 2.842 N/A ILE 195.A N PHE 128.A O no hydrogen 2.908 N/A ALA 196.A N TRP 203.A O no hydrogen 2.931 N/A GLU 197.A N SER 126.A O no hydrogen 2.940 N/A MET 198.A N GLU 201.A O no hydrogen 2.915 N/A GLU 201.A N MET 198.A O no hydrogen 2.904 N/A TRP 203.A N ALA 196.A O no hydrogen 2.861 N/A ILE 204.A N MET 262.A O no hydrogen 2.940 N/A VAL 205.A N TYR 194.A O no hydrogen 2.917 N/A GLN 208.A NE2 ASP 212.A OD1 no hydrogen 3.470 N/A ALA 210.A N ASP 206.A O no hydrogen 3.019 N/A GLN 211.A N ARG 207.A O no hydrogen 2.937 N/A GLN 211.A NE2 TYR 194.A OH no hydrogen 3.032 N/A ASP 212.A N GLN 208.A O no hydrogen 2.985 N/A LEU 213.A N ALA 210.A O no hydrogen 3.377 N/A TRP 217.A N ARG 226.A O no hydrogen 3.145 N/A TRP 217.A NE1 GLU 227.A OE2 no hydrogen 2.883 N/A GLN 218.A N LYS 58.A O no hydrogen 3.005 N/A ARG 226.A N TRP 217.A O no hydrogen 2.912 N/A HIS 230.A NE2 GLU 227.A OE1 no hydrogen 3.164 N/A LEU 231.A N MET 228.A O no hydrogen 2.948 N/A VAL 232.A N HIS 229.A O no hydrogen 3.373 N/A GLU 233.A N LEU 245.A O no hydrogen 2.880 N/A GLU 235.A N ARG 243.A O no hydrogen 3.106 N/A HIS 238.A N THR 241.A O no hydrogen 3.127 N/A LEU 245.A N GLU 233.A O no hydrogen 2.918 N/A LEU 247.A N LEU 231.A O no hydrogen 3.358 N/A GLN 250.A N TYR 61.A O no hydrogen 2.741 N/A GLN 250.A NE2 GLY 248.A O no hydrogen 3.197 N/A GLU 251.A N ASN 249.A OD1 no hydrogen 2.938 N/A LEU 254.A N GLN 250.A O no hydrogen 3.047 N/A LYS 255.A N GLU 251.A O no hydrogen 2.914 N/A LYS 255.A NZ GLU 201.A OE1 no hydrogen 2.867 N/A THR 256.A N GLY 252.A O no hydrogen 2.896 N/A THR 256.A OG1 SER 253.A O no hydrogen 2.904 N/A ALA 257.A N SER 253.A O no hydrogen 2.954 N/A LEU 258.A N LYS 255.A O no hydrogen 3.361 N/A THR 259.A N THR 256.A O no hydrogen 3.361 N/A THR 259.A OG1 THR 256.A O no hydrogen 3.085 N/A ALA 261.A N LEU 258.A O no hydrogen 3.273 N/A VAL 264.A N SER 202.A O no hydrogen 3.131 N/A THR 265.A N LYS 271.A O no hydrogen 2.954 N/A THR 265.A OG1 HIS 273.A NE2 no hydrogen 2.547 N/A LYS 266.A NZ TYR 270.A OH no hydrogen 3.341 N/A TYR 270.A N ILE 50.A O no hydrogen 2.872 N/A TYR 270.A OH GLU 197.A OE2 no hydrogen 3.216 N/A LYS 271.A N THR 265.A O no hydrogen 2.852 N/A LEU 272.A N VAL 48.A O no hydrogen 2.839 N/A HIS 273.A N ARG 263.A O no hydrogen 3.243 N/A HIS 273.A NE2 THR 265.A OG1 no hydrogen 2.547 N/A VAL 277.A N LEU 25.A O no hydrogen 2.963 N/A SER 278.A N GLN 183.A O no hydrogen 2.933 N/A CYS 279.A N ALA 23.A O no hydrogen 2.892 N/A ARG 280.A NE GLU 181.A OE1 no hydrogen 3.067 N/A ARG 280.A NH2 GLU 181.A OE1 no hydrogen 3.143 N/A VAL 281.A N VAL 21.A O no hydrogen 2.871 N/A LYS 282.A N THR 179.A O no hydrogen 2.956 N/A LYS 282.A NZ SER 284.A OG no hydrogen 2.952 N/A LEU 283.A N THR 19.A O no hydrogen 3.108 N/A LEU 286.A N LEU 283.A O no hydrogen 2.987 N/A THR 287.A N TYR 175.A O no hydrogen 2.509 N/A TYR 293.A N GLY 290.A O no hydrogen 3.320 N/A CYS 296.A N ARG 327.A O no hydrogen 3.180 N/A CYS 296.A SG ARG 327.A O no hydrogen 3.504 N/A PHE 301.A N LYS 319.A O no hydrogen 3.505 N/A LYS 304.A N GLN 317.A O no hydrogen 2.968 N/A THR 307.A N VAL 315.A O no hydrogen 2.856 N/A THR 307.A OG1 VAL 315.A O no hydrogen 3.500 N/A THR 309.A N THR 313.A O no hydrogen 3.072 N/A THR 309.A OG1 THR 313.A O no hydrogen 3.133 N/A THR 309.A OG1 THR 313.A OG1 no hydrogen 2.813 N/A GLY 310.A N ASP 308.A OD1 no hydrogen 3.267 N/A HIS 311.A N THR 309.A OG1 no hydrogen 2.987 N/A THR 313.A OG1 THR 309.A OG1 no hydrogen 2.813 N/A THR 313.A OG1 GLU 362.A OE2 no hydrogen 2.786 N/A VAL 314.A N VAL 363.A O no hydrogen 2.862 N/A VAL 315.A N THR 307.A O no hydrogen 2.984 N/A MET 316.A N ILE 361.A O no hydrogen 2.929 N/A GLN 317.A N LYS 304.A O no hydrogen 2.895 N/A VAL 318.A N VAL 359.A O no hydrogen 2.906 N/A LYS 319.A N PHE 301.A O no hydrogen 3.059 N/A VAL 320.A N ASP 357.A O no hydrogen 2.938 N/A CYS 326.A N ALA 352.A O no hydrogen 2.869 N/A CYS 326.A SG ALA 324.A O no hydrogen 3.139 N/A ARG 327.A N LYS 294.A O no hydrogen 2.833 N/A ILE 331.A N ILE 373.A O no hydrogen 2.935 N/A VAL 332.A N ASN 341.A OD1 no hydrogen 2.760 N/A ALA 333.A N TYR 371.A O no hydrogen 2.940 N/A ASP 334.A N ASP 334.A OD1 no hydrogen 2.409 N/A THR 337.A OG1 ASP 335.A OD2 no hydrogen 3.307 N/A ASN 341.A ND2 GLY 343.A O no hydrogen 3.136 N/A LYS 342.A N VAL 332.A O no hydrogen 2.826 N/A GLY 343.A N ASN 341.A OD1 no hydrogen 3.065 N/A ILE 344.A N ASN 364.A O no hydrogen 3.026 N/A VAL 346.A N GLU 362.A O no hydrogen 2.966 N/A THR 347.A N GLU 362.A O no hydrogen 3.214 N/A ALA 352.A N CYS 326.A O no hydrogen 2.867 N/A THR 354.A OG1 ASN 355.A O no hydrogen 3.410 N/A ASP 356.A N VAL 320.A O no hydrogen 2.592 N/A VAL 359.A N VAL 318.A O no hydrogen 2.889 N/A ILE 361.A N MET 316.A O no hydrogen 2.868 N/A GLU 362.A N THR 347.A OG1 no hydrogen 3.011 N/A VAL 363.A N VAL 314.A O no hydrogen 2.914 N/A ASN 364.A N ILE 344.A O no hydrogen 2.624 N/A GLY 368.A N LYS 387.A O no hydrogen 2.890 N/A SER 370.A N TRP 385.A O no hydrogen 2.877 N/A SER 370.A OG TRP 385.A O no hydrogen 3.404 N/A TYR 371.A N ALA 333.A O no hydrogen 2.840 N/A ILE 372.A N TYR 383.A O no hydrogen 2.869 N/A ILE 373.A N ILE 331.A O no hydrogen 2.878 N/A VAL 374.A N LEU 381.A O no hydrogen 2.901 N/A GLY 375.A N PRO 329.A O no hydrogen 2.920 N/A ARG 380.A NH1 LEU 336.A O no hydrogen 3.095 N/A LEU 381.A N VAL 374.A O no hydrogen 2.880 N/A TYR 383.A N ILE 372.A O no hydrogen 2.917 N/A TRP 385.A N SER 370.A O no hydrogen 2.888 N/A HIS 386.A ND1 ASP 369.A OD1 no hydrogen 2.874 N/A LYS 387.A N GLY 368.A O no hydrogen 2.918 N/A LYS 387.A NZ GLY 312.A O no hydrogen 3.102 N/A LYS 387.A NZ PRO 365.A O no hydrogen 3.200 N/A