Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ic3_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 257.A OE2 no hydrogen 2.683 N/A ASP 6.A N LYS 3.A O no hydrogen 2.627 N/A ARG 7.A NE GLU 256.A OE1 no hydrogen 2.647 N/A ARG 7.A NH2 LEU 2.A O no hydrogen 3.223 N/A ARG 15.A NE GLY 14.A O no hydrogen 2.720 N/A ARG 19.A N ASP 17.A OD1 no hydrogen 2.744 N/A ARG 19.A NE ASP 17.A OD1 no hydrogen 2.692 N/A ARG 19.A NE ASP 17.A OD2 no hydrogen 3.154 N/A GLY 22.A N ASP 17.A OD2 no hydrogen 3.012 N/A ALA 23.A N ARG 19.A O no hydrogen 2.797 N/A LEU 24.A N LEU 20.A O no hydrogen 2.620 N/A ARG 25.A N LYS 21.A O no hydrogen 2.946 N/A ARG 26.A N GLY 22.A O no hydrogen 2.833 N/A ARG 26.A NH1 ASP 17.A O no hydrogen 2.576 N/A ARG 26.A NH2 ASP 17.A O no hydrogen 2.572 N/A GLY 27.A N ALA 23.A O no hydrogen 2.855 N/A ASP 28.A N ALA 23.A O no hydrogen 2.985 N/A TRP 29.A N GLU 107.A OE1 no hydrogen 2.726 N/A LYS 31.A NZ TYR 30.A OH no hydrogen 2.665 N/A LYS 33.A NZ LYS 33.A O no hydrogen 2.955 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.528 N/A ILE 35.A N LYS 31.A O no hydrogen 3.032 N/A LEU 36.A N THR 32.A O no hydrogen 2.989 N/A LEU 37.A N LYS 33.A O no hydrogen 2.717 N/A LYS 38.A N GLU 34.A O no hydrogen 2.749 N/A LYS 38.A N ILE 35.A O no hydrogen 2.904 N/A GLY 39.A N LEU 36.A O no hydrogen 2.850 N/A TRP 42.A N ASP 41.A OD1 no hydrogen 2.562 N/A ILE 43.A N GLY 39.A O no hydrogen 3.329 N/A LEU 44.A N PRO 40.A O no hydrogen 3.183 N/A GLY 45.A N ASP 41.A O no hydrogen 3.048 N/A GLU 46.A N TRP 42.A O no hydrogen 2.983 N/A MET 47.A N ILE 43.A O no hydrogen 2.858 N/A LYS 48.A N LEU 44.A O no hydrogen 2.687 N/A THR 49.A N GLY 45.A O no hydrogen 2.732 N/A THR 49.A OG1 GLY 45.A O no hydrogen 2.909 N/A THR 49.A OG1 GLU 46.A O no hydrogen 2.752 N/A SER 50.A N GLU 46.A O no hydrogen 2.732 N/A GLY 51.A N MET 47.A O no hydrogen 3.052 N/A GLY 51.A N LYS 48.A O no hydrogen 2.979 N/A ARG 53.A NE GLY 59.A O no hydrogen 3.098 N/A ARG 53.A NH2 GLY 59.A O no hydrogen 2.970 N/A GLY 54.A N PHE 60.A O no hydrogen 3.148 N/A ARG 55.A N THR 214.A OG1 no hydrogen 3.033 N/A ARG 55.A NH2 SER 238.A O no hydrogen 3.332 N/A THR 62.A N LEU 52.A O no hydrogen 3.095 N/A THR 62.A OG1 LEU 52.A O no hydrogen 2.872 N/A LYS 65.A N PRO 61.A O no hydrogen 3.045 N/A LYS 65.A NZ VAL 209.A O no hydrogen 2.657 N/A TRP 66.A N THR 62.A O no hydrogen 2.890 N/A SER 67.A N GLY 63.A O no hydrogen 2.757 N/A PHE 68.A N LEU 64.A O no hydrogen 3.030 N/A ASN 70.A N SER 67.A O no hydrogen 2.733 N/A LYS 71.A N PHE 68.A O no hydrogen 3.356 N/A SER 73.A OG ARG 76.A O no hydrogen 3.148 N/A GLY 75.A N SER 73.A OG no hydrogen 3.307 N/A ARG 76.A NH2 ASP 199.A O no hydrogen 2.361 N/A TYR 79.A N PRO 206.A O no hydrogen 2.707 N/A LEU 80.A N ALA 120.A O no hydrogen 3.048 N/A VAL 81.A N THR 208.A O no hydrogen 2.847 N/A VAL 82.A N TYR 122.A O no hydrogen 2.949 N/A ASN 83.A N ALA 210.A O no hydrogen 3.036 N/A ALA 84.A N TYR 124.A O no hydrogen 2.827 N/A THR 91.A N GLU 88.A O no hydrogen 3.268 N/A THR 91.A OG1 GLU 88.A O no hydrogen 3.470 N/A THR 91.A OG1 THR 318.A OG1 no hydrogen 2.635 N/A CYS 92.A SG GLU 96.A OE1 no hydrogen 2.970 N/A LYS 93.A NZ ARG 55.A O no hydrogen 3.559 N/A LYS 93.A NZ ASP 94.A OD1 no hydrogen 2.649 N/A LYS 93.A NZ ASN 211.A OD1 no hydrogen 2.893 N/A LYS 93.A NZ GLU 213.A OE2 no hydrogen 3.016 N/A GLU 96.A N LYS 93.A O no hydrogen 3.303 N/A MET 98.A N ASP 94.A O no hydrogen 3.491 N/A ARG 99.A N ARG 95.A O no hydrogen 3.084 N/A ARG 99.A NH1 GLU 96.A OE2 no hydrogen 2.570 N/A HIS 100.A N GLU 96.A O no hydrogen 2.849 N/A ASP 101.A N ILE 97.A O no hydrogen 2.752 N/A LYS 104.A N ASP 101.A O no hydrogen 3.320 N/A LYS 104.A NZ ILE 8.A O no hydrogen 2.470 N/A LYS 104.A NZ ASP 101.A OD2 no hydrogen 3.186 N/A VAL 106.A N PRO 102.A O no hydrogen 3.037 N/A GLU 107.A N HIS 103.A O no hydrogen 2.965 N/A GLY 108.A N LYS 104.A O no hydrogen 2.894 N/A CYS 109.A N LEU 105.A O no hydrogen 2.825 N/A CYS 109.A SG LEU 105.A O no hydrogen 3.105 N/A LEU 110.A N VAL 106.A O no hydrogen 3.075 N/A VAL 111.A N GLU 107.A O no hydrogen 2.777 N/A GLY 112.A N GLY 108.A O no hydrogen 2.503 N/A GLY 113.A N CYS 109.A O no hydrogen 2.808 N/A ARG 114.A N LEU 110.A O no hydrogen 3.067 N/A ALA 115.A N VAL 111.A O no hydrogen 3.127 N/A MET 116.A N GLY 113.A O no hydrogen 2.678 N/A ALA 118.A N GLY 113.A O no hydrogen 3.344 N/A ARG 119.A N LYS 78.A O no hydrogen 3.382 N/A TYR 122.A N LEU 80.A O no hydrogen 2.879 N/A ILE 123.A N PHE 163.A O no hydrogen 2.752 N/A TYR 124.A N VAL 82.A O no hydrogen 3.066 N/A TYR 124.A OH SER 182.A OG no hydrogen 2.778 N/A ARG 126.A N ALA 84.A O no hydrogen 3.328 N/A ARG 126.A NE ASP 85.A OD1 no hydrogen 2.650 N/A ARG 126.A NH1 GLU 86.A O no hydrogen 2.561 N/A PHE 129.A N ARG 126.A O no hydrogen 2.962 N/A TYR 130.A N GLU 128.A O no hydrogen 2.888 N/A SER 134.A N TYR 130.A O no hydrogen 3.451 N/A LEU 136.A N GLU 132.A O no hydrogen 3.286 N/A GLN 137.A N ALA 133.A O no hydrogen 2.611 N/A VAL 138.A N SER 134.A O no hydrogen 2.772 N/A ALA 139.A N ASN 135.A O no hydrogen 2.984 N/A ILE 140.A N LEU 136.A O no hydrogen 2.977 N/A ARG 141.A N GLN 137.A O no hydrogen 2.946 N/A GLU 142.A N VAL 138.A O no hydrogen 3.024 N/A ALA 143.A N ALA 139.A O no hydrogen 2.944 N/A TYR 144.A N ILE 140.A O no hydrogen 3.007 N/A TYR 144.A OH VAL 162.A O no hydrogen 3.001 N/A GLU 145.A N ARG 141.A O no hydrogen 3.007 N/A ALA 146.A N GLU 142.A O no hydrogen 2.795 N/A GLY 147.A N TYR 144.A O no hydrogen 2.901 N/A ILE 149.A N ALA 143.A O no hydrogen 3.325 N/A GLY 150.A N PHE 160.A O no hydrogen 2.957 N/A ASN 152.A N ASP 159.A OD1 no hydrogen 2.602 N/A ALA 153.A N TYR 158.A O no hydrogen 2.863 N/A CYS 154.A N GLY 147.A O no hydrogen 3.023 N/A GLY 155.A N ASN 152.A O no hydrogen 2.734 N/A SER 156.A OG ALA 153.A O no hydrogen 2.486 N/A TYR 158.A OH ALA 118.A O no hydrogen 2.930 N/A PHE 160.A N GLY 150.A O no hydrogen 3.385 N/A ASP 161.A N ARG 119.A O no hydrogen 3.088 N/A PHE 163.A N ALA 121.A O no hydrogen 2.624 N/A VAL 165.A N ILE 123.A O no hydrogen 2.657 N/A GLY 167.A N ILE 125.A O no hydrogen 3.067 N/A TYR 171.A OH GLU 88.A OE2 no hydrogen 2.460 N/A TYR 171.A OH SER 290.A OG no hydrogen 3.079 N/A CYS 173.A SG TYR 124.A OH no hydrogen 3.354 N/A GLY 174.A N TYR 171.A O no hydrogen 2.994 N/A GLU 175.A N ILE 172.A O no hydrogen 2.702 N/A THR 177.A N GLU 175.A OE1 no hydrogen 2.518 N/A THR 177.A OG1 GLU 175.A OE1 no hydrogen 2.504 N/A THR 177.A OG1 GLU 175.A OE2 no hydrogen 3.477 N/A THR 177.A OG1 ARG 191.A O no hydrogen 3.062 N/A ALA 178.A N GLU 175.A O no hydrogen 2.988 N/A ALA 178.A N GLU 175.A OE1 no hydrogen 3.007 N/A LEU 179.A N GLU 175.A O no hydrogen 2.686 N/A SER 182.A N ALA 178.A O no hydrogen 3.053 N/A SER 182.A OG TYR 124.A OH no hydrogen 2.778 N/A ILE 183.A N LEU 179.A O no hydrogen 2.840 N/A GLU 184.A N ILE 180.A O no hydrogen 2.569 N/A GLY 185.A N SER 182.A O no hydrogen 2.907 N/A LYS 186.A N GLU 181.A O no hydrogen 3.107 N/A LYS 189.A N GLN 187.A O no hydrogen 2.856 N/A LYS 193.A NZ GLU 175.A OE2 no hydrogen 2.656 N/A LYS 193.A NZ THR 177.A OG1 no hydrogen 3.311 N/A VAL 200.A N PHE 196.A O no hydrogen 2.955 N/A PHE 203.A N GLU 184.A OE2 no hydrogen 3.198 N/A GLY 204.A N GLY 201.A O no hydrogen 2.626 N/A CYS 205.A N VAL 202.A O no hydrogen 2.940 N/A CYS 205.A SG PHE 203.A O no hydrogen 3.161 N/A THR 207.A N PRO 197.A O no hydrogen 3.239 N/A THR 207.A OG1 CYS 205.A O no hydrogen 2.534 N/A ALA 210.A N VAL 81.A O no hydrogen 3.200 N/A ASN 211.A ND2 ASP 94.A OD2 no hydrogen 2.908 N/A THR 214.A OG1 ASN 211.A O no hydrogen 3.333 N/A VAL 215.A N ASN 211.A O no hydrogen 3.152 N/A ALA 216.A N VAL 212.A O no hydrogen 2.801 N/A VAL 217.A N GLU 213.A O no hydrogen 3.072 N/A SER 218.A N VAL 215.A O no hydrogen 3.306 N/A THR 220.A OG1 VAL 217.A O no hydrogen 2.739 N/A ILE 221.A N VAL 217.A O no hydrogen 2.895 N/A CYS 222.A N SER 218.A O no hydrogen 2.793 N/A CYS 222.A SG SER 218.A O no hydrogen 3.081 N/A CYS 222.A SG SER 218.A OG no hydrogen 3.728 N/A ARG 223.A N PRO 219.A O no hydrogen 2.820 N/A ARG 223.A NH2 TYR 30.A O no hydrogen 3.417 N/A ARG 224.A N THR 220.A O no hydrogen 2.682 N/A ARG 224.A NH1 GLU 5.A O no hydrogen 2.742 N/A ARG 224.A NH2 GLU 5.A O no hydrogen 2.909 N/A ALA 230.A N GLY 226.A O no hydrogen 2.825 N/A GLY 231.A N THR 227.A O no hydrogen 2.786 N/A GLY 233.A N ALA 230.A O no hydrogen 3.467 N/A ARG 234.A N ASN 237.A O no hydrogen 3.032 N/A ARG 234.A N ASN 237.A OD1 no hydrogen 3.280 N/A ARG 234.A NH1 ASP 307.A OD2 no hydrogen 3.441 N/A ARG 234.A NH2 ASP 307.A OD2 no hydrogen 3.411 N/A SER 238.A OG GLY 51.A O no hydrogen 2.796 N/A SER 238.A OG GLU 235.A O no hydrogen 3.412 N/A SER 238.A OG ARG 236.A O no hydrogen 3.004 N/A LYS 241.A NZ LEU 242.A O no hydrogen 3.394 N/A LYS 241.A NZ THR 318.A O no hydrogen 2.939 N/A ASN 244.A N ALA 319.A O no hydrogen 3.411 N/A ILE 245.A N CYS 253.A O no hydrogen 3.279 N/A SER 246.A N VAL 321.A O no hydrogen 2.838 N/A ASN 250.A N GLY 273.A O no hydrogen 2.751 N/A CYS 253.A SG HIS 251.A O no hydrogen 3.653 N/A VAL 255.A N PHE 243.A O no hydrogen 3.070 N/A MET 259.A N GLY 239.A O no hydrogen 3.155 N/A SER 260.A N MET 304.A O no hydrogen 3.029 N/A LEU 266.A N PRO 262.A O no hydrogen 2.807 N/A ILE 267.A N LEU 263.A O no hydrogen 3.056 N/A GLU 268.A N GLU 265.A O no hydrogen 2.830 N/A LYS 269.A N GLU 265.A O no hydrogen 2.582 N/A HIS 270.A N LEU 266.A O no hydrogen 3.181 N/A THR 275.A N HIS 248.A O no hydrogen 3.118 N/A GLY 277.A N VAL 274.A O no hydrogen 2.843 N/A ASN 280.A N GLY 277.A O no hydrogen 2.662 N/A LEU 282.A N MET 324.A O no hydrogen 2.645 N/A ALA 283.A N MET 324.A O no hydrogen 3.317 N/A VAL 284.A N ILE 294.A O no hydrogen 2.643 N/A ILE 285.A N ILE 322.A O no hydrogen 2.646 N/A GLY 287.A N THR 291.A OG1 no hydrogen 3.014 N/A SER 289.A OG GLU 88.A OE1 no hydrogen 3.308 N/A SER 289.A OG TYR 341.A OH no hydrogen 2.715 N/A SER 290.A N GLU 88.A OE1 no hydrogen 2.943 N/A SER 290.A OG GLU 88.A OE1 no hydrogen 3.564 N/A SER 290.A OG GLU 88.A OE2 no hydrogen 3.291 N/A SER 290.A OG TYR 171.A OH no hydrogen 3.079 N/A SER 290.A OG TYR 341.A OH no hydrogen 3.172 N/A THR 291.A OG1 GLY 288.A O no hydrogen 3.206 N/A ILE 294.A N VAL 284.A O no hydrogen 2.785 N/A CYS 299.A N PRO 295.A O no hydrogen 3.397 N/A CYS 299.A SG ILE 294.A O no hydrogen 3.442 N/A CYS 299.A SG PRO 295.A O no hydrogen 2.895 N/A GLU 300.A N GLU 300.A OE1 no hydrogen 2.503 N/A THR 301.A OG1 VAL 298.A O no hydrogen 2.862 N/A VAL 302.A N VAL 298.A O no hydrogen 3.048 N/A MET 304.A N VAL 261.A O no hydrogen 3.210 N/A ALA 308.A N ASP 305.A OD1 no hydrogen 2.596 N/A LEU 309.A N ASP 305.A O no hydrogen 3.051 N/A VAL 310.A N PHE 306.A O no hydrogen 2.969 N/A GLN 311.A N ASP 307.A O no hydrogen 3.074 N/A ALA 312.A N ALA 308.A O no hydrogen 2.966 N/A GLN 313.A N VAL 310.A O no hydrogen 3.077 N/A THR 314.A N LEU 309.A O no hydrogen 2.862 N/A THR 314.A OG1 PRO 292.A O no hydrogen 2.690 N/A THR 318.A N GLY 287.A O no hydrogen 3.205 N/A THR 318.A OG1 THR 91.A OG1 no hydrogen 2.635 N/A THR 318.A OG1 GLY 287.A O no hydrogen 3.108 N/A ALA 319.A N LEU 316.A O no hydrogen 2.679 N/A VAL 321.A N ASN 244.A O no hydrogen 2.693 N/A ILE 322.A N ILE 285.A O no hydrogen 2.894 N/A MET 324.A N ALA 283.A O no hydrogen 3.029 N/A ARG 326.A NE ASP 279.A O no hydrogen 3.651 N/A THR 328.A OG1 ASP 325.A O no hydrogen 3.046 N/A LYS 332.A N ASP 329.A OD1 no hydrogen 3.316 N/A ALA 333.A N ASP 329.A O no hydrogen 2.766 N/A ILE 334.A N ILE 330.A O no hydrogen 2.816 N/A ALA 335.A N VAL 331.A O no hydrogen 3.278 N/A ARG 336.A N LYS 332.A O no hydrogen 3.024 N/A ARG 336.A N ALA 333.A O no hydrogen 3.182 N/A ARG 336.A NH2 ARG 336.A O no hydrogen 2.873 N/A LEU 337.A N ILE 334.A O no hydrogen 3.025 N/A ILE 338.A N ILE 334.A O no hydrogen 3.047 N/A GLU 339.A N ALA 335.A O no hydrogen 2.933 N/A PHE 340.A N ARG 336.A O no hydrogen 2.472 N/A TYR 341.A N LEU 337.A O no hydrogen 2.972 N/A TYR 341.A N ILE 338.A O no hydrogen 3.124 N/A TYR 341.A OH SER 289.A OG no hydrogen 2.715 N/A LYS 342.A N ILE 338.A O no hydrogen 2.935 N/A HIS 343.A N GLU 339.A O no hydrogen 3.333 N/A GLU 344.A N TYR 341.A O no hydrogen 3.311 N/A SER 345.A N TYR 341.A O no hydrogen 2.921 N/A SER 345.A OG TYR 341.A O no hydrogen 3.405 N/A ARG 353.A N CYS 349.A O no hydrogen 3.179 N/A ARG 353.A NE GLY 347.A O no hydrogen 2.769 N/A ARG 353.A NH1 GLU 354.A OE2 no hydrogen 2.771 N/A ARG 353.A NH2 GLY 347.A O no hydrogen 3.187 N/A ARG 353.A NH2 GLN 348.A O no hydrogen 3.409 N/A ARG 353.A NH2 THR 350.A OG1 no hydrogen 3.332 N/A GLU 354.A N THR 350.A O no hydrogen 3.321 N/A GLY 355.A N PRO 351.A O no hydrogen 3.089 N/A VAL 356.A N CYS 352.A O no hydrogen 2.839 N/A TRP 358.A N GLU 354.A O no hydrogen 2.704 N/A MET 359.A N GLY 355.A O no hydrogen 2.905 N/A ASN 360.A N VAL 356.A O no hydrogen 2.973 N/A ASN 360.A ND2 GLU 339.A OE1 no hydrogen 2.812 N/A LYS 361.A N ASP 357.A O no hydrogen 2.965 N/A VAL 362.A N TRP 358.A O no hydrogen 3.055 N/A MET 363.A N MET 359.A O no hydrogen 2.641 N/A ALA 364.A N ASN 360.A O no hydrogen 2.939 N/A ARG 365.A N LYS 361.A O no hydrogen 3.199 N/A PHE 366.A N VAL 362.A O no hydrogen 2.835 N/A VAL 367.A N MET 363.A O no hydrogen 2.980 N/A LYS 368.A N ALA 364.A O no hydrogen 3.220 N/A LYS 368.A NZ ASP 370.A OD2 no hydrogen 3.553 N/A GLY 369.A N ARG 365.A O no hydrogen 2.711 N/A ASP 370.A N ARG 365.A O no hydrogen 3.106 N/A GLU 375.A N ARG 372.A O no hydrogen 3.305 N/A ILE 376.A N PRO 373.A O no hydrogen 3.192 N/A LEU 379.A N GLU 375.A O no hydrogen 2.951 N/A TRP 380.A N ILE 376.A O no hydrogen 3.304 N/A GLU 381.A N ASP 377.A O no hydrogen 2.903 N/A ILE 382.A N SER 378.A O no hydrogen 2.956 N/A SER 383.A N LEU 379.A O no hydrogen 2.841 N/A SER 383.A OG ALA 399.A O no hydrogen 3.062 N/A LYS 384.A N TRP 380.A O no hydrogen 3.312 N/A GLN 385.A N ILE 382.A O no hydrogen 3.214 N/A ILE 386.A N ILE 382.A O no hydrogen 3.220 N/A GLU 387.A N SER 383.A O no hydrogen 2.991 N/A GLY 388.A N LYS 384.A O no hydrogen 3.335 N/A HIS 389.A ND1 GLN 385.A O no hydrogen 2.561 N/A THR 390.A OG1 ILE 386.A O no hydrogen 3.166 N/A THR 390.A OG1 CYS 392.A O no hydrogen 3.242 N/A GLY 397.A N ALA 393.A O no hydrogen 2.631 N/A ALA 398.A N LEU 394.A O no hydrogen 2.689 N/A ALA 399.A N GLY 395.A O no hydrogen 3.228 N/A TRP 400.A N ASP 396.A O no hydrogen 3.422 N/A TRP 400.A NE1 GLU 387.A OE2 no hydrogen 3.136 N/A GLN 403.A N ALA 399.A O no hydrogen 2.893 N/A GLN 403.A NE2 GLU 387.A OE1 no hydrogen 2.944 N/A GLY 404.A N TRP 400.A O no hydrogen 2.860 N/A LEU 405.A N PRO 401.A O no hydrogen 2.987 N/A ILE 406.A N VAL 402.A O no hydrogen 3.160 N/A ARG 407.A N GLN 403.A O no hydrogen 2.818 N/A HIS 408.A N GLY 404.A O no hydrogen 3.035 N/A PHE 409.A N LEU 405.A O no hydrogen 2.854 N/A LEU 413.A N PHE 409.A O no hydrogen 3.361 N/A GLU 414.A N ARG 410.A O no hydrogen 3.171 N/A ASP 415.A N PRO 411.A O no hydrogen 3.104 N/A ARG 416.A N GLU 412.A O no hydrogen 3.093 N/A ARG 416.A NH1 ASP 329.A OD1 no hydrogen 3.002 N/A ARG 416.A NH1 VAL 367.A O no hydrogen 3.213 N/A ARG 416.A NH2 ASP 329.A OD1 no hydrogen 2.720 N/A MET 417.A N LEU 413.A O no hydrogen 2.788 N/A GLN 418.A N GLU 414.A O no hydrogen 2.625 N/A ARG 419.A N ASP 415.A O no hydrogen 2.499 N/A PHE 420.A N ARG 416.A O no hydrogen 3.336 N/A ALA 421.A N MET 417.A O no hydrogen 3.330 N/A GLN 422.A N GLN 418.A O no hydrogen 3.046 N/A GLN 422.A NE2 GLN 418.A OE1 no hydrogen 3.205 N/A GLN 423.A N ARG 419.A O no hydrogen 3.458 N/A HIS 424.A N PHE 420.A O no hydrogen 3.214 N/A