Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8unj_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 GLU 202.A OE2 no hydrogen 2.860 N/A ASP 5.A N LEU 2.A O no hydrogen 3.260 N/A LYS 6.A N LEU 2.A O no hydrogen 2.964 N/A LYS 6.A NZ GLU 202.A OE2 no hydrogen 3.080 N/A ARG 14.A N SER 11.A O no hydrogen 3.285 N/A TYR 17.A OH ALA 45.A O no hydrogen 2.348 N/A HIS 18.A NE2 PRO 184.A O no hydrogen 2.484 N/A LYS 19.A NZ LEU 15.A O no hydrogen 2.470 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.953 N/A ALA 22.A N HIS 18.A O no hydrogen 3.128 N/A ALA 23.A N LYS 19.A O no hydrogen 2.919 N/A GLN 24.A N GLU 20.A O no hydrogen 2.934 N/A LEU 25.A N GLN 21.A O no hydrogen 2.899 N/A ARG 26.A N ALA 22.A O no hydrogen 2.870 N/A ASN 27.A N ALA 23.A O no hydrogen 2.954 N/A LEU 28.A N GLN 24.A O no hydrogen 2.916 N/A VAL 29.A N LEU 25.A O no hydrogen 3.339 N/A CYS 31.A SG ASN 27.A O no hydrogen 3.872 N/A HIS 36.A NE2 MET 151.A O no hydrogen 2.704 N/A LEU 37.A N LEU 160.A O no hydrogen 2.909 N/A LEU 38.A N LEU 179.A O no hydrogen 2.817 N/A VAL 39.A N LEU 162.A O no hydrogen 2.913 N/A TYR 40.A N VAL 181.A O no hydrogen 3.312 N/A ALA 45.A N PRO 42.A O no hydrogen 3.419 N/A LYS 47.A NZ PRO 42.A O no hydrogen 2.410 N/A ARG 50.A N GLY 46.A O no hydrogen 3.107 N/A ARG 50.A NH1 GLY 46.A O no hydrogen 3.041 N/A ARG 50.A NH2 TYR 17.A O no hydrogen 2.870 N/A ILE 51.A N LYS 47.A O no hydrogen 2.892 N/A MET 52.A N LYS 48.A O no hydrogen 2.934 N/A CYS 53.A N THR 49.A O no hydrogen 2.922 N/A CYS 53.A SG CYS 10.A O no hydrogen 3.578 N/A CYS 53.A SG SER 11.A O no hydrogen 3.258 N/A CYS 53.A SG THR 49.A O no hydrogen 3.221 N/A ILE 54.A N ARG 50.A O no hydrogen 2.853 N/A LEU 55.A N ILE 51.A O no hydrogen 2.898 N/A ARG 56.A N MET 52.A O no hydrogen 2.851 N/A ARG 56.A NE ARG 56.A O no hydrogen 3.506 N/A GLU 57.A N CYS 53.A O no hydrogen 2.928 N/A LEU 58.A N ILE 54.A O no hydrogen 2.883 N/A TYR 59.A N LEU 55.A O no hydrogen 3.072 N/A LEU 66.A N GLU 64.A O no hydrogen 2.903 N/A ARG 67.A N ALA 87.A O no hydrogen 2.939 N/A ARG 67.A NH2 ASN 89.A OD1 no hydrogen 2.455 N/A GLU 69.A N THR 85.A O no hydrogen 2.898 N/A HIS 70.A ND1 GLU 82.A OE2 no hydrogen 2.474 N/A GLN 71.A N ILE 83.A O no hydrogen 2.940 N/A ILE 73.A N ILE 81.A O no hydrogen 2.885 N/A THR 75.A N LYS 79.A O no hydrogen 3.373 N/A THR 75.A OG1 LYS 79.A O no hydrogen 2.602 N/A SER 77.A OG SER 77.A O no hydrogen 2.525 N/A LYS 78.A N THR 75.A O no hydrogen 2.977 N/A LYS 79.A N THR 75.A OG1 no hydrogen 2.747 N/A LYS 80.A NZ THR 74.A OG1 no hydrogen 2.429 N/A ILE 81.A N ILE 73.A O no hydrogen 2.946 N/A ILE 83.A N GLN 71.A O no hydrogen 2.876 N/A THR 85.A N GLU 69.A O no hydrogen 2.902 N/A THR 85.A OG1 GLU 69.A O no hydrogen 3.419 N/A ILE 86.A N GLU 93.A O no hydrogen 2.936 N/A ALA 87.A N ARG 67.A O no hydrogen 2.860 N/A SER 88.A N HIS 91.A O no hydrogen 3.204 N/A HIS 91.A NE2 GLU 93.A OE2 no hydrogen 3.021 N/A LEU 92.A N VAL 130.A O no hydrogen 2.923 N/A GLU 93.A N ILE 86.A O no hydrogen 2.829 N/A VAL 94.A N LEU 132.A O no hydrogen 2.878 N/A ASN 95.A ND2 ASP 98.A OD2 no hydrogen 3.188 N/A ASN 95.A ND2 GLU 135.A OE2 no hydrogen 2.811 N/A SER 97.A OG GLU 135.A O no hydrogen 3.199 N/A ASP 98.A N ASN 95.A O no hydrogen 3.422 N/A ALA 99.A N PRO 96.A O no hydrogen 2.915 N/A GLY 100.A N SER 97.A O no hydrogen 2.927 N/A SER 102.A N ALA 99.A O no hydrogen 2.935 N/A ARG 104.A NE GLN 108.A OE1 no hydrogen 2.707 N/A VAL 105.A N SER 102.A O no hydrogen 2.959 N/A VAL 106.A N SER 102.A O no hydrogen 3.442 N/A ILE 107.A N ASP 103.A O no hydrogen 2.793 N/A GLN 108.A N ARG 104.A O no hydrogen 2.522 N/A GLU 109.A N VAL 105.A O no hydrogen 2.604 N/A LEU 111.A N VAL 106.A O no hydrogen 3.305 N/A LYS 112.A NZ GLN 116.A OE1 no hydrogen 3.442 N/A THR 113.A N GLU 109.A O no hydrogen 3.264 N/A THR 113.A OG1 GLU 109.A O no hydrogen 3.526 N/A THR 113.A OG1 MET 110.A O no hydrogen 2.335 N/A VAL 114.A N MET 110.A O no hydrogen 3.175 N/A VAL 114.A N LEU 111.A O no hydrogen 3.004 N/A ALA 115.A N LYS 112.A O no hydrogen 2.973 N/A GLN 116.A N LYS 112.A O no hydrogen 2.710 N/A GLN 116.A NE2 TYR 154.A OH no hydrogen 2.976 N/A SER 117.A OG THR 113.A O no hydrogen 2.803 N/A ARG 126.A NH1 LEU 58.A O no hydrogen 3.181 N/A VAL 131.A N ARG 159.A O no hydrogen 2.684 N/A LEU 132.A N LEU 92.A O no hydrogen 2.843 N/A THR 134.A N VAL 94.A O no hydrogen 2.925 N/A THR 134.A OG1 VAL 94.A O no hydrogen 3.557 N/A THR 134.A OG1 LEU 132.A O no hydrogen 3.524 N/A VAL 136.A N CYS 163.A O no hydrogen 3.419 N/A ASP 137.A N ASP 137.A OD1 no hydrogen 2.497 N/A LYS 138.A N GLU 135.A O no hydrogen 3.266 N/A LEU 139.A N VAL 136.A O no hydrogen 3.280 N/A THR 140.A N ASP 103.A OD2 no hydrogen 2.941 N/A THR 140.A OG1 ASP 103.A OD1 no hydrogen 2.882 N/A THR 140.A OG1 ASP 103.A OD2 no hydrogen 3.122 N/A ALA 143.A N THR 140.A OG1 no hydrogen 3.426 N/A GLN 144.A N THR 140.A O no hydrogen 3.203 N/A GLN 144.A NE2 LYS 169.A O no hydrogen 3.191 N/A HIS 145.A N LYS 141.A O no hydrogen 2.911 N/A ALA 146.A N ASP 142.A O no hydrogen 2.904 N/A LEU 147.A N GLN 144.A O no hydrogen 3.089 N/A THR 150.A OG1 ALA 146.A O no hydrogen 3.071 N/A MET 151.A N LEU 147.A O no hydrogen 3.077 N/A GLU 152.A N ARG 148.A O no hydrogen 3.262 N/A LYS 153.A N ARG 149.A O no hydrogen 3.252 N/A THR 157.A N TYR 154.A O no hydrogen 3.268 N/A CYS 158.A N TYR 154.A O no hydrogen 2.957 N/A CYS 158.A SG TYR 154.A O no hydrogen 3.306 N/A ARG 159.A N LYS 129.A O no hydrogen 2.574 N/A LEU 160.A N HIS 36.A ND1 no hydrogen 3.467 N/A ILE 161.A N VAL 131.A O no hydrogen 3.045 N/A LEU 162.A N LEU 37.A O no hydrogen 2.888 N/A CYS 164.A N VAL 39.A O no hydrogen 2.946 N/A CYS 164.A SG VAL 39.A O no hydrogen 3.691 N/A VAL 170.A N THR 167.A O no hydrogen 3.039 N/A ILE 174.A N ILE 171.A O no hydrogen 2.937 N/A ARG 175.A N ILE 171.A O no hydrogen 3.269 N/A ARG 175.A NE THR 167.A O no hydrogen 2.771 N/A ARG 175.A NE VAL 170.A O no hydrogen 3.070 N/A ARG 175.A NH2 THR 167.A O no hydrogen 3.474 N/A SER 176.A N PRO 172.A O no hydrogen 2.899 N/A SER 176.A OG PRO 172.A O no hydrogen 2.722 N/A ARG 177.A N ILE 174.A O no hydrogen 3.217 N/A ARG 177.A NE GLU 152.A OE1 no hydrogen 3.437 N/A CYS 178.A SG ILE 174.A O no hydrogen 3.238 N/A LEU 179.A N HIS 36.A O no hydrogen 2.492 N/A VAL 181.A N LEU 38.A O no hydrogen 2.942 N/A VAL 183.A N TYR 40.A O no hydrogen 2.987 N/A SER 187.A N ASP 190.A OD2 no hydrogen 3.167 N/A SER 187.A OG ASP 190.A OD2 no hydrogen 2.474 N/A ILE 191.A N SER 187.A O no hydrogen 2.800 N/A CYS 192.A N ILE 188.A O no hydrogen 2.914 N/A CYS 192.A SG ILE 188.A O no hydrogen 3.255 N/A CYS 192.A SG HIS 212.A ND1 no hydrogen 3.570 N/A HIS 193.A N GLU 189.A O no hydrogen 2.890 N/A VAL 194.A N ASP 190.A O no hydrogen 2.913 N/A LEU 195.A N ILE 191.A O no hydrogen 2.884 N/A SER 196.A N CYS 192.A O no hydrogen 2.901 N/A SER 196.A OG CYS 192.A O no hydrogen 2.775 N/A THR 197.A N HIS 193.A O no hydrogen 2.894 N/A THR 197.A OG1 HIS 193.A O no hydrogen 2.396 N/A VAL 198.A N VAL 194.A O no hydrogen 2.910 N/A CYS 199.A N LEU 195.A O no hydrogen 2.937 N/A CYS 199.A SG LEU 195.A O no hydrogen 3.414 N/A LYS 200.A N SER 196.A O no hydrogen 2.878 N/A LYS 201.A N THR 197.A O no hydrogen 2.919 N/A GLU 202.A N VAL 198.A O no hydrogen 3.096 N/A GLU 202.A N CYS 199.A O no hydrogen 3.158 N/A LEU 204.A N CYS 199.A O no hydrogen 2.708 N/A ALA 211.A N PRO 207.A O no hydrogen 3.211 N/A HIS 212.A N SER 208.A O no hydrogen 2.927 N/A HIS 212.A ND1 SER 208.A O no hydrogen 2.583 N/A ARG 213.A N GLN 209.A O no hydrogen 2.928 N/A ARG 213.A NE ALA 241.A O no hydrogen 3.229 N/A ARG 213.A NH2 ALA 241.A O no hydrogen 3.440 N/A ARG 213.A NH2 GLN 243.A O no hydrogen 2.416 N/A LEU 214.A N LEU 210.A O no hydrogen 2.895 N/A ALA 215.A N ALA 211.A O no hydrogen 2.923 N/A GLU 216.A N HIS 212.A O no hydrogen 2.898 N/A LYS 217.A N ARG 213.A O no hydrogen 2.944 N/A SER 218.A OG LEU 214.A O no hydrogen 3.363 N/A SER 218.A OG ALA 215.A O no hydrogen 3.271 N/A SER 218.A OG ASN 221.A O no hydrogen 3.418 N/A ARG 220.A NE PRO 186.A O no hydrogen 2.753 N/A ARG 220.A NH2 ALA 185.A O no hydrogen 2.852 N/A ASN 221.A N SER 218.A O no hydrogen 3.245 N/A ASN 221.A ND2 SER 43.A O no hydrogen 2.841 N/A LEU 222.A N GLY 44.A O no hydrogen 3.478 N/A LYS 224.A N ASN 221.A OD1 no hydrogen 2.835 N/A ALA 225.A N ASN 221.A O no hydrogen 3.081 N/A LEU 226.A N LEU 222.A O no hydrogen 2.920 N/A LEU 227.A N ARG 223.A O no hydrogen 2.969 N/A MET 228.A N LYS 224.A O no hydrogen 2.916 N/A CYS 229.A N ALA 225.A O no hydrogen 2.896 N/A GLU 230.A N LEU 226.A O no hydrogen 2.977 N/A ALA 231.A N LEU 227.A O no hydrogen 2.904 N/A CYS 232.A N MET 228.A O no hydrogen 2.884 N/A CYS 232.A SG MET 228.A O no hydrogen 3.279 N/A ARG 233.A N CYS 229.A O no hydrogen 2.915 N/A VAL 234.A N GLU 230.A O no hydrogen 2.919 N/A GLN 235.A N ALA 231.A O no hydrogen 2.897 N/A GLN 235.A NE2 GLU 244.A O no hydrogen 2.643 N/A GLN 236.A N CYS 232.A O no hydrogen 3.094 N/A GLN 236.A NE2 PRO 238.A O no hydrogen 3.198 N/A THR 240.A N GLN 243.A OE1 no hydrogen 3.451 N/A GLN 243.A NE2 CYS 232.A O no hydrogen 2.906 N/A GLN 243.A NE2 GLN 236.A O no hydrogen 3.229 N/A GLU 247.A N ILE 245.A O no hydrogen 2.748 N/A VAL 252.A N THR 248.A O no hydrogen 2.850 N/A TYR 253.A N ASP 249.A O no hydrogen 2.869 N/A LEU 254.A N TRP 250.A O no hydrogen 2.948 N/A ARG 255.A N GLU 251.A O no hydrogen 2.880 N/A GLU 256.A N VAL 252.A O no hydrogen 2.872 N/A THR 257.A N TYR 253.A O no hydrogen 2.871 N/A THR 257.A OG1 TYR 253.A O no hydrogen 2.763 N/A ALA 258.A N LEU 254.A O no hydrogen 2.930 N/A ASN 259.A N ARG 255.A O no hydrogen 2.903 N/A ALA 260.A N GLU 256.A O no hydrogen 2.822 N/A ILE 261.A N THR 257.A O no hydrogen 2.964 N/A VAL 262.A N ALA 258.A O no hydrogen 2.930 N/A SER 263.A N ASN 259.A O no hydrogen 2.869 N/A SER 263.A OG ASN 259.A O no hydrogen 2.966 N/A SER 263.A OG ALA 260.A O no hydrogen 3.108 N/A GLN 264.A N ALA 260.A O no hydrogen 3.152 N/A GLN 268.A N GLN 268.A OE1 no hydrogen 3.029 N/A LEU 270.A N THR 266.A O no hydrogen 2.991 N/A LEU 271.A N PRO 267.A O no hydrogen 2.894 N/A GLU 272.A N GLN 268.A O no hydrogen 2.926 N/A VAL 273.A N ARG 269.A O no hydrogen 2.896 N/A ARG 274.A N LEU 270.A O no hydrogen 2.862 N/A GLY 275.A N LEU 271.A O no hydrogen 2.911 N/A ARG 276.A N GLU 272.A O no hydrogen 2.951 N/A ARG 276.A NH1 GLU 272.A OE2 no hydrogen 2.583 N/A LEU 277.A N VAL 273.A O no hydrogen 2.862 N/A TYR 278.A N ARG 274.A O no hydrogen 2.812 N/A GLU 279.A N GLY 275.A O no hydrogen 2.888 N/A LEU 280.A N ARG 276.A O no hydrogen 2.947 N/A LEU 281.A N LEU 277.A O no hydrogen 2.849 N/A THR 282.A N TYR 278.A O no hydrogen 2.707 N/A THR 282.A OG1 TYR 278.A O no hydrogen 2.802 N/A THR 282.A OG1 GLU 279.A O no hydrogen 3.037 N/A HIS 283.A N GLU 279.A O no hydrogen 3.183 N/A HIS 283.A ND1 GLU 279.A O no hydrogen 2.390 N/A CYS 284.A N LEU 281.A O no hydrogen 2.965 N/A CYS 284.A SG THR 282.A O no hydrogen 3.400 N/A ILE 290.A N PRO 286.A O no hydrogen 3.186 N/A MET 291.A N PRO 287.A O no hydrogen 2.896 N/A LYS 292.A N GLU 288.A O no hydrogen 2.900 N/A GLY 293.A N ILE 289.A O no hydrogen 2.894 N/A LEU 294.A N ILE 290.A O no hydrogen 2.893 N/A LEU 295.A N MET 291.A O no hydrogen 2.933 N/A SER 296.A N LYS 292.A O no hydrogen 2.886 N/A GLU 297.A N GLY 293.A O no hydrogen 2.936 N/A LEU 298.A N LEU 294.A O no hydrogen 2.867 N/A LEU 299.A N LEU 295.A O no hydrogen 3.027 N/A ASN 301.A N LEU 298.A O no hydrogen 3.224 N/A CYS 302.A SG LEU 298.A O no hydrogen 3.302 N/A GLY 304.A N ASP 303.A OD1 no hydrogen 2.605 N/A LEU 306.A N ASP 303.A O no hydrogen 2.969 N/A LYS 307.A NZ LEU 299.A O no hydrogen 2.427 N/A LYS 307.A NZ CYS 302.A O no hydrogen 3.469 N/A GLU 309.A N GLU 309.A OE1 no hydrogen 2.738 N/A VAL 310.A N LEU 306.A O no hydrogen 3.447 N/A ALA 311.A N LYS 307.A O no hydrogen 2.958 N/A GLN 312.A N GLY 308.A O no hydrogen 2.897 N/A MET 313.A N GLU 309.A O no hydrogen 2.912 N/A ALA 314.A N VAL 310.A O no hydrogen 2.878 N/A ALA 315.A N ALA 311.A O no hydrogen 2.942 N/A TYR 316.A N GLN 312.A O no hydrogen 2.938 N/A TYR 317.A N MET 313.A O no hydrogen 2.836 N/A GLU 318.A N ALA 314.A O no hydrogen 2.915 N/A HIS 319.A N ALA 315.A O no hydrogen 2.952 N/A ARG 320.A N TYR 316.A O no hydrogen 2.916 N/A ARG 320.A NH1 TYR 316.A OH no hydrogen 2.739 N/A LEU 321.A N TYR 317.A O no hydrogen 2.860 N/A GLN 322.A N GLU 318.A O no hydrogen 2.937 N/A GLN 322.A NE2 GLU 318.A OE2 no hydrogen 3.296 N/A LEU 323.A N HIS 319.A O no hydrogen 2.909 N/A GLY 324.A N ARG 320.A O no hydrogen 2.979 N/A LEU 331.A N ALA 327.A O no hydrogen 2.933 N/A GLU 332.A N ILE 328.A O no hydrogen 2.784 N/A ALA 333.A N TYR 329.A O no hydrogen 2.873 N/A PHE 334.A N HIS 330.A O no hydrogen 2.918 N/A VAL 335.A N LEU 331.A O no hydrogen 2.965 N/A ALA 336.A N GLU 332.A O no hydrogen 2.872 N/A LYS 337.A N ALA 333.A O no hydrogen 2.907 N/A PHE 338.A N PHE 334.A O no hydrogen 2.929 N/A MET 339.A N VAL 335.A O no hydrogen 2.898 N/A ALA 340.A N ALA 336.A O no hydrogen 2.947 N/A LEU 341.A N LYS 337.A O no hydrogen 2.940 N/A TYR 342.A N PHE 338.A O no hydrogen 2.823 N/A TYR 342.A OH ASN 301.A OD1 no hydrogen 3.199 N/A LYS 343.A N MET 339.A O no hydrogen 2.885 N/A LYS 343.A NZ GLN 265.A O no hydrogen 2.970 N/A LYS 344.A N ALA 340.A O no hydrogen 2.957 N/A PHE 345.A N LEU 341.A O no hydrogen 2.860 N/A MET 346.A N TYR 342.A O no hydrogen 2.763 N/A GLU 347.A N LYS 343.A O no hydrogen 2.930 N/A