Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8gau_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH GLU 177.A OE2 no hydrogen 2.666 N/A ARG 3.A N ASP 103.A O no hydrogen 3.045 N/A ARG 3.A NH1 CYS 42.A O no hydrogen 3.362 N/A ARG 3.A NH2 HIS 102.A O no hydrogen 2.686 N/A LYS 7.A NZ GLY 332.A O no hydrogen 2.822 N/A LYS 7.A NZ LYS 333.A O no hydrogen 3.344 N/A CYS 10.A N ILE 336.A O no hydrogen 3.134 N/A CYS 10.A SG ILE 336.A O no hydrogen 3.272 N/A THR 13.A N THR 367.A O no hydrogen 3.191 N/A ALA 16.A N CYS 365.A O no hydrogen 2.633 N/A SER 19.A N VAL 363.A O no hydrogen 3.089 N/A LYS 20.A NZ PRO 377.A O no hydrogen 2.672 N/A ARG 25.A NH1 GLY 379.A O no hydrogen 2.738 N/A LEU 26.A N ASN 22.A O no hydrogen 3.105 N/A SER 27.A OG SER 23.A O no hydrogen 3.515 N/A SER 27.A OG ILE 24.A O no hydrogen 2.602 N/A TRP 33.A NE1 HIS 86.A O no hydrogen 2.683 N/A VAL 34.A N THR 56.A O no hydrogen 3.343 N/A THR 35.A OG1 ASN 359.A OD1 no hydrogen 2.454 N/A ARG 36.A N LEU 52.A O no hydrogen 3.058 N/A TYR 39.A N PHE 50.A O no hydrogen 3.230 N/A TYR 39.A OH SER 100.A OG no hydrogen 3.143 N/A SER 41.A OG GLU 147.A OE1 no hydrogen 2.946 N/A ASP 45.A N ASP 43.A OD1 no hydrogen 2.839 N/A LYS 46.A N ASP 43.A OD1 no hydrogen 2.441 N/A TYR 48.A N SER 41.A O no hydrogen 2.868 N/A GLN 49.A N ASN 79.A O no hydrogen 3.097 N/A PHE 50.A N TYR 39.A O no hydrogen 2.772 N/A LEU 52.A N ARG 36.A O no hydrogen 3.219 N/A GLY 53.A N THR 75.A O no hydrogen 2.894 N/A THR 56.A OG1 THR 57.A O no hydrogen 3.053 N/A THR 57.A OG1 ASN 59.A O no hydrogen 3.463 N/A LEU 58.A N ILE 32.A O no hydrogen 3.032 N/A HIS 62.A ND1 ASN 60.A OD1 no hydrogen 3.328 N/A SER 63.A OG ASN 60.A O no hydrogen 3.052 N/A HIS 68.A ND1 ASN 65.A O no hydrogen 2.917 N/A LEU 76.A N CYS 93.A O no hydrogen 3.192 N/A LEU 77.A N ALA 51.A O no hydrogen 3.017 N/A ASN 79.A N GLN 49.A O no hydrogen 3.492 N/A ASN 79.A ND2 THR 89.A OG1 no hydrogen 2.576 N/A LEU 81.A N CYS 47.A O no hydrogen 3.305 N/A VAL 83.A N GLU 80.A O no hydrogen 3.276 N/A GLY 88.A N HIS 86.A ND1 no hydrogen 3.058 N/A THR 89.A OG1 HIS 86.A O no hydrogen 3.332 N/A VAL 92.A N LEU 76.A O no hydrogen 3.077 N/A ALA 95.A N ARG 74.A O no hydrogen 3.317 N/A TRP 96.A N ILE 112.A O no hydrogen 3.064 N/A SER 98.A N GLU 145.A OE2 no hydrogen 2.646 N/A SER 99.A N VAL 110.A O no hydrogen 3.106 N/A SER 99.A OG SER 146.A O no hydrogen 2.509 N/A SER 100.A OG TYR 39.A OH no hydrogen 3.143 N/A SER 100.A OG HIS 109.A ND1 no hydrogen 2.705 N/A CYS 101.A N LEU 108.A O no hydrogen 3.370 N/A ASP 103.A N ALA 106.A O no hydrogen 3.303 N/A LYS 105.A N ASP 103.A OD1 no hydrogen 2.692 N/A LYS 105.A NZ TYR 2.A OH no hydrogen 3.219 N/A ALA 106.A N ASP 103.A OD1 no hydrogen 2.791 N/A LEU 108.A N CYS 101.A O no hydrogen 3.133 N/A HIS 109.A N ILE 124.A O no hydrogen 3.061 N/A HIS 109.A ND1 SER 100.A OG no hydrogen 2.705 N/A VAL 110.A N SER 99.A O no hydrogen 3.020 N/A CYS 111.A N SER 122.A O no hydrogen 3.285 N/A ILE 112.A N SER 97.A O no hydrogen 3.114 N/A THR 113.A N THR 120.A O no hydrogen 3.088 N/A GLY 114.A N THR 113.A OG1 no hydrogen 2.568 N/A THR 120.A N THR 113.A O no hydrogen 3.075 N/A ALA 121.A N ILE 133.A O no hydrogen 3.104 N/A SER 122.A N CYS 111.A O no hydrogen 2.747 N/A ILE 124.A N HIS 109.A O no hydrogen 3.227 N/A TYR 125.A N ARG 128.A O no hydrogen 3.032 N/A TYR 125.A OH ASP 103.A OD2 no hydrogen 2.735 N/A ASN 126.A N TRP 107.A O no hydrogen 3.460 N/A ARG 128.A N TYR 125.A O no hydrogen 3.140 N/A VAL 130.A N PHE 123.A O no hydrogen 3.046 N/A SER 132.A N ASP 131.A OD1 no hydrogen 2.649 N/A ILE 133.A N ALA 121.A O no hydrogen 3.354 N/A SER 135.A OG ASP 161.A OD2 no hydrogen 2.285 N/A TRP 136.A N ASP 161.A OD2 no hydrogen 3.205 N/A SER 137.A N ASP 161.A OD2 no hydrogen 2.949 N/A SER 137.A OG ASP 169.A OD2 no hydrogen 2.730 N/A LYS 138.A N SER 135.A OG no hydrogen 3.029 N/A LYS 138.A N ASP 161.A OD2 no hydrogen 3.130 N/A ASN 139.A N ASP 161.A OD1 no hydrogen 3.071 N/A ARG 142.A N THR 160.A O no hydrogen 3.451 N/A ARG 142.A NE GLU 194.A OE1 no hydrogen 2.625 N/A ARG 142.A NH1 ILE 140.A O no hydrogen 2.530 N/A ARG 142.A NH2 GLU 194.A OE2 no hydrogen 2.623 N/A THR 143.A OG1 VAL 158.A O no hydrogen 3.497 N/A GLN 144.A N THR 143.A OG1 no hydrogen 2.660 N/A SER 146.A OG GLN 144.A OE1 no hydrogen 3.481 N/A SER 146.A OG CYS 196.A O no hydrogen 3.134 N/A CYS 148.A N SER 100.A O no hydrogen 3.470 N/A CYS 150.A SG HIS 102.A O no hydrogen 3.991 N/A ILE 151.A N THR 154.A O no hydrogen 2.811 N/A THR 154.A OG1 GLU 176.A OE2 no hydrogen 2.651 N/A CYS 155.A N VAL 175.A O no hydrogen 2.858 N/A CYS 155.A SG GLY 153.A O no hydrogen 3.419 N/A THR 156.A N VAL 149.A O no hydrogen 3.025 N/A VAL 157.A N LEU 173.A O no hydrogen 3.221 N/A MET 159.A N LYS 171.A O no hydrogen 3.188 N/A THR 160.A N ARG 142.A O no hydrogen 3.226 N/A ASP 161.A N ASP 169.A O no hydrogen 3.056 N/A SER 165.A N SER 163.A OG no hydrogen 3.422 N/A SER 165.A OG ALA 164.A O no hydrogen 2.992 N/A LYS 171.A N MET 159.A O no hydrogen 3.208 N/A ILE 172.A N SER 184.A O no hydrogen 2.880 N/A LEU 173.A N VAL 157.A O no hydrogen 2.969 N/A PHE 174.A N HIS 182.A O no hydrogen 3.256 N/A VAL 175.A N CYS 155.A O no hydrogen 3.049 N/A GLU 176.A N LYS 179.A O no hydrogen 3.080 N/A LYS 179.A N GLU 176.A O no hydrogen 3.313 N/A VAL 181.A N PHE 174.A O no hydrogen 3.193 N/A SER 184.A N ILE 172.A O no hydrogen 3.316 N/A GLY 188.A N SER 187.A OG no hydrogen 2.561 N/A SER 189.A N SER 232.A OG no hydrogen 3.140 N/A SER 189.A OG SER 232.A O no hydrogen 3.241 N/A ALA 190.A N SER 232.A OG no hydrogen 3.067 N/A GLN 191.A N TYR 234.A OH no hydrogen 3.271 N/A GLN 191.A NE2 SER 189.A O no hydrogen 3.246 N/A GLU 194.A N ARG 210.A O no hydrogen 3.296 N/A SER 197.A OG GLY 269.A O no hydrogen 3.247 N/A TYR 199.A N ARG 206.A O no hydrogen 3.182 N/A TYR 199.A OH ASP 273.A OD1 no hydrogen 3.321 N/A ARG 201.A N GLY 204.A O no hydrogen 2.917 N/A GLY 204.A N ARG 201.A O no hydrogen 2.666 N/A VAL 205.A N ILE 223.A O no hydrogen 3.276 N/A ARG 206.A N TYR 199.A O no hydrogen 3.485 N/A ARG 206.A NE ASP 222.A OD1 no hydrogen 3.134 N/A CYS 207.A N VAL 221.A O no hydrogen 2.881 N/A VAL 208.A N SER 197.A O no hydrogen 3.272 N/A CYS 209.A N PRO 219.A O no hydrogen 3.267 N/A CYS 209.A SG CYS 207.A O no hydrogen 3.952 N/A ARG 210.A N GLU 194.A O no hydrogen 2.929 N/A TRP 213.A N ASP 211.A OD1 no hydrogen 3.297 N/A SER 216.A N ASN 259.A OD1 no hydrogen 2.933 N/A ASN 217.A ND2 SER 253.A OG no hydrogen 2.540 N/A ARG 218.A NE GLY 241.A O no hydrogen 3.058 N/A ARG 218.A NH2 GLY 241.A O no hydrogen 2.728 N/A ARG 218.A NH2 VAL 267.A O no hydrogen 3.452 N/A ILE 220.A N SER 233.A O no hydrogen 2.729 N/A VAL 221.A N CYS 207.A O no hydrogen 2.877 N/A ASP 222.A N VAL 231.A O no hydrogen 3.097 N/A ILE 223.A N VAL 205.A O no hydrogen 2.992 N/A ASN 224.A N SER 229.A O no hydrogen 3.303 N/A TYR 228.A N ASN 224.A O no hydrogen 3.117 N/A VAL 231.A N ASP 222.A O no hydrogen 3.475 N/A SER 232.A OG SER 187.A O no hydrogen 3.229 N/A SER 233.A N ILE 220.A O no hydrogen 3.197 N/A VAL 235.A N ARG 218.A O no hydrogen 2.974 N/A CYS 236.A SG TYR 234.A O no hydrogen 3.706 N/A ARG 245.A NH1 ASP 242.A O no hydrogen 3.260 N/A ARG 245.A NH1 THR 283.A O no hydrogen 3.428 N/A ARG 245.A NH2 THR 283.A O no hydrogen 2.706 N/A VAL 250.A N SER 247.A O no hydrogen 3.328 N/A SER 251.A N SER 247.A O no hydrogen 3.073 N/A SER 251.A OG GLY 238.A O no hydrogen 3.443 N/A SER 251.A OG SER 247.A O no hydrogen 3.453 N/A SER 251.A OG ASP 248.A O no hydrogen 3.151 N/A SER 253.A N ASN 305.A OD1 no hydrogen 2.426 N/A SER 253.A OG VAL 235.A O no hydrogen 3.340 N/A CYS 255.A SG LYS 303.A O no hydrogen 3.858 N/A ASN 259.A ND2 SER 216.A OG no hydrogen 2.692 N/A ASN 259.A ND2 SER 252.A O no hydrogen 3.359 N/A VAL 267.A N ASP 242.A OD1 no hydrogen 3.101 N/A LYS 268.A NZ GLN 144.A O no hydrogen 2.838 N/A PHE 272.A N TRP 279.A O no hydrogen 3.023 N/A ASP 273.A N ASP 273.A OD1 no hydrogen 2.523 N/A TRP 279.A N PHE 272.A O no hydrogen 3.021 N/A ARG 282.A N GLU 293.A O no hydrogen 3.253 N/A ARG 282.A NE GLU 293.A OE2 no hydrogen 3.485 N/A ARG 282.A NH1 VAL 240.A O no hydrogen 3.372 N/A ARG 282.A NH2 ASP 248.A OD1 no hydrogen 3.525 N/A THR 283.A OG1 ASN 285.A O no hydrogen 3.028 N/A ASN 285.A N LEU 290.A O no hydrogen 3.238 N/A ARG 289.A NH2 GLY 266.A O no hydrogen 3.122 N/A GLU 293.A N ARG 282.A O no hydrogen 2.966 N/A THR 294.A N GLN 313.A O no hydrogen 3.133 N/A LYS 296.A N THR 310.A O no hydrogen 2.932 N/A VAL 297.A N VAL 278.A O no hydrogen 3.218 N/A ILE 298.A N LEU 308.A O no hydrogen 2.921 N/A GLU 299.A N ASP 277.A OD1 no hydrogen 2.683 N/A GLY 300.A N VAL 297.A O no hydrogen 3.288 N/A TRP 301.A N ASN 276.A O no hydrogen 3.312 N/A SER 302.A OG ASN 276.A OD1 no hydrogen 2.627 N/A SER 306.A N ALA 304.A O no hydrogen 2.616 N/A SER 306.A OG ILE 298.A O no hydrogen 2.929 N/A LYS 307.A NZ ASP 248.A O no hydrogen 2.644 N/A THR 310.A N LYS 296.A O no hydrogen 3.013 N/A ASN 311.A ND2 TYR 371.A OH no hydrogen 3.554 N/A ARG 312.A NE GLU 293.A OE1 no hydrogen 3.003 N/A ARG 312.A NH2 GLU 293.A OE1 no hydrogen 2.922 N/A GLN 313.A N THR 294.A O no hydrogen 3.237 N/A GLN 313.A NE2 PHE 15.A O no hydrogen 3.123 N/A ILE 315.A N TYR 292.A O no hydrogen 3.145 N/A VAL 316.A N TYR 292.A O no hydrogen 3.383 N/A ASP 320.A N GLU 317.A O no hydrogen 3.333 N/A ARG 321.A NH1 GLU 351.A OE2 no hydrogen 3.345 N/A SER 322.A N ARG 289.A O no hydrogen 3.508 N/A SER 322.A OG GLY 291.A O no hydrogen 2.887 N/A SER 325.A N LYS 268.A O no hydrogen 3.196 N/A SER 325.A OG LYS 268.A O no hydrogen 3.146 N/A GLY 326.A N TYR 341.A O no hydrogen 3.377 N/A PHE 328.A N CYS 339.A O no hydrogen 3.324 N/A VAL 330.A N ASN 337.A O no hydrogen 3.489 N/A GLY 332.A N CYS 335.A O no hydrogen 3.297 N/A ILE 336.A N PRO 8.A O no hydrogen 2.757 N/A ASN 337.A N VAL 330.A O no hydrogen 3.301 N/A ASN 337.A ND2 GLY 366.A O no hydrogen 3.665 N/A ARG 338.A N ASN 337.A OD1 no hydrogen 2.629 N/A ARG 338.A NH1 SER 329.A OG no hydrogen 2.590 N/A ARG 338.A NH2 PRO 200.A O no hydrogen 2.854 N/A CYS 339.A N PHE 328.A O no hydrogen 3.198 N/A PHE 340.A N PHE 364.A O no hydrogen 3.108 N/A TYR 341.A OH PRO 38.A O no hydrogen 3.200 N/A VAL 342.A N VAL 362.A O no hydrogen 2.946 N/A GLU 343.A N TYR 324.A O no hydrogen 2.927 N/A LEU 344.A N SER 360.A O no hydrogen 2.874 N/A ARG 346.A N SER 358.A O no hydrogen 3.153 N/A ARG 346.A NH1 ALA 380.A O no hydrogen 3.455 N/A ARG 346.A NH2 ALA 380.A O no hydrogen 3.261 N/A ARG 348.A N TRP 356.A O no hydrogen 3.184 N/A ARG 348.A N THR 357.A OG1 no hydrogen 3.055 N/A ARG 348.A NH1 VAL 354.A O no hydrogen 2.642 N/A GLU 351.A N GLU 351.A OE1 no hydrogen 2.783 N/A LYS 353.A NZ ASN 383.A OD1 no hydrogen 3.365 N/A THR 357.A OG1 TRP 356.A O no hydrogen 2.856 N/A SER 358.A N ARG 346.A O no hydrogen 3.159 N/A ASN 359.A N SER 358.A OG no hydrogen 2.598 N/A ASN 359.A ND2 GLU 343.A OE2 no hydrogen 2.848 N/A SER 360.A N LEU 344.A O no hydrogen 3.186 N/A SER 360.A OG ASP 378.A OD1 no hydrogen 2.611 N/A ILE 361.A N ASP 21.A OD1 no hydrogen 3.227 N/A ILE 361.A N ASP 21.A OD2 no hydrogen 2.921 N/A VAL 362.A N VAL 342.A O no hydrogen 3.230 N/A VAL 363.A N SER 19.A O no hydrogen 3.318 N/A PHE 364.A N PHE 340.A O no hydrogen 3.055 N/A CYS 365.A N ALA 16.A O no hydrogen 3.004 N/A GLY 366.A N ARG 338.A O no hydrogen 3.319 N/A GLY 369.A N THR 367.A OG1 no hydrogen 3.419 N/A TRP 376.A N ILE 315.A O no hydrogen 3.382 N/A ASN 383.A ND2 ASP 381.A OD2 no hydrogen 3.010 N/A