Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jkh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLY 16.A O no hydrogen 2.956 N/A SER 5.A N ARG 14.A O no hydrogen 2.683 N/A THR 13.A OG1 SER 5.A O no hydrogen 2.951 N/A ARG 14.A N SER 5.A O no hydrogen 2.812 N/A GLY 16.A N GLY 3.A O no hydrogen 2.959 N/A GLY 18.A N HIS 1.A O no hydrogen 3.392 N/A VAL 25.A N ASN 23.A OD1 no hydrogen 3.416 N/A ARG 29.A NH1 ASP 24.A O no hydrogen 2.936 N/A LYS 33.A N THR 165.A O no hydrogen 3.101 N/A TYR 34.A OH ARG 29.A O no hydrogen 2.480 N/A HIS 35.A N VAL 167.A O no hydrogen 2.712 N/A SER 38.A N ASP 37.A OD1 no hydrogen 2.375 N/A ARG 40.A NE LEU 111.A O no hydrogen 2.650 N/A ARG 41.A NH1 VAL 108.A O no hydrogen 3.358 N/A LEU 42.A N SER 38.A O no hydrogen 2.594 N/A ALA 43.A N PRO 39.A O no hydrogen 2.908 N/A ALA 44.A N ARG 40.A O no hydrogen 2.974 N/A ALA 45.A N ARG 41.A O no hydrogen 2.919 N/A VAL 46.A N LEU 42.A O no hydrogen 2.906 N/A LYS 47.A N ALA 43.A O no hydrogen 2.934 N/A GLN 48.A N ALA 44.A O no hydrogen 2.921 N/A ALA 49.A N ALA 45.A O no hydrogen 2.911 N/A TRP 50.A N VAL 46.A O no hydrogen 2.931 N/A GLU 51.A N LYS 47.A O no hydrogen 2.947 N/A ASP 52.A N GLN 48.A O no hydrogen 2.921 N/A GLY 53.A N ALA 49.A O no hydrogen 3.209 N/A ILE 54.A N ALA 49.A O no hydrogen 3.081 N/A CYS 55.A N HIS 147.A O no hydrogen 3.028 N/A CYS 55.A SG PRO 144.A O no hydrogen 4.045 N/A CYS 55.A SG HIS 147.A O no hydrogen 3.624 N/A ILE 57.A N VAL 134.A O no hydrogen 2.978 N/A SER 58.A N ALA 149.A O no hydrogen 2.829 N/A SER 58.A OG TRP 98.A O no hydrogen 3.113 N/A SER 59.A OG ASP 136.A OD1 no hydrogen 2.803 N/A VAL 60.A N.A GLU 64.A OE1 no hydrogen 3.395 N/A VAL 60.A N.B GLU 64.A OE1 no hydrogen 3.410 N/A ARG 62.A N GLU 219.A OE1 no hydrogen 3.301 N/A ARG 62.A NE ILE 218.A O no hydrogen 3.229 N/A ARG 62.A NH2 ILE 218.A O no hydrogen 3.385 N/A ARG 62.A NH2 GLU 271.A O no hydrogen 3.433 N/A ARG 62.A NH2 GLU 271.A OE1 no hydrogen 3.435 N/A ILE 66.A N ARG 62.A O no hydrogen 2.973 N/A MET 67.A N MET 63.A O no hydrogen 2.912 N/A TRP 68.A N GLU 64.A O no hydrogen 2.906 N/A TRP 68.A NE1 GLU 64.A OE2 no hydrogen 3.067 N/A ARG 69.A N ASN 65.A O no hydrogen 2.949 N/A SER 70.A N ILE 66.A O no hydrogen 2.918 N/A SER 70.A OG ILE 66.A O no hydrogen 3.008 N/A VAL 71.A N MET 67.A O no hydrogen 3.003 N/A VAL 71.A N TRP 68.A O no hydrogen 3.220 N/A GLU 72.A N TRP 68.A O no hydrogen 2.945 N/A LEU 75.A N VAL 71.A O no hydrogen 2.991 N/A ASN 76.A N GLU 72.A O no hydrogen 2.903 N/A ASN 76.A ND2 VAL 88.A O no hydrogen 3.524 N/A ALA 77.A N GLY 73.A O no hydrogen 2.978 N/A ILE 78.A N GLU 74.A O no hydrogen 2.898 N/A LEU 79.A N LEU 75.A O no hydrogen 2.954 N/A GLU 80.A N ASN 76.A O no hydrogen 2.901 N/A GLU 81.A N ALA 77.A O no hydrogen 2.926 N/A ASN 82.A N LEU 79.A O no hydrogen 3.220 N/A GLY 83.A N GLU 80.A O no hydrogen 3.091 N/A VAL 84.A N LEU 79.A O no hydrogen 3.254 N/A LEU 86.A N VAL 84.A O no hydrogen 3.076 N/A THR 87.A N ASN 131.A O no hydrogen 3.041 N/A VAL 88.A N ASN 76.A OD1 no hydrogen 2.960 N/A VAL 89.A N PHE 133.A O no hydrogen 3.016 N/A MET 97.A N MET 220.A O no hydrogen 3.026 N/A GLN 102.A N ARG 148.A O no hydrogen 3.372 N/A GLN 102.A NE2 LYS 146.A O no hydrogen 2.857 N/A ARG 103.A NH1 GLY 100.A O no hydrogen 3.406 N/A ARG 103.A NH1 GLN 102.A O no hydrogen 2.869 N/A ARG 103.A NH2 SER 176.A O no hydrogen 2.816 N/A TRP 118.A NE1 PRO 36.A O no hydrogen 2.695 N/A GLY 119.A N GLU 74.A OE1 no hydrogen 3.052 N/A GLY 119.A N GLU 74.A OE2 no hydrogen 3.206 N/A LYS 120.A N GLU 74.A OE1 no hydrogen 3.399 N/A THR 129.A OG1 ALA 127.A O no hydrogen 3.531 N/A ASN 131.A ND2 GLN 85.A O no hydrogen 3.105 N/A PHE 133.A N THR 87.A O no hydrogen 2.723 N/A VAL 135.A N VAL 89.A O no hydrogen 2.749 N/A ARG 148.A N LEU 145.A O no hydrogen 3.159 N/A ARG 148.A NH2 THR 139.A OG1 no hydrogen 2.695 N/A ALA 149.A N GLY 56.A O no hydrogen 2.979 N/A TRP 150.A N GLN 102.A O no hydrogen 3.185 N/A ASN 151.A ND2 SER 176.A O no hydrogen 3.556 N/A LEU 154.A N LYS 170.A O no hydrogen 2.787 N/A GLU 156.A N TRP 168.A O no hydrogen 2.755 N/A ASP 157.A N TRP 168.A O no hydrogen 3.488 N/A HIS 158.A N ASP 157.A OD1 no hydrogen 2.849 N/A HIS 158.A NE2 ALA 182.A O no hydrogen 3.126 N/A GLY 161.A N TYR 32.A OH no hydrogen 3.258 N/A VAL 162.A N GLY 159.A O no hydrogen 3.065 N/A THR 165.A N VAL 162.A O no hydrogen 3.424 N/A THR 165.A OG1 GLY 159.A O no hydrogen 2.940 N/A THR 165.A OG1 VAL 162.A O no hydrogen 2.788 N/A SER 166.A OG LYS 33.A O no hydrogen 3.517 N/A SER 166.A OG HIS 35.A ND1 no hydrogen 2.636 N/A VAL 167.A N LYS 33.A O no hydrogen 2.775 N/A TRP 168.A N ASP 157.A O no hydrogen 2.918 N/A LEU 169.A N HIS 35.A O no hydrogen 3.087 N/A ARG 172.A N SER 152.A O no hydrogen 3.434 N/A ARG 172.A NE ASP 174.A OD1 no hydrogen 3.516 N/A ARG 172.A NH1 PHE 153.A O no hydrogen 3.423 N/A CYS 179.A N GLU 224.A O no hydrogen 2.825 N/A CYS 179.A SG GLU 224.A O no hydrogen 3.207 N/A GLY 185.A N SER 196.A O no hydrogen 2.947 N/A THR 186.A OG1 HIS 229.A O no hydrogen 3.014 N/A ALA 187.A N VAL 194.A O no hydrogen 3.042 N/A LYS 189.A N GLU 192.A O no hydrogen 2.987 N/A ALA 193.A N SER 204.A O no hydrogen 3.499 N/A VAL 194.A N ALA 187.A O no hydrogen 2.815 N/A HIS 195.A N ILE 202.A O no hydrogen 2.991 N/A SER 196.A N GLY 185.A O no hydrogen 3.037 N/A SER 196.A OG GLY 185.A O no hydrogen 2.417 N/A ASP 197.A N TYR 200.A O no hydrogen 3.226 N/A GLY 199.A N ASP 197.A OD1 no hydrogen 3.013 N/A TYR 200.A N ASP 197.A OD1 no hydrogen 2.600 N/A TYR 200.A OH LEU 247.A O no hydrogen 2.766 N/A TRP 201.A N HIS 216.A O no hydrogen 3.179 N/A TRP 201.A NE1 GLU 203.A OE2 no hydrogen 3.043 N/A ILE 202.A N HIS 195.A O no hydrogen 2.987 N/A GLU 203.A N ARG 214.A O no hydrogen 2.887 N/A SER 204.A N ALA 193.A O no hydrogen 3.082 N/A SER 204.A OG HIS 254.A O no hydrogen 3.085 N/A GLU 205.A N ARG 211.A O no hydrogen 3.139 N/A LYS 206.A N LYS 191.A O no hydrogen 3.258 N/A LYS 206.A NZ ASN 207.A O no hydrogen 2.752 N/A LYS 206.A NZ ASP 208.A O no hydrogen 3.235 N/A ARG 211.A N GLU 205.A O no hydrogen 3.080 N/A ARG 211.A NE GLU 205.A OE2 no hydrogen 2.800 N/A ARG 211.A NH2 GLU 205.A OE2 no hydrogen 2.597 N/A LEU 212.A N THR 256.A O no hydrogen 2.817 N/A LYS 213.A N GLU 203.A O no hydrogen 2.982 N/A ARG 214.A NE GLU 274.A OE2 no hydrogen 3.076 N/A ARG 214.A NH1 GLU 274.A OE2 no hydrogen 3.031 N/A ALA 215.A N ILE 275.A O no hydrogen 3.024 N/A HIS 216.A N TRP 201.A O no hydrogen 3.046 N/A HIS 216.A NE2 GLU 272.A OE2 no hydrogen 3.348 N/A LEU 217.A N LEU 273.A O no hydrogen 3.219 N/A ILE 218.A N GLY 199.A O no hydrogen 3.261 N/A LYS 221.A N TYR 200.A OH no hydrogen 3.386 N/A LYS 221.A NZ ASP 197.A OD2 no hydrogen 2.800 N/A THR 222.A OG1 MET 97.A O no hydrogen 2.463 N/A GLU 224.A N LEU 177.A O no hydrogen 3.195 N/A TRP 225.A NE1 HIS 229.A O no hydrogen 3.174 N/A SER 228.A OG HIS 229.A ND1 no hydrogen 3.167 N/A HIS 229.A N PRO 226.A O no hydrogen 3.314 N/A HIS 229.A ND1 SER 228.A OG no hydrogen 3.167 N/A THR 230.A OG1 PRO 226.A O no hydrogen 2.954 N/A LEU 231.A N HIS 195.A NE2 no hydrogen 3.531 N/A ASP 240.A N GLU 237.A O no hydrogen 3.435 N/A ILE 242.A N ASN 255.A O no hydrogen 3.036 N/A ILE 243.A N ASN 255.A OD1 no hydrogen 3.484 N/A LEU 247.A N PRO 244.A O no hydrogen 3.085 N/A GLY 249.A N PRO 244.A O no hydrogen 3.299 N/A HIS 253.A NE2 ASP 234.A O no hydrogen 2.983 N/A ASN 255.A N SER 252.A O no hydrogen 3.125 N/A ASN 255.A ND2 ILE 243.A O no hydrogen 3.393 N/A ASN 255.A ND2 PRO 250.A O no hydrogen 2.972 N/A THR 256.A OG1 HIS 253.A O no hydrogen 2.545 N/A ARG 257.A NH1 LEU 212.A O no hydrogen 2.652 N/A TYR 260.A N ARG 257.A O no hydrogen 3.454 N/A TYR 260.A OH THR 317.A O no hydrogen 3.087 N/A ARG 261.A N GLU 334.A OE2 no hydrogen 3.407 N/A THR 262.A OG1 LEU 241.A O no hydrogen 3.406 N/A GLN 263.A N ILE 242.A O no hydrogen 3.423 N/A GLN 263.A NE2 ARG 261.A O no hydrogen 3.262 N/A GLN 263.A NE2 GLU 334.A OE1 no hydrogen 3.274 N/A TRP 268.A N GLY 266.A O no hydrogen 2.801 N/A SER 270.A N PRO 267.A O no hydrogen 3.378 N/A SER 270.A OG PRO 267.A O no hydrogen 3.032 N/A LEU 273.A N LEU 217.A O no hydrogen 3.217 N/A ILE 275.A N ALA 215.A O no hydrogen 2.774 N/A ARG 276.A N SER 322.A O no hydrogen 3.155 N/A CYS 280.A N TYR 331.A OH no hydrogen 3.381 N/A THR 283.A N CYS 280.A O no hydrogen 3.091 N/A THR 283.A OG1 CYS 280.A O no hydrogen 2.561 N/A THR 283.A OG1 TYR 331.A OH no hydrogen 2.761 N/A LYS 284.A N GLU 309.A O no hydrogen 2.944 N/A HIS 286.A N TRP 311.A O no hydrogen 3.385 N/A GLU 288.A N CYS 313.A O no hydrogen 2.821 N/A CYS 291.A N GLU 288.A O no hydrogen 3.406 N/A CYS 291.A SG ARG 336.A O no hydrogen 4.030 N/A ARG 294.A NE GLU 334.A OE2 no hydrogen 2.720 N/A ARG 294.A NH1 THR 262.A O no hydrogen 3.195 N/A ARG 294.A NH1 GLU 334.A OE2 no hydrogen 2.699 N/A GLY 295.A N MET 333.A O no hydrogen 3.188 N/A SER 297.A N LYS 265.A O no hydrogen 3.314 N/A SER 297.A OG TYR 331.A O no hydrogen 2.320 N/A ARG 299.A N VAL 346.A O no hydrogen 3.351 N/A ARG 299.A NE THR 301.A O no hydrogen 3.479 N/A SER 300.A N CYS 329.A O no hydrogen 2.952 N/A THR 302.A N ARG 306.A O no hydrogen 2.649 N/A THR 302.A OG1 ARG 306.A O no hydrogen 3.040 N/A GLY 305.A N THR 302.A O no hydrogen 2.867 N/A ARG 306.A NH1 GLU 340.A OE2 no hydrogen 2.638 N/A ARG 306.A NH2 GLU 340.A OE1 no hydrogen 2.705 N/A ARG 306.A NH2 GLU 340.A OE2 no hydrogen 3.264 N/A ILE 308.A N SER 300.A O no hydrogen 3.163 N/A TRP 311.A N LYS 284.A O no hydrogen 2.991 N/A CYS 312.A N ARG 336.A O no hydrogen 2.893 N/A CYS 312.A SG ARG 336.A O no hydrogen 3.470 N/A CYS 313.A N HIS 286.A O no hydrogen 3.277 N/A ARG 314.A NE CYS 291.A O no hydrogen 2.783 N/A THR 317.A OG1 GLU 258.A O no hydrogen 2.870 N/A THR 317.A OG1 GLU 258.A OE1 no hydrogen 3.388 N/A SER 322.A N ARG 276.A O no hydrogen 3.115 N/A SER 322.A OG ARG 276.A O no hydrogen 3.224 N/A SER 322.A OG GLU 278.A O no hydrogen 3.265 N/A PHE 323.A N TRP 330.A O no hydrogen 3.035 N/A ARG 324.A N GLU 274.A O no hydrogen 3.027 N/A ARG 324.A NE SER 322.A OG no hydrogen 3.009 N/A CYS 329.A SG TRP 330.A O no hydrogen 3.397 N/A TRP 330.A N PHE 323.A O no hydrogen 2.931 N/A TYR 331.A N LEU 298.A O no hydrogen 2.856 N/A TYR 331.A OH THR 283.A OG1 no hydrogen 2.761 N/A GLY 332.A N LEU 321.A O no hydrogen 2.972 N/A MET 333.A N GLN 263.A OE1 no hydrogen 3.143 N/A ILE 335.A N GLY 332.A O no hydrogen 3.297 N/A ARG 336.A N CYS 312.A O no hydrogen 2.986 N/A ARG 336.A NH1 PRO 296.A O no hydrogen 2.395 N/A ARG 336.A NH2 PRO 296.A O no hydrogen 3.314 N/A ARG 336.A NH2 GLU 342.A OE1 no hydrogen 3.315 N/A ARG 338.A N GLU 310.A O no hydrogen 2.986 N/A ARG 338.A NH2 GLU 310.A OE1 no hydrogen 3.130 N/A ARG 338.A NH2 GLU 310.A OE2 no hydrogen 2.696 N/A LYS 339.A NZ GLU 310.A OE2 no hydrogen 2.378 N/A ASN 344.A N PRO 341.A O no hydrogen 3.262 N/A ASN 344.A ND2 GLU 340.A OE2 no hydrogen 3.327 N/A LEU 345.A N GLU 342.A O no hydrogen 3.286 N/A SER 348.A N SER 297.A O no hydrogen 3.179 N/A SER 348.A OG LYS 265.A O no hydrogen 2.632 N/A ALA 352.A N MET 264.A O no hydrogen 3.006 N/A