Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jqs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLY 16.A O no hydrogen 3.243 N/A CYS 4.A SG ARG 14.A O no hydrogen 3.861 N/A SER 5.A N ARG 14.A O no hydrogen 3.166 N/A SER 5.A OG ARG 14.A O no hydrogen 3.312 N/A ASP 7.A N GLU 12.A O no hydrogen 3.153 N/A SER 9.A OG ASP 7.A OD1 no hydrogen 3.539 N/A LYS 10.A N ASP 7.A O no hydrogen 3.248 N/A ARG 14.A N SER 5.A O no hydrogen 3.328 N/A GLY 16.A N GLY 3.A O no hydrogen 3.426 N/A THR 17.A OG1 HIS 1.A O no hydrogen 2.655 N/A GLY 18.A N HIS 1.A O no hydrogen 3.340 N/A VAL 25.A N ASN 23.A OD1 no hydrogen 3.145 N/A HIS 35.A N VAL 167.A O no hydrogen 3.110 N/A ARG 40.A NH1 PRO 112.A O no hydrogen 2.768 N/A ARG 41.A N SER 38.A O no hydrogen 3.036 N/A ARG 41.A NH2 GLU 110.A OE1 no hydrogen 2.909 N/A LEU 42.A N SER 38.A O no hydrogen 2.700 N/A ALA 43.A N PRO 39.A O no hydrogen 3.303 N/A ALA 45.A N ARG 41.A O no hydrogen 3.136 N/A VAL 46.A N LEU 42.A O no hydrogen 2.994 N/A LYS 47.A N ALA 43.A O no hydrogen 2.936 N/A GLN 48.A N ALA 44.A O no hydrogen 2.917 N/A ALA 49.A N ALA 45.A O no hydrogen 3.071 N/A TRP 50.A N VAL 46.A O no hydrogen 3.211 N/A TRP 50.A N LYS 47.A O no hydrogen 3.145 N/A GLU 51.A N LYS 47.A O no hydrogen 3.311 N/A ASP 52.A N GLN 48.A O no hydrogen 3.067 N/A ILE 54.A N ALA 49.A O no hydrogen 2.871 N/A CYS 55.A N HIS 147.A O no hydrogen 3.070 N/A ILE 57.A N VAL 134.A O no hydrogen 2.710 N/A SER 58.A N.A ALA 149.A O no hydrogen 2.933 N/A SER 58.A N.B ALA 149.A O no hydrogen 2.933 N/A SER 58.A OG.A TRP 98.A O no hydrogen 2.928 N/A SER 58.A OG.B TRP 98.A O no hydrogen 2.928 N/A VAL 60.A N.A GLU 64.A OE1 no hydrogen 3.171 N/A VAL 60.A N.B GLU 64.A OE1 no hydrogen 3.171 N/A ARG 62.A N GLU 219.A OE1 no hydrogen 3.498 N/A ARG 62.A NE ILE 218.A O no hydrogen 3.037 N/A ARG 62.A NH2 GLU 271.A O no hydrogen 3.315 N/A ASN 65.A ND2 GLY 91.A O no hydrogen 3.320 N/A ILE 66.A N ARG 62.A O no hydrogen 3.142 N/A MET 67.A N.A MET 63.A O no hydrogen 3.061 N/A MET 67.A N.B MET 63.A O no hydrogen 3.061 N/A TRP 68.A N GLU 64.A O no hydrogen 2.996 N/A TRP 68.A NE1 GLU 64.A OE2 no hydrogen 3.236 N/A ARG 69.A N ASN 65.A O no hydrogen 3.117 N/A ARG 69.A NH2 ASN 65.A OD1 no hydrogen 3.066 N/A SER 70.A N ILE 66.A O no hydrogen 3.164 N/A SER 70.A OG ILE 66.A O no hydrogen 3.346 N/A VAL 71.A N MET 67.A O.A no hydrogen 3.276 N/A VAL 71.A N MET 67.A O.B no hydrogen 3.276 N/A LEU 75.A N VAL 71.A O no hydrogen 2.843 N/A ASN 76.A N GLU 72.A O no hydrogen 3.213 N/A ALA 77.A N GLY 73.A O no hydrogen 3.372 N/A ILE 78.A N GLU 74.A O no hydrogen 3.254 N/A GLU 80.A N ASN 76.A O no hydrogen 3.369 N/A ASN 82.A N LEU 79.A O no hydrogen 3.232 N/A ASN 82.A ND2 HIS 113.A O no hydrogen 3.380 N/A GLY 83.A N LEU 79.A O no hydrogen 3.256 N/A VAL 84.A N LEU 79.A O no hydrogen 3.128 N/A THR 87.A OG1 THR 129.A OG1 no hydrogen 3.269 N/A VAL 88.A N ASN 76.A OD1 no hydrogen 3.490 N/A VAL 89.A N PHE 133.A O no hydrogen 2.752 N/A ASN 95.A ND2 SER 270.A O no hydrogen 2.773 N/A MET 97.A N MET 220.A O no hydrogen 3.133 N/A ARG 99.A NE THR 222.A O no hydrogen 2.847 N/A ARG 99.A NH2 THR 222.A O no hydrogen 3.034 N/A GLN 102.A N ARG 148.A O no hydrogen 3.367 N/A GLN 102.A NE2 LYS 146.A O no hydrogen 3.240 N/A ARG 103.A NH1 GLY 100.A O no hydrogen 3.030 N/A ARG 103.A NH1 GLN 102.A O no hydrogen 2.270 N/A LEU 104.A N SER 152.A OG no hydrogen 3.178 N/A TRP 115.A NE1 GLU 74.A OE2 no hydrogen 2.246 N/A TRP 118.A NE1 PRO 36.A O no hydrogen 2.156 N/A GLY 119.A N GLU 74.A OE1 no hydrogen 3.230 N/A THR 129.A OG1 GLU 80.A OE2 no hydrogen 3.201 N/A THR 129.A OG1 THR 87.A OG1 no hydrogen 3.269 N/A ASN 131.A ND2 GLN 85.A O no hydrogen 3.081 N/A PHE 133.A N THR 87.A O no hydrogen 2.476 N/A VAL 135.A N VAL 89.A O no hydrogen 2.831 N/A GLU 142.A N THR 139.A O no hydrogen 3.015 N/A CYS 143.A SG HIS 147.A ND1 no hydrogen 3.606 N/A HIS 147.A N PRO 144.A O no hydrogen 3.104 N/A ARG 148.A NH2 THR 139.A OG1 no hydrogen 2.677 N/A ALA 149.A N GLY 56.A O no hydrogen 3.037 N/A TRP 150.A N GLN 102.A O no hydrogen 3.201 N/A ASN 151.A ND2 GLU 178.A O no hydrogen 3.231 N/A LEU 154.A N LYS 170.A O no hydrogen 2.855 N/A VAL 155.A N ASP 180.A OD2 no hydrogen 2.970 N/A GLU 156.A N TRP 168.A O no hydrogen 2.835 N/A HIS 164.A N ARG 31.A O no hydrogen 2.574 N/A THR 165.A OG1 GLY 159.A O no hydrogen 2.417 N/A THR 165.A OG1 VAL 162.A O no hydrogen 2.599 N/A TRP 168.A N ASP 157.A O no hydrogen 2.995 N/A LEU 169.A N HIS 35.A O no hydrogen 2.962 N/A ARG 172.A N SER 152.A O no hydrogen 3.026 N/A ARG 172.A NE ASP 174.A OD1 no hydrogen 3.396 N/A ASP 174.A N ASP 174.A OD1 no hydrogen 2.502 N/A CYS 179.A N GLU 224.A O no hydrogen 2.889 N/A ALA 182.A N ASP 180.A OD1 no hydrogen 3.426 N/A GLY 185.A N SER 196.A O no hydrogen 3.000 N/A THR 186.A OG1 HIS 229.A O no hydrogen 2.899 N/A ALA 187.A N VAL 194.A O no hydrogen 3.119 N/A LYS 189.A N GLU 192.A O no hydrogen 3.024 N/A ALA 193.A N SER 204.A O no hydrogen 3.155 N/A VAL 194.A N ALA 187.A O no hydrogen 2.906 N/A HIS 195.A N ILE 202.A O no hydrogen 2.913 N/A SER 196.A N GLY 185.A O no hydrogen 3.096 N/A SER 196.A OG GLY 185.A O no hydrogen 2.775 N/A ASP 197.A N TYR 200.A O no hydrogen 3.303 N/A GLY 199.A N ASP 197.A OD1 no hydrogen 3.178 N/A TYR 200.A N ASP 197.A OD1 no hydrogen 2.892 N/A TYR 200.A OH LEU 247.A O no hydrogen 2.594 N/A TRP 201.A N HIS 216.A O no hydrogen 3.101 N/A TRP 201.A NE1 GLU 203.A OE2 no hydrogen 2.920 N/A ILE 202.A N HIS 195.A O no hydrogen 2.917 N/A GLU 203.A N ARG 214.A O no hydrogen 2.893 N/A SER 204.A N ALA 193.A O no hydrogen 3.107 N/A SER 204.A OG HIS 254.A O no hydrogen 3.280 N/A GLU 205.A N ARG 211.A O no hydrogen 3.232 N/A LYS 206.A NZ ASP 208.A O no hydrogen 3.529 N/A ASN 207.A N THR 209.A O no hydrogen 3.298 N/A ARG 211.A N GLU 205.A O no hydrogen 3.090 N/A ARG 211.A NE GLU 205.A OE2 no hydrogen 3.260 N/A ARG 211.A NH2 GLU 205.A OE2 no hydrogen 3.312 N/A LEU 212.A N THR 256.A O no hydrogen 2.832 N/A LYS 213.A N GLU 203.A O no hydrogen 3.004 N/A ARG 214.A NH1 GLU 203.A OE2 no hydrogen 3.458 N/A ALA 215.A N ILE 275.A O no hydrogen 3.370 N/A HIS 216.A N TRP 201.A O no hydrogen 2.974 N/A LEU 217.A N LEU 273.A O no hydrogen 3.071 N/A ILE 218.A N GLY 199.A O no hydrogen 3.094 N/A MET 220.A N ASN 95.A OD1 no hydrogen 3.336 N/A LYS 221.A N TYR 200.A OH no hydrogen 3.349 N/A LYS 221.A NZ ASP 197.A OD2 no hydrogen 2.271 N/A THR 222.A OG1 MET 97.A O no hydrogen 2.392 N/A GLU 224.A N LEU 177.A O no hydrogen 2.954 N/A TRP 225.A NE1 HIS 229.A O no hydrogen 3.305 N/A SER 228.A OG HIS 229.A ND1 no hydrogen 2.915 N/A HIS 229.A N PRO 226.A O no hydrogen 3.315 N/A HIS 229.A ND1 SER 228.A OG no hydrogen 2.915 N/A THR 230.A N LYS 227.A O no hydrogen 3.374 N/A THR 230.A OG1 PRO 226.A O no hydrogen 2.606 N/A LEU 231.A N HIS 195.A NE2 no hydrogen 3.458 N/A SER 239.A OG ASP 240.A OD1 no hydrogen 3.410 N/A ASP 240.A N GLU 237.A O no hydrogen 3.233 N/A ILE 242.A N ASN 255.A O no hydrogen 2.977 N/A LEU 247.A N PRO 244.A O no hydrogen 2.985 N/A GLY 249.A N PRO 244.A O no hydrogen 3.291 N/A SER 252.A OG LEU 231.A O no hydrogen 2.232 N/A SER 252.A OG HIS 254.A ND1 no hydrogen 3.150 N/A HIS 253.A N TRP 232.A O no hydrogen 3.327 N/A HIS 253.A NE2 ASP 234.A O no hydrogen 2.963 N/A HIS 254.A N SER 252.A OG no hydrogen 3.261 N/A HIS 254.A ND1 SER 252.A OG no hydrogen 3.150 N/A ASN 255.A N SER 252.A O no hydrogen 3.073 N/A ASN 255.A ND2 ILE 243.A O no hydrogen 3.366 N/A ASN 255.A ND2 PRO 250.A O no hydrogen 3.061 N/A THR 256.A OG1 HIS 253.A O no hydrogen 2.652 N/A ARG 257.A NH1 LEU 212.A O no hydrogen 2.954 N/A TYR 260.A N ARG 257.A O no hydrogen 3.242 N/A TYR 260.A OH THR 317.A O no hydrogen 2.917 N/A ARG 261.A N GLU 334.A OE2 no hydrogen 3.261 N/A THR 262.A N SER 239.A O no hydrogen 3.369 N/A THR 262.A OG1 LEU 241.A O no hydrogen 3.139 N/A GLN 263.A N ILE 242.A O no hydrogen 3.401 N/A GLN 263.A NE2 ARG 261.A O no hydrogen 2.968 N/A GLN 263.A NE2 GLU 334.A OE1 no hydrogen 3.383 N/A TRP 268.A N GLY 266.A O no hydrogen 2.839 N/A TRP 268.A NE1 GLN 263.A O no hydrogen 3.043 N/A SER 270.A N PRO 267.A O no hydrogen 3.419 N/A SER 270.A OG PRO 267.A O no hydrogen 3.022 N/A LEU 273.A N LEU 217.A O no hydrogen 2.894 N/A ILE 275.A N ALA 215.A O no hydrogen 2.843 N/A ARG 276.A N SER 322.A O no hydrogen 3.147 N/A ARG 276.A NH2 GLU 274.A OE1 no hydrogen 2.932 N/A GLU 278.A N PRO 320.A O no hydrogen 2.834 N/A CYS 280.A N TYR 331.A OH no hydrogen 3.337 N/A THR 283.A N CYS 280.A O no hydrogen 3.092 N/A THR 283.A OG1 CYS 280.A O no hydrogen 3.376 N/A THR 283.A OG1 TYR 331.A OH no hydrogen 2.492 N/A LYS 284.A N GLU 309.A O no hydrogen 3.211 N/A HIS 286.A N TRP 311.A O no hydrogen 3.166 N/A GLU 288.A N CYS 313.A O no hydrogen 2.900 N/A ARG 294.A NH1 GLU 334.A OE2 no hydrogen 2.492 N/A ARG 294.A NH2 THR 262.A O no hydrogen 3.085 N/A GLY 295.A N MET 333.A O no hydrogen 3.319 N/A SER 297.A N LYS 265.A O no hydrogen 3.174 N/A SER 297.A OG TYR 331.A O no hydrogen 2.184 N/A ARG 299.A N VAL 346.A O no hydrogen 2.960 N/A ARG 299.A NE THR 301.A O no hydrogen 3.343 N/A ARG 299.A NH2 THR 301.A O no hydrogen 3.458 N/A ARG 299.A NH2 THR 302.A O no hydrogen 3.212 N/A SER 300.A N CYS 329.A O no hydrogen 3.062 N/A SER 300.A OG CYS 329.A O no hydrogen 3.328 N/A THR 302.A N ARG 306.A O no hydrogen 2.904 N/A SER 304.A N THR 302.A OG1 no hydrogen 3.293 N/A ARG 306.A NH2 GLU 340.A OE2 no hydrogen 2.873 N/A ILE 308.A N SER 300.A O no hydrogen 3.066 N/A TRP 311.A N LYS 284.A O no hydrogen 2.993 N/A TRP 311.A NE1 ILE 308.A O no hydrogen 3.109 N/A CYS 312.A N ARG 336.A O no hydrogen 2.802 N/A CYS 312.A SG ARG 336.A O no hydrogen 3.528 N/A CYS 312.A SG PRO 337.A O no hydrogen 3.890 N/A CYS 313.A N HIS 286.A O no hydrogen 3.062 N/A ARG 314.A NE CYS 291.A O no hydrogen 3.135 N/A ARG 314.A NH2 CYS 291.A O no hydrogen 3.127 N/A THR 317.A OG1 GLU 258.A O no hydrogen 2.636 N/A SER 322.A N ARG 276.A O no hydrogen 2.891 N/A SER 322.A OG GLU 278.A O no hydrogen 2.451 N/A SER 322.A OG PRO 320.A O no hydrogen 3.442 N/A PHE 323.A N TRP 330.A O no hydrogen 2.947 N/A ARG 324.A N GLU 274.A O no hydrogen 2.999 N/A ARG 324.A NH2 GLU 278.A O no hydrogen 3.369 N/A ARG 324.A NH2 GLU 279.A O no hydrogen 3.430 N/A ALA 325.A N GLY 328.A O no hydrogen 3.360 N/A CYS 329.A SG TRP 330.A O no hydrogen 3.490 N/A TRP 330.A N PHE 323.A O no hydrogen 2.946 N/A TYR 331.A N LEU 298.A O no hydrogen 3.049 N/A TYR 331.A OH THR 283.A OG1 no hydrogen 2.492 N/A GLY 332.A N LEU 321.A O no hydrogen 3.246 N/A MET 333.A N GLN 263.A OE1 no hydrogen 2.929 N/A ILE 335.A N GLY 332.A O no hydrogen 3.353 N/A ARG 336.A N CYS 312.A O no hydrogen 2.982 N/A ARG 336.A NE GLU 342.A OE2 no hydrogen 3.443 N/A ARG 336.A NH1 PRO 296.A O no hydrogen 3.070 N/A ARG 336.A NH1 MET 333.A O no hydrogen 3.195 N/A ARG 336.A NH2 PRO 296.A O no hydrogen 3.322 N/A ARG 336.A NH2 GLU 342.A OE1 no hydrogen 2.840 N/A ARG 338.A N GLU 310.A O no hydrogen 3.123 N/A ARG 338.A NH1 GLU 310.A OE1 no hydrogen 2.611 N/A ASN 344.A N PRO 341.A O no hydrogen 3.146 N/A ASN 344.A ND2 GLU 340.A OE2 no hydrogen 3.240 N/A LEU 345.A N GLU 342.A O no hydrogen 3.464 N/A SER 348.A N SER 297.A O no hydrogen 3.067 N/A SER 348.A OG LYS 265.A O no hydrogen 2.985 N/A SER 348.A OG GLY 266.A O no hydrogen 3.525 N/A THR 351.A OG1 MET 264.A O no hydrogen 3.511 N/A ALA 352.A N MET 264.A O no hydrogen 3.076 N/A