Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wh8_K.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N LYS 1.A O no hydrogen 3.189 N/A LYS 6.A N SER 2.A O no hydrogen 2.940 N/A GLY 7.A N TYR 3.A O no hydrogen 2.663 N/A VAL 8.A N GLN 4.A O no hydrogen 2.886 N/A LYS 9.A N LEU 5.A O no hydrogen 3.036 N/A TRP 10.A N LYS 6.A O no hydrogen 3.186 N/A ILE 12.A N VAL 8.A O no hydrogen 3.142 N/A SER 13.A N LYS 9.A O no hydrogen 3.223 N/A LEU 14.A N TRP 10.A O no hydrogen 3.124 N/A TRP 15.A N LEU 11.A O no hydrogen 3.268 N/A GLN 16.A N ILE 12.A O no hydrogen 3.202 N/A ASN 17.A N SER 13.A O no hydrogen 3.126 N/A GLY 18.A N LEU 14.A O no hydrogen 3.205 N/A ASN 20.A ND2 ILE 177.A O no hydrogen 2.823 N/A GLN 26.A N ARG 198.A O no hydrogen 3.418 N/A LYS 31.A NZ ASP 131.A OD2 no hydrogen 2.734 N/A THR 35.A OG1 THR 32.A O no hydrogen 2.792 N/A ILE 36.A N THR 32.A O no hydrogen 3.459 N/A GLY 37.A N ILE 33.A O no hydrogen 3.011 N/A PHE 38.A N GLN 34.A O no hydrogen 3.251 N/A LEU 39.A N THR 35.A O no hydrogen 3.430 N/A SER 40.A N ILE 36.A O no hydrogen 2.803 N/A HIS 41.A N GLY 37.A O no hydrogen 2.928 N/A LEU 42.A N PHE 38.A O no hydrogen 3.294 N/A LYS 43.A N SER 40.A O no hydrogen 3.175 N/A GLY 44.A N HIS 41.A O no hydrogen 3.306 N/A VAL 53.A N VAL 105.A O no hydrogen 3.076 N/A ILE 54.A N VAL 129.A O no hydrogen 3.041 N/A ALA 55.A N THR 107.A O no hydrogen 3.328 N/A THR 59.A OG1 PRO 56.A O no hydrogen 2.978 N/A SER 61.A OG SER 58.A O no hydrogen 2.962 N/A ASN 62.A N SER 58.A O no hydrogen 3.316 N/A TRP 63.A N THR 59.A O no hydrogen 2.903 N/A PHE 64.A N LEU 60.A O no hydrogen 3.116 N/A ASN 65.A N SER 61.A O no hydrogen 2.926 N/A GLU 66.A N ASN 62.A O no hydrogen 2.919 N/A ILE 67.A N TRP 63.A O no hydrogen 2.901 N/A ALA 68.A N PHE 64.A O no hydrogen 2.948 N/A ARG 69.A N ASN 65.A O no hydrogen 2.909 N/A PHE 70.A N GLU 66.A O no hydrogen 2.956 N/A THR 71.A OG1 ILE 67.A O no hydrogen 2.783 N/A ILE 77.A N ILE 104.A O no hydrogen 3.135 N/A TYR 79.A N ILE 106.A O no hydrogen 2.797 N/A GLN 85.A NE2 ASP 115.A OD2 no hydrogen 2.922 N/A ARG 86.A N LYS 83.A O no hydrogen 3.284 N/A LEU 89.A N GLN 85.A O no hydrogen 3.145 N/A ARG 90.A N ASP 87.A O no hydrogen 3.120 N/A ARG 91.A N ASP 87.A O no hydrogen 3.108 N/A LYS 92.A N GLU 88.A O no hydrogen 3.192 N/A GLY 99.A N HIS 93.A NE2 no hydrogen 3.141 N/A PHE 102.A N GLY 99.A O no hydrogen 2.912 N/A ILE 104.A N ASN 75.A O no hydrogen 3.052 N/A VAL 105.A N TYR 51.A O no hydrogen 3.395 N/A ILE 106.A N ILE 77.A O no hydrogen 3.290 N/A THR 107.A N VAL 53.A O no hydrogen 3.410 N/A SER 108.A OG GLU 110.A OE1 no hydrogen 3.306 N/A GLU 110.A N GLU 110.A OE1 no hydrogen 2.514 N/A VAL 111.A N SER 108.A OG no hydrogen 3.262 N/A ALA 112.A N SER 108.A O no hydrogen 2.754 N/A MET 113.A N TYR 109.A O no hydrogen 3.128 N/A ASN 114.A N GLU 110.A O no hydrogen 2.600 N/A ASP 115.A N VAL 111.A O no hydrogen 3.039 N/A ARG 118.A N ASP 115.A O no hydrogen 3.024 N/A LEU 120.A N ALA 116.A O no hydrogen 2.587 N/A LEU 120.A N LYS 117.A O no hydrogen 2.880 N/A HIS 122.A N ILE 119.A O no hydrogen 3.181 N/A TRP 125.A N LYS 151.A O no hydrogen 3.261 N/A VAL 129.A N LEU 52.A O no hydrogen 3.146 N/A ILE 130.A N LEU 156.A O no hydrogen 3.356 N/A ASP 131.A N ILE 54.A O no hydrogen 2.984 N/A GLU 132.A N TYR 109.A OH no hydrogen 3.095 N/A GLY 133.A N LEU 158.A O no hydrogen 3.052 N/A ARG 135.A N GLU 132.A O no hydrogen 3.323 N/A LEU 136.A N GLY 133.A O no hydrogen 2.869 N/A LYS 137.A N HIS 134.A O no hydrogen 3.291 N/A LYS 137.A NZ GLU 169.A OE2 no hydrogen 3.296 N/A LYS 140.A N ASN 138.A OD1 no hydrogen 2.505 N/A CYS 141.A SG ASN 138.A O no hydrogen 3.658 N/A LEU 144.A N CYS 141.A O no hydrogen 2.897 N/A ARG 145.A N CYS 141.A O no hydrogen 3.411 N/A GLU 146.A N LYS 142.A O no hydrogen 2.994 N/A LEU 147.A N LEU 143.A O no hydrogen 2.696 N/A LEU 147.A N LEU 144.A O no hydrogen 3.083 N/A LYS 148.A N LEU 144.A O no hydrogen 3.218 N/A LYS 148.A N ARG 145.A O no hydrogen 3.334 N/A ASN 154.A ND2 LYS 126.A O no hydrogen 2.971 N/A LYS 155.A N ASN 20.A OD1 no hydrogen 3.445 N/A LEU 157.A N GLY 21.A O no hydrogen 3.333 N/A LEU 158.A N ILE 130.A O no hydrogen 3.061 N/A THR 159.A N LEU 23.A O no hydrogen 3.284 N/A THR 159.A OG1 HIS 134.A NE2 no hydrogen 3.172 N/A THR 161.A N THR 159.A OG1 no hydrogen 3.051 N/A GLN 164.A N GLU 169.A OE1 no hydrogen 3.175 N/A ASN 165.A N GLU 169.A OE1 no hydrogen 2.925 N/A ASN 165.A N GLU 169.A OE2 no hydrogen 3.227 N/A ASN 166.A N GLU 169.A OE1 no hydrogen 3.213 N/A SER 168.A N ASN 166.A OD1 no hydrogen 2.319 N/A SER 168.A OG ASN 166.A OD1 no hydrogen 3.056 N/A TRP 171.A N LEU 167.A O no hydrogen 3.054 N/A SER 172.A N SER 168.A O no hydrogen 2.904 N/A SER 172.A OG SER 168.A O no hydrogen 3.256 N/A LEU 173.A N GLU 169.A O no hydrogen 3.159 N/A LEU 174.A N LEU 170.A O no hydrogen 3.119 N/A ASN 175.A N TRP 171.A O no hydrogen 3.333 N/A PHE 176.A N SER 172.A O no hydrogen 3.384 N/A ILE 177.A N LEU 173.A O no hydrogen 2.698 N/A LEU 178.A N LEU 174.A O no hydrogen 3.039 N/A ILE 181.A N LEU 178.A O no hydrogen 2.917 N/A SER 185.A OG GLN 182.A O no hydrogen 2.521 N/A LEU 187.A N VAL 183.A O no hydrogen 2.860 N/A HIS 188.A N VAL 184.A O no hydrogen 3.201 N/A GLY 189.A N SER 185.A O no hydrogen 3.165 N/A GLY 189.A N LYS 186.A O no hydrogen 3.294 N/A LEU 191.A N LEU 187.A O no hydrogen 3.115 N/A ARG 192.A N HIS 188.A O no hydrogen 3.148 N/A ILE 195.A N LEU 191.A O no hydrogen 3.158 N/A ARG 197.A NH1 GLU 436.A OE2 no hydrogen 3.520 N/A ARG 198.A N ASP 25.A OD1 no hydrogen 3.211 N/A VAL 203.A N ASP 202.A OD1 no hydrogen 2.761 N/A LYS 210.A NZ HIS 402.A ND1 no hydrogen 3.185 N/A LYS 211.A N VAL 410.A O no hydrogen 3.374 N/A LYS 211.A NZ ARG 209.A O no hydrogen 3.135 N/A ILE 213.A N VAL 412.A O no hydrogen 3.175 N/A THR 220.A OG1 GLN 289.A O no hydrogen 3.344 N/A LYS 224.A N THR 220.A O no hydrogen 3.129 N/A LYS 225.A N ASP 221.A O no hydrogen 2.991 N/A PHE 226.A N HIS 222.A O no hydrogen 2.952 N/A GLN 227.A N GLN 223.A O no hydrogen 2.839 N/A GLU 228.A N LYS 224.A O no hydrogen 2.947 N/A HIS 229.A N LYS 225.A O no hydrogen 3.105 N/A LEU 230.A N GLN 227.A O no hydrogen 2.997 N/A VAL 231.A N GLN 227.A O no hydrogen 2.750 N/A ASN 232.A N GLU 228.A O no hydrogen 3.211 N/A THR 234.A OG1 ASN 233.A O no hydrogen 2.325 N/A LEU 235.A N HIS 229.A O no hydrogen 3.173 N/A ALA 237.A N THR 234.A O no hydrogen 2.697 N/A HIS 238.A N THR 234.A O no hydrogen 2.692 N/A GLY 240.A N ALA 237.A O no hydrogen 2.756 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.601 N/A GLN 259.A N ASN 255.A O no hydrogen 3.039 N/A LEU 260.A N LEU 256.A O no hydrogen 2.834 N/A ARG 261.A N VAL 257.A O no hydrogen 2.741 N/A LYS 262.A N ILE 258.A O no hydrogen 3.029 N/A ASN 263.A N GLN 259.A O no hydrogen 3.363 N/A ASN 263.A ND2 GLN 223.A O no hydrogen 3.109 N/A CYS 264.A N LEU 260.A O no hydrogen 3.206 N/A CYS 264.A SG LEU 260.A O no hydrogen 3.031 N/A CYS 264.A SG SER 420.A OG no hydrogen 2.771 N/A ASN 265.A N ARG 261.A O no hydrogen 2.786 N/A ASN 265.A ND2 ARG 261.A O no hydrogen 2.582 N/A HIS 266.A N LYS 262.A O no hydrogen 3.106 N/A HIS 266.A NE2 VAL 287.A O no hydrogen 3.247 N/A ASP 268.A N HIS 266.A ND1 no hydrogen 2.951 N/A LEU 269.A N HIS 266.A O no hydrogen 3.184 N/A LEU 270.A N PRO 267.A O no hydrogen 3.074 N/A GLN 271.A N PRO 267.A O no hydrogen 3.187 N/A GLN 271.A NE2 ASP 275.A OD2 no hydrogen 2.713 N/A GLY 272.A N ASP 268.A O no hydrogen 2.664 N/A GLN 273.A N LEU 269.A O no hydrogen 3.220 N/A ILE 274.A N LEU 270.A O no hydrogen 2.756 N/A ASP 275.A N GLN 271.A O no hydrogen 2.985 N/A SER 277.A OG GLY 272.A O no hydrogen 3.346 N/A SER 277.A OG ASP 275.A O no hydrogen 3.376 N/A SER 277.A OG ASP 275.A OD1 no hydrogen 2.589 N/A GLU 284.A N PRO 281.A O no hydrogen 3.470 N/A GLN 289.A N GLU 285.A O no hydrogen 3.308 N/A CYS 290.A N VAL 287.A O no hydrogen 3.292 N/A CYS 290.A SG GLN 223.A OE1 no hydrogen 3.754 N/A CYS 290.A SG ASN 265.A O no hydrogen 3.407 N/A GLY 291.A N GLN 223.A OE1 no hydrogen 3.212 N/A LYS 292.A NZ CYS 264.A O no hydrogen 3.031 N/A LYS 292.A NZ GLU 422.A OE1 no hydrogen 2.876 N/A ARG 294.A N CYS 290.A O no hydrogen 3.169 N/A LEU 295.A N GLY 291.A O no hydrogen 3.121 N/A LEU 296.A N LYS 292.A O no hydrogen 3.148 N/A GLU 297.A N PHE 293.A O no hydrogen 2.925 N/A ARG 298.A N ARG 294.A O no hydrogen 3.210 N/A LEU 299.A N LEU 295.A O no hydrogen 3.274 N/A LEU 300.A N LEU 296.A O no hydrogen 2.911 N/A VAL 301.A N GLU 297.A O no hydrogen 2.944 N/A ARG 302.A N ARG 298.A O no hydrogen 3.072 N/A ARG 302.A NH1 ARG 298.A O no hydrogen 3.040 N/A LEU 303.A N LEU 299.A O no hydrogen 2.984 N/A PHE 304.A N LEU 300.A O no hydrogen 2.875 N/A ALA 305.A N VAL 301.A O no hydrogen 3.210 N/A ASN 306.A ND2 HIS 308.A ND1 no hydrogen 3.311 N/A ASN 307.A N LEU 303.A O no hydrogen 3.136 N/A LYS 309.A NZ PHE 353.A O no hydrogen 3.475 N/A ILE 312.A N PHE 363.A O no hydrogen 3.498 N/A PHE 313.A N ILE 383.A O no hydrogen 3.044 N/A SER 314.A OG TRP 316.A O no hydrogen 3.207 N/A GLN 315.A N ASP 386.A OD2 no hydrogen 3.492 N/A ASP 321.A N THR 317.A O no hydrogen 3.176 N/A ILE 322.A N LYS 318.A O no hydrogen 2.955 N/A MET 323.A N LEU 319.A O no hydrogen 3.108 N/A ASP 324.A N LEU 320.A O no hydrogen 2.920 N/A TYR 325.A N ASP 321.A O no hydrogen 2.918 N/A TYR 325.A OH PRO 281.A O no hydrogen 3.105 N/A TYR 325.A OH GLU 329.A OE2 no hydrogen 3.023 N/A TYR 326.A N ILE 322.A O no hydrogen 2.935 N/A PHE 327.A N MET 323.A O no hydrogen 2.939 N/A SER 328.A N ASP 324.A O no hydrogen 2.885 N/A SER 328.A OG ASP 324.A O no hydrogen 3.391 N/A SER 328.A OG TYR 325.A O no hydrogen 2.990 N/A GLU 329.A N TYR 325.A O no hydrogen 3.104 N/A GLU 329.A N TYR 326.A O no hydrogen 3.273 N/A LYS 330.A NZ TYR 326.A OH no hydrogen 3.050 N/A GLY 331.A N PHE 327.A O no hydrogen 2.913 N/A PHE 332.A N PHE 327.A O no hydrogen 3.331 N/A ARG 336.A NH2 ASP 338.A OD2 no hydrogen 3.489 N/A ILE 337.A N LEU 364.A O no hydrogen 3.407 N/A ARG 346.A N LYS 342.A O no hydrogen 3.338 N/A ARG 347.A N LEU 343.A O no hydrogen 3.087 N/A ARG 347.A N ASP 344.A O no hydrogen 3.308 N/A ARG 347.A NE ASP 344.A OD1 no hydrogen 3.442 N/A ARG 347.A NH2 ASP 344.A OD1 no hydrogen 3.439 N/A ARG 348.A N ASP 344.A O no hydrogen 3.400 N/A ARG 348.A NH2 GLU 345.A O no hydrogen 3.251 N/A GLN 349.A N GLU 345.A O no hydrogen 3.341 N/A ILE 350.A N ARG 346.A O no hydrogen 3.234 N/A LYS 351.A N ARG 347.A O no hydrogen 3.186 N/A ASP 352.A N ARG 348.A O no hydrogen 2.904 N/A ASP 352.A N GLN 349.A O no hydrogen 3.186 N/A PHE 353.A N GLN 349.A O no hydrogen 2.579 N/A SER 354.A N ILE 350.A O no hydrogen 2.419 N/A SER 354.A OG ILE 350.A O no hydrogen 2.823 N/A ASP 355.A N ASP 352.A O no hydrogen 2.704 N/A SER 358.A N ASP 355.A OD2 no hydrogen 2.881 N/A SER 358.A OG ASP 355.A OD2 no hydrogen 2.544 N/A LEU 364.A N CYS 335.A O no hydrogen 2.808 N/A THR 367.A OG1 SER 314.A O no hydrogen 2.311 N/A ASP 380.A N LYS 309.A O no hydrogen 2.904 N/A THR 381.A N LYS 309.A O no hydrogen 3.196 N/A THR 381.A OG1 LYS 309.A O no hydrogen 3.052 N/A CYS 382.A N HIS 411.A O no hydrogen 3.340 N/A ILE 383.A N LEU 311.A O no hydrogen 2.552 N/A LEU 384.A N TYR 413.A O no hydrogen 3.232 N/A TYR 385.A N PHE 313.A O no hydrogen 3.235 N/A TYR 385.A OH ASN 265.A O no hydrogen 2.630 N/A MET 393.A N ASN 390.A O no hydrogen 3.139 N/A LEU 395.A N PRO 391.A O no hydrogen 2.955 N/A GLN 396.A N GLN 392.A O no hydrogen 3.264 N/A ALA 397.A N MET 393.A O no hydrogen 2.914 N/A MET 398.A N ASP 394.A O no hydrogen 2.898 N/A ASP 399.A N LEU 395.A O no hydrogen 2.904 N/A ARG 400.A N GLN 396.A O no hydrogen 2.919 N/A ARG 400.A NH1 THR 367.A O no hydrogen 3.190 N/A ARG 400.A NH2 ALA 369.A O no hydrogen 2.958 N/A ARG 400.A NH2 GLY 371.A O no hydrogen 3.034 N/A CYS 401.A N MET 398.A O no hydrogen 3.279 N/A CYS 401.A SG LEU 376.A O no hydrogen 4.047 N/A CYS 401.A SG ALA 379.A O no hydrogen 3.357 N/A HIS 402.A N MET 398.A O no hydrogen 2.968 N/A HIS 402.A NE2 PRO 208.A O no hydrogen 3.043 N/A GLN 406.A NE2 THR 377.A O no hydrogen 3.023 N/A GLN 406.A NE2 ALA 379.A O no hydrogen 2.747 N/A GLN 406.A NE2 CYS 401.A O no hydrogen 3.208 N/A VAL 412.A N LYS 211.A O no hydrogen 2.771 N/A TYR 413.A N CYS 382.A O no hydrogen 3.060 N/A ARG 414.A N ILE 213.A O no hydrogen 3.252 N/A SER 416.A OG THR 417.A O no hydrogen 3.438 N/A THR 417.A OG1 GLU 422.A OE2 no hydrogen 2.830 N/A ALA 418.A N ALA 217.A O no hydrogen 3.138 N/A THR 423.A OG1 THR 417.A O no hydrogen 3.025 N/A ARG 424.A N SER 420.A O no hydrogen 3.124 N/A VAL 425.A N ILE 421.A O no hydrogen 2.971 N/A LEU 426.A N GLU 422.A O no hydrogen 3.101 N/A LYS 427.A N THR 423.A O no hydrogen 3.260 N/A ARG 428.A N ARG 424.A O no hydrogen 3.084 N/A ALA 429.A N VAL 425.A O no hydrogen 2.876 N/A TYR 430.A N LEU 426.A O no hydrogen 2.871 N/A SER 431.A N LYS 427.A O no hydrogen 2.974 N/A SER 431.A OG ARG 428.A O no hydrogen 2.855 N/A LYS 432.A N ARG 428.A O no hydrogen 3.004 N/A LYS 432.A NZ ASN 165.A OD1 no hydrogen 2.705 N/A LYS 432.A NZ TRP 389.A O no hydrogen 3.181 N/A LEU 433.A N ALA 429.A O no hydrogen 2.954 N/A LYS 434.A N TYR 430.A O no hydrogen 3.026 N/A LEU 435.A N SER 431.A O no hydrogen 2.870 N/A GLU 436.A N LYS 432.A O no hydrogen 3.131 N/A HIS 437.A N LEU 433.A O no hydrogen 2.721 N/A VAL 438.A N LYS 434.A O no hydrogen 3.003 N/A ILE 440.A N GLU 436.A O no hydrogen 2.872 N/A GLY 441.A N HIS 437.A O no hydrogen 3.163 N/A GLN 442.A N VAL 439.A O no hydrogen 3.106 N/A