Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8u6r_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 2.A OE1 no hydrogen 2.851 N/A VAL 6.A N ASP 115.A OD2 no hydrogen 3.353 N/A MET 12.A N LYS 9.A O no hydrogen 3.107 N/A LYS 16.A NZ ASP 13.A OD2 no hydrogen 3.487 N/A VAL 17.A N ASN 53.A O no hydrogen 3.182 N/A GLN 19.A NE2 TRP 20.A O no hydrogen 2.701 N/A GLN 19.A NE2 VAL 56.A O no hydrogen 3.162 N/A LYS 26.A NZ GLU 384.A OE2 no hydrogen 2.902 N/A ILE 27.A N THR 23.A O no hydrogen 3.121 N/A LYS 28.A N GLU 24.A O no hydrogen 2.996 N/A ALA 29.A N GLU 25.A O no hydrogen 3.153 N/A LEU 30.A N LYS 26.A O no hydrogen 3.039 N/A VAL 31.A N ILE 27.A O no hydrogen 2.998 N/A GLU 32.A N LYS 28.A O no hydrogen 2.928 N/A ILE 33.A N ALA 29.A O no hydrogen 2.793 N/A CYS 34.A N LEU 30.A O no hydrogen 2.704 N/A THR 35.A N VAL 31.A O no hydrogen 3.053 N/A THR 35.A N GLU 32.A O no hydrogen 2.920 N/A THR 35.A OG1 VAL 31.A O no hydrogen 3.180 N/A GLU 36.A N GLU 32.A O no hydrogen 3.196 N/A MET 37.A N ILE 33.A O no hydrogen 3.097 N/A GLU 38.A N CYS 34.A O no hydrogen 3.028 N/A LYS 39.A N THR 35.A O no hydrogen 3.316 N/A GLU 40.A N GLU 36.A O no hydrogen 3.017 N/A GLY 41.A N GLU 38.A O no hydrogen 3.100 N/A LYS 42.A N MET 37.A O no hydrogen 2.971 N/A LYS 42.A NZ GLU 40.A OE1 no hydrogen 2.795 N/A ILE 43.A N MET 37.A O no hydrogen 3.451 N/A SER 44.A N GLN 139.A O no hydrogen 2.902 N/A ILE 46.A N ARG 137.A O no hydrogen 3.369 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.538 N/A ASN 50.A ND2 LYS 120.A O no hydrogen 3.560 N/A TYR 52.A N ASN 50.A OD1 no hydrogen 3.404 N/A TYR 52.A OH ASP 13.A OD1 no hydrogen 3.375 N/A ASN 53.A N PRO 15.A O no hydrogen 3.046 N/A ASN 53.A ND2 VAL 17.A O no hydrogen 2.915 N/A THR 54.A OG1 ALA 123.A O no hydrogen 3.120 N/A VAL 56.A N GLN 19.A OE1 no hydrogen 2.768 N/A PHE 57.A N LEU 68.A O no hydrogen 2.869 N/A ILE 59.A N ARG 66.A O no hydrogen 3.071 N/A ARG 66.A N ILE 59.A O no hydrogen 3.081 N/A LEU 68.A N PHE 57.A O no hydrogen 3.087 N/A ASP 70.A N PRO 55.A O no hydrogen 3.123 N/A ARG 72.A NE ASP 70.A OD1 no hydrogen 2.569 N/A ARG 72.A NE ASP 70.A OD2 no hydrogen 3.443 N/A ARG 72.A NH1 PRO 392.A O no hydrogen 2.959 N/A ASN 75.A N PHE 71.A O no hydrogen 2.850 N/A ASN 75.A ND2 GLY 146.A O no hydrogen 3.495 N/A LYS 76.A N ARG 72.A O no hydrogen 3.171 N/A LYS 76.A NZ GLU 73.A OE1 no hydrogen 3.140 N/A ARG 77.A N GLU 73.A O no hydrogen 3.251 N/A ARG 77.A NE ASP 13.A O no hydrogen 2.790 N/A THR 78.A N LEU 74.A O no hydrogen 3.201 N/A THR 78.A N ASN 75.A O no hydrogen 3.368 N/A THR 78.A OG1 LEU 74.A O no hydrogen 2.979 N/A PHE 81.A N THR 78.A O no hydrogen 2.927 N/A TRP 82.A N GLN 79.A O no hydrogen 2.549 N/A GLU 83.A N GLN 79.A O no hydrogen 2.672 N/A LEU 94.A N PRO 91.A O no hydrogen 3.446 N/A LYS 95.A NZ ALA 92.A O no hydrogen 3.438 N/A LYS 95.A NZ ILE 362.A O no hydrogen 3.273 N/A LYS 96.A N GLY 93.A O no hydrogen 3.029 N/A LYS 97.A N LEU 94.A O no hydrogen 3.408 N/A LYS 97.A NZ ASP 171.A O no hydrogen 3.310 N/A LYS 97.A NZ ASP 186.A OD2 no hydrogen 3.288 N/A LYS 98.A N ASP 186.A OD1 no hydrogen 3.316 N/A SER 99.A N SER 185.A O no hydrogen 3.202 N/A SER 99.A OG HIS 215.A ND1 no hydrogen 2.942 N/A VAL 100.A N LEU 214.A O no hydrogen 2.932 N/A THR 101.A N VAL 183.A O no hydrogen 2.772 N/A THR 101.A OG1 HIS 192.A NE2 no hydrogen 2.641 N/A LEU 103.A N LEU 181.A O no hydrogen 2.790 N/A VAL 105.A N ASP 179.A O no hydrogen 3.026 N/A TYR 109.A OH MET 178.A O no hydrogen 2.521 N/A PHE 110.A N ASP 107.A O no hydrogen 2.915 N/A SER 111.A N ALA 108.A O no hydrogen 3.319 N/A SER 111.A OG ALA 108.A O no hydrogen 2.921 N/A VAL 112.A N TYR 109.A O no hydrogen 3.069 N/A LEU 114.A N ASN 141.A O no hydrogen 2.955 N/A PHE 118.A N ASP 115.A O no hydrogen 2.886 N/A ARG 119.A N GLU 116.A O no hydrogen 3.294 N/A ARG 119.A NE LEU 114.A O no hydrogen 2.905 N/A ARG 119.A NH1 ASN 141.A OD1 no hydrogen 3.312 N/A ARG 119.A NH2 LEU 114.A O no hydrogen 2.932 N/A TYR 121.A N PHE 118.A O no hydrogen 2.991 N/A THR 122.A N ARG 119.A O no hydrogen 2.832 N/A THR 122.A OG1 ARG 119.A O no hydrogen 2.787 N/A PHE 124.A N TYR 138.A O no hydrogen 2.966 N/A THR 125.A OG1 ASN 53.A OD1 no hydrogen 2.764 N/A ILE 126.A N ILE 136.A O no hydrogen 2.727 N/A SER 128.A OG THR 133.A O no hydrogen 2.620 N/A GLU 132.A N ILE 129.A O no hydrogen 3.062 N/A THR 133.A N SER 128.A OG no hydrogen 3.218 N/A THR 133.A OG1 PRO 134.A O no hydrogen 2.614 N/A ILE 136.A N ILE 126.A O no hydrogen 2.980 N/A ARG 137.A NH1 TYR 52.A O no hydrogen 3.550 N/A ARG 137.A NH1 ASN 53.A OD1 no hydrogen 3.325 N/A ARG 137.A NH1 THR 125.A OG1 no hydrogen 3.015 N/A ARG 137.A NH2 ASN 50.A O no hydrogen 2.772 N/A ARG 137.A NH2 TYR 52.A O no hydrogen 2.587 N/A TYR 138.A N PHE 124.A O no hydrogen 3.016 N/A TYR 138.A OH GLU 38.A OE1 no hydrogen 3.343 N/A GLN 139.A N SER 44.A O no hydrogen 2.780 N/A TYR 140.A N THR 122.A OG1 no hydrogen 2.642 N/A ASN 141.A N LYS 42.A O no hydrogen 2.790 N/A ASN 141.A ND2 GLY 41.A O no hydrogen 3.035 N/A ASN 141.A ND2 SER 44.A OG no hydrogen 2.602 N/A LEU 143.A N VAL 112.A O no hydrogen 3.027 N/A TRP 147.A NE1 THR 78.A OG1 no hydrogen 3.291 N/A LYS 148.A N ASN 75.A OD1 no hydrogen 3.174 N/A SER 150.A OG PRO 144.A O no hydrogen 2.645 N/A ILE 153.A N GLY 149.A O no hydrogen 2.938 N/A PHE 154.A N SER 150.A O no hydrogen 3.034 N/A GLN 155.A N ALA 152.A O no hydrogen 3.244 N/A GLN 155.A NE2 GLY 87.A O no hydrogen 3.439 N/A MET 158.A N PHE 154.A O no hydrogen 3.010 N/A THR 159.A N GLN 155.A O no hydrogen 2.677 N/A THR 159.A OG1 GLN 155.A O no hydrogen 2.991 N/A LYS 160.A N SER 156.A O no hydrogen 3.118 N/A ILE 161.A N SER 157.A O no hydrogen 2.962 N/A LEU 162.A N MET 158.A O no hydrogen 2.969 N/A GLU 163.A N THR 159.A O no hydrogen 3.165 N/A PHE 165.A N LEU 162.A O no hydrogen 2.864 N/A LYS 166.A N LEU 162.A O no hydrogen 2.911 N/A LYS 167.A N GLU 163.A O no hydrogen 2.946 N/A ASN 169.A N PHE 165.A O no hydrogen 3.085 N/A ASN 169.A ND2 PHE 165.A O no hydrogen 2.771 N/A ILE 172.A N ASN 169.A O no hydrogen 3.419 N/A VAL 173.A N GLY 184.A O no hydrogen 3.060 N/A TYR 175.A N TYR 182.A O no hydrogen 2.961 N/A TYR 177.A N ASP 180.A O no hydrogen 3.243 N/A ASP 180.A N TYR 177.A O no hydrogen 2.973 N/A LEU 181.A N LEU 103.A O no hydrogen 2.697 N/A TYR 182.A N TYR 175.A O no hydrogen 2.725 N/A VAL 183.A N THR 101.A O no hydrogen 2.836 N/A GLY 184.A N VAL 173.A O no hydrogen 2.982 N/A SER 185.A N SER 99.A O no hydrogen 2.994 N/A SER 185.A OG HIS 192.A ND1 no hydrogen 2.295 N/A LEU 187.A N SER 185.A OG no hydrogen 3.295 N/A HIS 192.A N GLU 188.A O no hydrogen 2.680 N/A HIS 192.A ND1 SER 185.A OG no hydrogen 2.295 N/A HIS 192.A NE2 THR 101.A OG1 no hydrogen 2.641 N/A ARG 193.A N ILE 189.A O no hydrogen 3.071 N/A THR 194.A N GLY 190.A O no hydrogen 3.261 N/A THR 194.A OG1 GLY 190.A O no hydrogen 2.532 N/A THR 194.A OG1 GLN 191.A O no hydrogen 3.307 N/A LYS 195.A N GLN 191.A O no hydrogen 2.955 N/A LYS 195.A NZ GLU 198.A OE2 no hydrogen 2.863 N/A ILE 196.A N HIS 192.A O no hydrogen 2.998 N/A GLU 198.A N THR 194.A O no hydrogen 3.011 N/A LEU 199.A N LYS 195.A O no hydrogen 2.969 N/A ARG 200.A N ILE 196.A O no hydrogen 2.833 N/A ARG 200.A NH1 THR 210.A O no hydrogen 3.200 N/A ARG 200.A NH2 THR 210.A O no hydrogen 3.433 N/A GLN 201.A N GLU 197.A O no hydrogen 2.959 N/A HIS 202.A N GLU 198.A O no hydrogen 2.859 N/A HIS 202.A NE2 ILE 161.A O no hydrogen 2.567 N/A LEU 203.A N LEU 199.A O no hydrogen 2.872 N/A LEU 204.A N ARG 200.A O no hydrogen 2.899 N/A ARG 205.A N GLN 201.A O no hydrogen 2.763 N/A TRP 206.A N HIS 202.A O no hydrogen 3.239 N/A TRP 206.A N LEU 203.A O no hydrogen 3.362 N/A GLY 207.A N LEU 204.A O no hydrogen 3.217 N/A LEU 208.A N LEU 203.A O no hydrogen 2.949 N/A LEU 214.A N VAL 100.A O no hydrogen 2.953 N/A HIS 215.A NE2 GLU 213.A OE2 no hydrogen 2.968 N/A LYS 218.A NZ GLN 222.A OE1 no hydrogen 2.739 N/A GLN 222.A N THR 331.A OG1 no hydrogen 2.904 N/A TRP 232.A NE1 LYS 229.A O no hydrogen 2.951 N/A VAL 234.A N GLU 271.A O no hydrogen 2.948 N/A ASN 235.A N LEU 269.A O no hydrogen 3.128 N/A ASP 236.A N THR 233.A OG1 no hydrogen 2.929 N/A ILE 237.A N THR 233.A O no hydrogen 3.121 N/A GLN 238.A N VAL 234.A O no hydrogen 3.048 N/A LYS 239.A N ASN 235.A O no hydrogen 2.928 N/A LEU 240.A N ASP 236.A O no hydrogen 2.983 N/A VAL 241.A N ILE 237.A O no hydrogen 3.019 N/A GLY 242.A N GLN 238.A O no hydrogen 2.941 N/A LYS 243.A N LYS 239.A O no hydrogen 3.148 N/A LYS 243.A NZ VAL 225.A O no hydrogen 2.839 N/A LEU 244.A N LEU 240.A O no hydrogen 3.090 N/A ASN 245.A N VAL 241.A O no hydrogen 3.043 N/A TRP 246.A N GLY 242.A O no hydrogen 3.357 N/A ALA 247.A N LYS 243.A O no hydrogen 2.975 N/A SER 248.A N LEU 244.A O no hydrogen 3.223 N/A SER 248.A OG ASN 245.A O no hydrogen 3.128 N/A GLN 249.A N TRP 246.A O no hydrogen 3.128 N/A ILE 250.A N ALA 247.A O no hydrogen 2.699 N/A TYR 251.A N ALA 247.A O no hydrogen 2.964 N/A SER 260.A N VAL 256.A O no hydrogen 3.186 N/A SER 260.A OG VAL 256.A O no hydrogen 3.329 N/A SER 260.A OG ARG 257.A O no hydrogen 3.317 N/A LEU 262.A N LEU 259.A O no hydrogen 3.067 N/A LYS 267.A NZ GLU 271.A OE2 no hydrogen 2.889 N/A GLU 271.A N ALA 268.A O no hydrogen 3.246 N/A GLU 278.A N THR 276.A OG1 no hydrogen 2.978 N/A ALA 279.A N THR 276.A O no hydrogen 3.259 N/A GLU 280.A N THR 276.A O no hydrogen 3.456 N/A LEU 281.A N GLU 277.A O no hydrogen 3.281 N/A GLU 282.A N GLU 278.A O no hydrogen 3.191 N/A LEU 283.A N ALA 279.A O no hydrogen 2.858 N/A ALA 284.A N GLU 280.A O no hydrogen 2.836 N/A GLU 285.A N LEU 281.A O no hydrogen 3.098 N/A ASN 286.A N GLU 282.A O no hydrogen 3.360 N/A ASN 286.A ND2 LYS 255.A O no hydrogen 2.996 N/A ARG 287.A N LEU 283.A O no hydrogen 3.000 N/A GLU 288.A N ALA 284.A O no hydrogen 3.251 N/A ILE 289.A N GLU 285.A O no hydrogen 3.407 N/A ASP 300.A N GLN 323.A OE1 no hydrogen 2.800 N/A SER 302.A N ASP 300.A OD1 no hydrogen 3.149 N/A SER 302.A OG ASP 300.A OD1 no hydrogen 3.222 N/A LYS 303.A NZ ASP 300.A OD2 no hydrogen 3.116 N/A ILE 306.A N TYR 322.A O no hydrogen 2.860 N/A ALA 307.A N LYS 368.A O no hydrogen 3.264 N/A GLU 308.A N GLN 320.A O no hydrogen 2.924 N/A GLN 310.A N THR 318.A O no hydrogen 3.060 N/A LYS 311.A NZ ASP 344.A OD2 no hydrogen 2.905 N/A GLN 312.A N GLN 316.A O no hydrogen 2.952 N/A GLN 312.A NE2 THR 318.A OG1 no hydrogen 2.892 N/A GLN 312.A NE2 LYS 404.A O no hydrogen 3.629 N/A TRP 317.A N TYR 334.A O no hydrogen 2.920 N/A TRP 317.A NE1 GLN 347.A OE1 no hydrogen 2.791 N/A THR 318.A N GLN 310.A O no hydrogen 3.177 N/A TYR 319.A N GLY 332.A O no hydrogen 2.962 N/A GLN 320.A N GLU 308.A O no hydrogen 2.910 N/A ILE 321.A N LYS 330.A O no hydrogen 2.818 N/A TYR 322.A N ILE 306.A O no hydrogen 2.904 N/A TYR 322.A OH GLU 308.A OE2 no hydrogen 3.034 N/A GLN 323.A NE2 ASP 300.A O no hydrogen 2.486 N/A GLN 323.A NE2 LYS 303.A O no hydrogen 3.273 N/A LYS 327.A N GLU 324.A O no hydrogen 3.299 N/A ASN 328.A ND2 TYR 407.A OH no hydrogen 3.385 N/A LYS 330.A N ILE 321.A O no hydrogen 3.139 N/A LYS 330.A NZ TYR 319.A OH no hydrogen 2.838 N/A LYS 330.A NZ GLU 358.A OE1 no hydrogen 2.437 N/A THR 331.A OG1 GLN 222.A O no hydrogen 3.525 N/A GLY 332.A N TYR 319.A O no hydrogen 3.233 N/A TYR 334.A N TRP 317.A O no hydrogen 2.684 N/A TYR 334.A OH GLU 350.A OE1 no hydrogen 2.522 N/A ARG 336.A N GLY 315.A O no hydrogen 3.275 N/A VAL 345.A N ASN 343.A OD1 no hydrogen 2.697 N/A LYS 346.A NZ HIS 341.A O no hydrogen 3.463 N/A GLN 347.A N ASN 343.A O no hydrogen 3.096 N/A GLN 347.A NE2 THR 342.A OG1 no hydrogen 3.034 N/A LEU 348.A N ASP 344.A O no hydrogen 3.117 N/A THR 349.A N VAL 345.A O no hydrogen 3.032 N/A THR 349.A OG1 VAL 345.A O no hydrogen 3.264 N/A GLU 350.A N LYS 346.A O no hydrogen 3.089 N/A ALA 351.A N GLN 347.A O no hydrogen 2.973 N/A VAL 352.A N LEU 348.A O no hydrogen 2.961 N/A GLN 353.A N THR 349.A O no hydrogen 3.034 N/A GLN 353.A NE2 THR 349.A O no hydrogen 3.071 N/A GLN 353.A NE2 TYR 385.A O no hydrogen 3.664 N/A LYS 354.A N GLU 350.A O no hydrogen 2.845 N/A LYS 354.A NZ GLU 358.A OE2 no hydrogen 2.922 N/A ILE 355.A N ALA 351.A O no hydrogen 2.846 N/A THR 356.A N VAL 352.A O no hydrogen 3.021 N/A THR 356.A OG1 VAL 352.A O no hydrogen 2.786 N/A THR 357.A N GLN 353.A O no hydrogen 3.191 N/A THR 357.A OG1 GLN 353.A O no hydrogen 3.555 N/A GLU 358.A N LYS 354.A O no hydrogen 3.186 N/A SER 359.A N ILE 355.A O no hydrogen 2.949 N/A SER 359.A OG LYS 365.A O no hydrogen 2.559 N/A ILE 360.A N THR 356.A O no hydrogen 3.016 N/A VAL 361.A N THR 357.A O no hydrogen 2.887 N/A ILE 362.A N GLU 358.A O no hydrogen 3.048 N/A TRP 363.A N SER 359.A O no hydrogen 3.007 N/A GLY 364.A N ILE 360.A O no hydrogen 2.845 N/A THR 366.A OG1 PRO 367.A O no hydrogen 3.545 N/A LYS 368.A N LEU 305.A O no hydrogen 3.131 N/A LYS 368.A NZ GLU 395.A OE1 no hydrogen 3.457 N/A PHE 369.A N GLU 393.A O no hydrogen 2.956 N/A LYS 370.A N ALA 307.A O no hydrogen 2.973 N/A LEU 371.A N GLU 395.A O no hydrogen 2.956 N/A GLN 374.A NE2 GLU 376.A OE1 no hydrogen 3.175 N/A GLU 376.A N GLU 376.A OE1 no hydrogen 2.902 N/A THR 377.A OG1 GLN 374.A OE1 no hydrogen 3.196 N/A TRP 378.A N GLN 374.A O no hydrogen 3.056 N/A GLU 379.A N LYS 375.A O no hydrogen 2.960 N/A THR 380.A N THR 377.A O no hydrogen 3.140 N/A THR 380.A OG1 GLU 376.A O no hydrogen 2.837 N/A TRP 381.A N TRP 378.A O no hydrogen 3.323 N/A TRP 382.A N TRP 378.A O no hydrogen 3.251 N/A GLU 384.A N TRP 381.A O no hydrogen 3.093 N/A TYR 385.A N TRP 382.A O no hydrogen 3.428 N/A TRP 386.A NE1 TRP 390.A O no hydrogen 3.040 N/A GLN 387.A N GLN 353.A OE1 no hydrogen 2.823 N/A GLN 387.A NE2 LYS 61.A O no hydrogen 3.494 N/A GLU 395.A N PHE 369.A O no hydrogen 2.855 N/A VAL 397.A N LEU 371.A O no hydrogen 2.902 N/A THR 399.A OG1 PRO 400.A O no hydrogen 3.210 N/A LYS 404.A NZ LYS 311.A O no hydrogen 3.026 N/A LYS 404.A NZ GLN 312.A O no hydrogen 3.180 N/A TRP 406.A N VAL 403.A O no hydrogen 3.190 N/A TYR 407.A N LYS 404.A O no hydrogen 2.548 N/A