Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8u6s_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 7.A N ASP 118.A OD2 no hydrogen 3.116 N/A LYS 10.A N ARG 80.A O no hydrogen 3.390 N/A VAL 18.A N ASN 54.A O no hydrogen 3.058 N/A GLN 20.A NE2 TRP 21.A O no hydrogen 2.903 N/A GLN 20.A NE2 VAL 57.A O no hydrogen 2.912 N/A LYS 27.A N THR 24.A OG1 no hydrogen 3.323 N/A LYS 27.A NZ THR 381.A OG1 no hydrogen 3.374 N/A LYS 27.A NZ GLU 382.A OE1 no hydrogen 3.265 N/A LYS 27.A NZ GLU 382.A OE2 no hydrogen 2.941 N/A ILE 28.A N THR 24.A O no hydrogen 3.060 N/A LYS 29.A N GLU 25.A O no hydrogen 3.097 N/A ALA 30.A N GLU 26.A O no hydrogen 3.194 N/A LEU 31.A N LYS 27.A O no hydrogen 3.017 N/A VAL 32.A N ILE 28.A O no hydrogen 2.816 N/A VAL 32.A N LYS 29.A O no hydrogen 3.159 N/A GLU 33.A N LYS 29.A O no hydrogen 2.945 N/A ILE 34.A N ALA 30.A O no hydrogen 3.000 N/A CYS 35.A N LEU 31.A O no hydrogen 3.129 N/A CYS 35.A SG LEU 31.A O no hydrogen 3.128 N/A THR 36.A N VAL 32.A O no hydrogen 3.259 N/A GLU 37.A N GLU 33.A O no hydrogen 3.123 N/A MET 38.A N ILE 34.A O no hydrogen 2.911 N/A GLU 39.A N CYS 35.A O no hydrogen 2.757 N/A LYS 40.A N THR 36.A O no hydrogen 3.226 N/A GLU 41.A N GLU 37.A O no hydrogen 2.868 N/A GLY 42.A N GLU 39.A O no hydrogen 3.138 N/A LYS 43.A N MET 38.A O no hydrogen 2.802 N/A SER 45.A N GLN 142.A O no hydrogen 2.942 N/A ILE 47.A N ARG 140.A O no hydrogen 3.073 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.804 N/A ASN 51.A N GLY 48.A O no hydrogen 3.451 N/A ASN 51.A ND2 LYS 123.A O no hydrogen 3.270 N/A ASN 51.A ND2 GLN 142.A OE1 no hydrogen 3.641 N/A TYR 53.A N ASN 51.A OD1 no hydrogen 3.257 N/A TYR 53.A OH ASP 14.A OD1 no hydrogen 3.227 N/A ASN 54.A N PRO 16.A O no hydrogen 2.952 N/A ASN 54.A ND2 VAL 18.A O no hydrogen 2.657 N/A THR 55.A N ALA 126.A O no hydrogen 2.988 N/A VAL 57.A N GLN 20.A OE1 no hydrogen 2.935 N/A PHE 58.A N LEU 71.A O no hydrogen 2.869 N/A LYS 67.A N SER 65.A OG no hydrogen 3.219 N/A ARG 69.A N ILE 60.A O no hydrogen 2.940 N/A LYS 70.A NZ TYR 143.A OH no hydrogen 2.817 N/A LEU 71.A N PHE 58.A O no hydrogen 3.170 N/A ASP 73.A N PRO 56.A O no hydrogen 3.122 N/A ARG 75.A N ASP 73.A OD1 no hydrogen 3.192 N/A ARG 75.A NE ASP 73.A OD1 no hydrogen 2.553 N/A ARG 75.A NE ASP 73.A OD2 no hydrogen 3.347 N/A ARG 75.A NH1 PRO 390.A O no hydrogen 2.928 N/A ARG 75.A NH2 ASP 73.A OD2 no hydrogen 2.787 N/A ASN 78.A N PHE 74.A O no hydrogen 2.724 N/A ASN 78.A ND2 GLY 149.A O no hydrogen 3.413 N/A LYS 79.A N ARG 75.A O no hydrogen 3.421 N/A LYS 79.A NZ GLU 76.A OE1 no hydrogen 2.930 N/A LYS 79.A NZ GLU 391.A OE1 no hydrogen 3.378 N/A ARG 80.A N GLU 76.A O no hydrogen 3.112 N/A ARG 80.A NE ASP 14.A O no hydrogen 2.496 N/A ARG 80.A NH2 ASP 14.A O no hydrogen 3.118 N/A THR 81.A N LEU 77.A O no hydrogen 2.934 N/A THR 81.A OG1 LEU 77.A O no hydrogen 3.181 N/A PHE 84.A N THR 81.A O no hydrogen 2.553 N/A TRP 85.A N THR 81.A O no hydrogen 3.325 N/A GLU 86.A N GLN 82.A O no hydrogen 2.456 N/A GLN 88.A N PHE 84.A O no hydrogen 3.068 N/A LYS 99.A N GLY 96.A O no hydrogen 2.576 N/A LYS 101.A N ASP 189.A OD1 no hydrogen 3.405 N/A SER 102.A N SER 188.A O no hydrogen 3.265 N/A VAL 103.A N LEU 217.A O no hydrogen 3.306 N/A THR 104.A N VAL 186.A O no hydrogen 3.029 N/A THR 104.A OG1 HIS 195.A NE2 no hydrogen 2.644 N/A LEU 106.A N LEU 184.A O no hydrogen 2.861 N/A VAL 108.A N ASP 182.A O no hydrogen 2.979 N/A ALA 111.A N VAL 108.A O no hydrogen 2.843 N/A TYR 112.A OH GLN 179.A OE1 no hydrogen 2.930 N/A TYR 112.A OH MET 181.A O no hydrogen 2.902 N/A SER 114.A N ALA 111.A O no hydrogen 3.003 N/A SER 114.A OG ALA 111.A O no hydrogen 3.198 N/A VAL 115.A N TYR 112.A O no hydrogen 3.092 N/A LEU 117.A N ASN 144.A O no hydrogen 3.228 N/A ASP 120.A N ASP 118.A OD1 no hydrogen 3.442 N/A PHE 121.A N ASP 118.A O no hydrogen 3.382 N/A ARG 122.A NE LEU 117.A O no hydrogen 2.847 N/A ARG 122.A NH1 ASN 144.A OD1 no hydrogen 3.428 N/A ARG 122.A NH2 LEU 117.A O no hydrogen 2.758 N/A TYR 124.A N PHE 121.A O no hydrogen 2.928 N/A THR 125.A N ARG 122.A O no hydrogen 2.949 N/A THR 125.A OG1 ARG 122.A O no hydrogen 3.086 N/A ALA 126.A N LYS 123.A O no hydrogen 3.507 N/A PHE 127.A N TYR 141.A O no hydrogen 2.727 N/A THR 128.A OG1 ASN 54.A OD1 no hydrogen 2.862 N/A ILE 129.A N ILE 139.A O no hydrogen 2.890 N/A SER 131.A OG THR 136.A O no hydrogen 2.241 N/A GLU 135.A N ILE 132.A O no hydrogen 3.099 N/A THR 136.A N SER 131.A OG no hydrogen 3.255 N/A THR 136.A OG1 PRO 137.A O no hydrogen 3.004 N/A ILE 139.A N ILE 129.A O no hydrogen 3.082 N/A ARG 140.A NH1 TYR 53.A O no hydrogen 3.375 N/A ARG 140.A NH1 THR 128.A OG1 no hydrogen 2.721 N/A ARG 140.A NH2 ASN 51.A O no hydrogen 2.606 N/A ARG 140.A NH2 TYR 53.A O no hydrogen 2.520 N/A TYR 141.A N PHE 127.A O no hydrogen 3.087 N/A TYR 141.A OH GLU 39.A OE1 no hydrogen 3.207 N/A GLN 142.A N SER 45.A O no hydrogen 3.009 N/A TYR 143.A N THR 125.A OG1 no hydrogen 2.709 N/A ASN 144.A N LYS 43.A O no hydrogen 2.875 N/A ASN 144.A ND2 GLY 42.A O no hydrogen 2.735 N/A ASN 144.A ND2 SER 45.A OG no hydrogen 2.696 N/A LEU 146.A N VAL 115.A O no hydrogen 3.003 N/A TRP 150.A NE1 THR 81.A OG1 no hydrogen 3.037 N/A LYS 151.A N ASN 78.A OD1 no hydrogen 3.278 N/A SER 153.A N TRP 150.A O no hydrogen 3.447 N/A SER 153.A OG PRO 147.A O no hydrogen 2.984 N/A ILE 156.A N GLY 152.A O no hydrogen 3.173 N/A PHE 157.A N SER 153.A O no hydrogen 3.280 N/A GLN 158.A N ALA 155.A O no hydrogen 3.343 N/A GLN 158.A NE2 LEU 89.A O no hydrogen 2.871 N/A GLN 158.A NE2 ALA 155.A O no hydrogen 3.336 N/A SER 159.A OG ILE 156.A O no hydrogen 3.426 N/A MET 161.A N PHE 157.A O no hydrogen 2.958 N/A THR 162.A N GLN 158.A O no hydrogen 3.121 N/A THR 162.A OG1 GLN 158.A O no hydrogen 3.030 N/A LYS 163.A N SER 159.A O no hydrogen 3.220 N/A ILE 164.A N SER 160.A O no hydrogen 3.291 N/A LEU 165.A N MET 161.A O no hydrogen 3.070 N/A GLU 166.A N LYS 163.A O no hydrogen 2.961 N/A LYS 169.A N LEU 165.A O no hydrogen 2.601 N/A LYS 170.A N GLU 166.A O no hydrogen 3.126 N/A LYS 170.A NZ LYS 170.A O no hydrogen 2.758 N/A GLN 171.A N PRO 167.A O no hydrogen 3.080 N/A ASN 172.A N PHE 168.A O no hydrogen 3.207 N/A ASN 172.A N LYS 169.A O no hydrogen 3.269 N/A ASN 172.A ND2 PHE 168.A O no hydrogen 3.026 N/A ASP 174.A N ASP 174.A OD1 no hydrogen 2.493 N/A VAL 176.A N GLY 187.A O no hydrogen 2.790 N/A TYR 178.A N TYR 185.A O no hydrogen 2.952 N/A TYR 180.A N ASP 183.A O no hydrogen 2.975 N/A ASP 183.A N TYR 180.A O no hydrogen 2.976 N/A LEU 184.A N LEU 106.A O no hydrogen 2.800 N/A TYR 185.A N TYR 178.A O no hydrogen 2.548 N/A VAL 186.A N THR 104.A O no hydrogen 2.924 N/A GLY 187.A N VAL 176.A O no hydrogen 2.979 N/A SER 188.A N SER 102.A O no hydrogen 3.247 N/A SER 188.A OG HIS 195.A ND1 no hydrogen 2.304 N/A HIS 195.A N GLU 191.A O no hydrogen 2.684 N/A HIS 195.A ND1 SER 188.A OG no hydrogen 2.304 N/A HIS 195.A NE2 THR 104.A OG1 no hydrogen 2.644 N/A ARG 196.A N ILE 192.A O no hydrogen 2.611 N/A THR 197.A N GLY 193.A O no hydrogen 2.950 N/A THR 197.A OG1 GLN 194.A O no hydrogen 3.043 N/A LYS 198.A N GLN 194.A O no hydrogen 2.822 N/A ILE 199.A N HIS 195.A O no hydrogen 3.034 N/A GLU 200.A N ARG 196.A O no hydrogen 2.867 N/A GLU 201.A N THR 197.A O no hydrogen 2.573 N/A LEU 202.A N LYS 198.A O no hydrogen 3.242 N/A ARG 203.A N ILE 199.A O no hydrogen 2.607 N/A ARG 203.A NH1 THR 213.A O no hydrogen 2.870 N/A ARG 203.A NH2 THR 213.A O no hydrogen 2.890 N/A GLN 204.A N GLU 200.A O no hydrogen 2.808 N/A HIS 205.A N GLU 201.A O no hydrogen 2.729 N/A HIS 205.A NE2 ILE 164.A O no hydrogen 2.367 N/A LEU 206.A N LEU 202.A O no hydrogen 2.985 N/A LEU 207.A N ARG 203.A O no hydrogen 2.830 N/A ARG 208.A N GLN 204.A O no hydrogen 3.061 N/A ARG 208.A N HIS 205.A O no hydrogen 3.135 N/A TRP 209.A N HIS 205.A O no hydrogen 3.315 N/A TRP 209.A N LEU 206.A O no hydrogen 3.265 N/A GLY 210.A N LEU 207.A O no hydrogen 3.273 N/A LEU 211.A N LEU 206.A O no hydrogen 3.165 N/A LEU 217.A N VAL 103.A O no hydrogen 2.783 N/A HIS 218.A ND1 LYS 101.A O no hydrogen 3.206 N/A LYS 221.A N HIS 218.A O no hydrogen 3.356 N/A THR 223.A OG1 VAL 224.A O no hydrogen 3.217 N/A THR 235.A OG1 ASP 238.A OD1 no hydrogen 2.721 N/A VAL 236.A N LEU 269.A O no hydrogen 3.214 N/A ASN 237.A ND2 GLN 240.A OE1 no hydrogen 2.804 N/A ASP 238.A N THR 235.A OG1 no hydrogen 3.291 N/A ILE 239.A N THR 235.A O no hydrogen 3.300 N/A GLN 240.A N ASN 237.A O no hydrogen 3.014 N/A LYS 241.A N ASN 237.A O no hydrogen 3.083 N/A LEU 242.A N ASP 238.A O no hydrogen 2.877 N/A VAL 243.A N ILE 239.A O no hydrogen 2.892 N/A GLY 244.A N GLN 240.A O no hydrogen 2.594 N/A LYS 245.A N LYS 241.A O no hydrogen 2.928 N/A LEU 246.A N LEU 242.A O no hydrogen 3.120 N/A ASN 247.A N VAL 243.A O no hydrogen 2.917 N/A TRP 248.A N GLY 244.A O no hydrogen 3.162 N/A ALA 249.A N LYS 245.A O no hydrogen 2.796 N/A SER 250.A N LEU 246.A O no hydrogen 2.999 N/A SER 250.A OG ASN 247.A O no hydrogen 2.608 N/A GLN 251.A N TRP 248.A O no hydrogen 3.052 N/A ILE 252.A N ALA 249.A O no hydrogen 2.889 N/A TYR 253.A N ALA 249.A O no hydrogen 3.346 N/A LYS 261.A N GLN 258.A O no hydrogen 2.677 N/A LEU 262.A N LEU 259.A O no hydrogen 2.781 N/A LEU 263.A N SER 260.A O no hydrogen 2.521 N/A ARG 264.A N LYS 261.A O no hydrogen 2.662 N/A LYS 267.A N GLY 265.A O no hydrogen 2.647 N/A LYS 267.A NZ ARG 264.A O no hydrogen 2.413 N/A GLU 271.A N LEU 269.A O no hydrogen 2.724 N/A ILE 273.A N TRP 234.A O no hydrogen 2.668 N/A GLU 280.A N THR 276.A O no hydrogen 2.501 N/A LEU 281.A N GLU 277.A O no hydrogen 2.568 N/A GLU 282.A N GLU 278.A O no hydrogen 2.943 N/A LEU 283.A N ALA 279.A O no hydrogen 2.721 N/A ALA 284.A N GLU 280.A O no hydrogen 2.714 N/A GLU 285.A N LEU 281.A O no hydrogen 2.827 N/A ASN 286.A N GLU 282.A O no hydrogen 2.669 N/A ARG 287.A N LEU 283.A O no hydrogen 2.934 N/A GLU 288.A N ALA 284.A O no hydrogen 3.101 N/A ILE 289.A N GLU 285.A O no hydrogen 3.065 N/A LEU 290.A N ASN 286.A O no hydrogen 2.898 N/A LYS 291.A N ARG 287.A O no hydrogen 3.180 N/A GLU 292.A N GLU 288.A O no hydrogen 3.161 N/A ASP 300.A N GLN 323.A OE1 no hydrogen 3.259 N/A SER 302.A N ASP 300.A OD1 no hydrogen 2.936 N/A SER 302.A OG ASP 300.A OD1 no hydrogen 2.569 N/A SER 302.A OG ASP 300.A OD2 no hydrogen 3.180 N/A LYS 303.A N ASP 300.A O no hydrogen 2.911 N/A ILE 306.A N TYR 322.A O no hydrogen 2.828 N/A ALA 307.A N LYS 366.A O no hydrogen 2.837 N/A GLU 308.A N GLN 320.A O no hydrogen 3.056 N/A GLN 310.A N THR 318.A O no hydrogen 2.865 N/A GLN 310.A NE2 GLN 320.A OE1 no hydrogen 3.429 N/A LYS 311.A NZ ASP 342.A OD2 no hydrogen 2.604 N/A GLN 312.A N GLN 316.A O no hydrogen 2.800 N/A GLN 312.A NE2 LYS 402.A O no hydrogen 2.426 N/A GLN 316.A N GLY 313.A O no hydrogen 3.082 N/A TRP 317.A N TYR 334.A O no hydrogen 2.891 N/A TRP 317.A NE1 GLN 345.A OE1 no hydrogen 2.453 N/A THR 318.A N GLN 310.A O no hydrogen 3.053 N/A THR 318.A OG1 GLN 310.A OE1 no hydrogen 3.371 N/A TYR 319.A N GLY 332.A O no hydrogen 2.976 N/A TYR 319.A OH GLU 356.A OE1 no hydrogen 2.740 N/A GLN 320.A N GLU 308.A O no hydrogen 2.904 N/A GLN 320.A NE2 GLN 310.A OE1 no hydrogen 3.232 N/A ILE 321.A N LYS 330.A O no hydrogen 2.897 N/A TYR 322.A N ILE 306.A O no hydrogen 2.943 N/A TYR 322.A OH GLU 308.A OE2 no hydrogen 2.630 N/A GLN 323.A NE2 ASP 300.A O no hydrogen 2.845 N/A GLN 323.A NE2 LYS 303.A O no hydrogen 2.994 N/A GLN 323.A NE2 ASP 304.A O no hydrogen 3.680 N/A LYS 327.A N GLU 324.A O no hydrogen 2.797 N/A LYS 330.A N ILE 321.A O no hydrogen 3.283 N/A LYS 330.A NZ THR 331.A O no hydrogen 3.190 N/A THR 331.A OG1 LYS 330.A O no hydrogen 3.275 N/A GLY 332.A N TYR 319.A O no hydrogen 3.228 N/A LYS 333.A NZ GLN 316.A OE1 no hydrogen 2.776 N/A TYR 334.A N TRP 317.A O no hydrogen 2.895 N/A TYR 334.A OH GLU 348.A OE1 no hydrogen 2.826 N/A ALA 338.A N THR 340.A OG1 no hydrogen 3.053 N/A ASN 341.A ND2 TYR 383.A OH no hydrogen 3.538 N/A VAL 343.A N ASN 341.A OD1 no hydrogen 2.651 N/A LYS 344.A NZ GLU 348.A OE2 no hydrogen 3.535 N/A GLN 345.A N ASN 341.A O no hydrogen 3.151 N/A GLN 345.A NE2 THR 340.A O no hydrogen 3.110 N/A LEU 346.A N ASP 342.A O no hydrogen 3.236 N/A THR 347.A N VAL 343.A O no hydrogen 2.846 N/A THR 347.A OG1 VAL 343.A O no hydrogen 3.070 N/A GLU 348.A N LYS 344.A O no hydrogen 2.883 N/A ALA 349.A N GLN 345.A O no hydrogen 2.784 N/A VAL 350.A N LEU 346.A O no hydrogen 2.651 N/A GLN 351.A N THR 347.A O no hydrogen 2.883 N/A LYS 352.A N GLU 348.A O no hydrogen 2.860 N/A ILE 353.A N ALA 349.A O no hydrogen 2.882 N/A THR 354.A N VAL 350.A O no hydrogen 2.980 N/A THR 354.A OG1 GLN 351.A O no hydrogen 3.150 N/A THR 355.A N GLN 351.A O no hydrogen 3.206 N/A THR 355.A OG1 GLN 351.A O no hydrogen 3.062 N/A GLU 356.A N LYS 352.A O no hydrogen 3.086 N/A SER 357.A N ILE 353.A O no hydrogen 3.040 N/A SER 357.A OG ILE 353.A O no hydrogen 3.294 N/A ILE 358.A N THR 354.A O no hydrogen 2.676 N/A VAL 359.A N THR 355.A O no hydrogen 2.783 N/A ILE 360.A N GLU 356.A O no hydrogen 3.081 N/A TRP 361.A N SER 357.A O no hydrogen 2.959 N/A GLY 362.A N SER 357.A O no hydrogen 3.129 N/A GLY 362.A N ILE 358.A O no hydrogen 2.854 N/A LYS 366.A N LEU 305.A O no hydrogen 2.644 N/A LYS 366.A NZ GLU 393.A OE1 no hydrogen 3.387 N/A PHE 367.A N GLU 391.A O no hydrogen 3.148 N/A LYS 368.A N ALA 307.A O no hydrogen 2.877 N/A LEU 369.A N GLU 393.A O no hydrogen 2.898 N/A ILE 371.A N LEU 369.A O no hydrogen 3.000 N/A GLN 372.A NE2 GLU 374.A OE1 no hydrogen 3.024 N/A GLU 374.A N GLU 374.A OE1 no hydrogen 2.740 N/A TRP 376.A N GLN 372.A O no hydrogen 3.126 N/A GLU 377.A N LYS 373.A O no hydrogen 3.022 N/A THR 378.A N THR 375.A O no hydrogen 3.328 N/A THR 378.A OG1 GLU 374.A O no hydrogen 2.594 N/A TRP 379.A N THR 375.A O no hydrogen 3.263 N/A TRP 380.A N TRP 376.A O no hydrogen 3.043 N/A THR 381.A OG1 GLU 382.A OE2 no hydrogen 2.706 N/A GLU 382.A N TRP 379.A O no hydrogen 3.412 N/A TRP 384.A NE1 TRP 388.A O no hydrogen 3.015 N/A GLN 385.A N GLN 351.A OE1 no hydrogen 2.586 N/A THR 387.A OG1 ASP 183.A OD1 no hydrogen 3.513 N/A GLU 393.A N PHE 367.A O no hydrogen 2.833 N/A VAL 395.A N LEU 369.A O no hydrogen 2.922 N/A TRP 404.A N LEU 400.A O no hydrogen 3.312 N/A TYR 405.A N VAL 401.A O no hydrogen 3.084 N/A