Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ks8_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N ARG 1.A O no hydrogen 3.387 N/A VAL 6.A N LEU 2.A O no hydrogen 2.982 N/A GLY 7.A N SER 3.A O no hydrogen 2.922 N/A ALA 8.A N ALA 4.A O no hydrogen 3.055 N/A ILE 9.A N PHE 5.A O no hydrogen 2.936 N/A ALA 10.A N VAL 6.A O no hydrogen 2.903 N/A GLY 12.A N ALA 8.A O no hydrogen 3.077 N/A ASP 13.A N ILE 9.A O no hydrogen 2.660 N/A LEU 14.A N VAL 11.A O no hydrogen 3.375 N/A THR 18.A N VAL 15.A O no hydrogen 3.183 N/A THR 18.A OG1 VAL 15.A O no hydrogen 2.723 N/A LYS 22.A NZ LEU 443.A O no hydrogen 2.384 N/A GLY 23.A N GLY 20.A O no hydrogen 3.254 N/A MET 24.A N SER 17.A O no hydrogen 2.364 N/A GLN 29.A NE2 SER 33.A OG no hydrogen 2.798 N/A SER 30.A OG THR 35.A OG1 no hydrogen 2.308 N/A SER 33.A N SER 30.A O no hydrogen 3.211 N/A SER 33.A OG SER 30.A O no hydrogen 3.526 N/A THR 35.A OG1 SER 30.A OG no hydrogen 2.308 N/A CYS 36.A SG SER 33.A O no hydrogen 3.544 N/A THR 39.A OG1 GLU 348.A OE1 no hydrogen 2.791 N/A THR 39.A OG1 GLU 348.A OE2 no hydrogen 3.361 N/A ASN 40.A ND2 SER 145.A O no hydrogen 2.298 N/A ALA 43.A N ASP 41.A OD1 no hydrogen 3.059 N/A THR 44.A OG1 ASP 41.A OD2 no hydrogen 3.548 N/A ILE 45.A N ASP 41.A O no hydrogen 3.176 N/A LEU 46.A N GLY 42.A O no hydrogen 3.040 N/A SER 48.A N THR 44.A O no hydrogen 3.280 N/A ILE 49.A N ILE 45.A O no hydrogen 3.197 N/A ASN 53.A ND2 SER 3.A O no hydrogen 3.009 N/A ALA 55.A N ASN 53.A OD1 no hydrogen 2.901 N/A ALA 56.A N ASN 53.A O no hydrogen 3.195 N/A LYS 57.A N PRO 54.A O no hydrogen 3.227 N/A VAL 58.A N ALA 55.A O no hydrogen 3.366 N/A VAL 60.A N ALA 56.A O no hydrogen 3.392 N/A ASN 61.A N LYS 57.A O no hydrogen 2.946 N/A ILE 62.A N VAL 58.A O no hydrogen 3.019 N/A SER 63.A N LEU 59.A O no hydrogen 3.126 N/A SER 63.A OG LEU 59.A O no hydrogen 3.004 N/A SER 63.A OG THR 78.A OG1 no hydrogen 3.238 N/A LYS 64.A N VAL 60.A O no hydrogen 3.100 N/A LYS 64.A N ASN 61.A O no hydrogen 3.240 N/A LYS 64.A NZ ASN 61.A OD1 no hydrogen 3.451 N/A GLN 66.A N ILE 62.A O no hydrogen 3.184 N/A GLN 66.A NE2 GLN 66.A O no hydrogen 3.358 N/A ASP 67.A N SER 63.A O no hydrogen 2.942 N/A GLU 69.A N VAL 65.A O no hydrogen 3.317 N/A GLU 69.A N GLN 66.A O no hydrogen 3.290 N/A VAL 70.A N GLN 66.A O no hydrogen 3.362 N/A THR 74.A OG1 ASP 67.A OD1 no hydrogen 3.278 N/A SER 76.A OG GLY 73.A O no hydrogen 2.485 N/A VAL 77.A N GLY 73.A O no hydrogen 3.093 N/A THR 78.A N THR 74.A O no hydrogen 3.154 N/A THR 78.A OG1 SER 63.A OG no hydrogen 3.238 N/A THR 78.A OG1 THR 74.A O no hydrogen 3.308 N/A VAL 79.A N THR 75.A O no hydrogen 3.058 N/A LEU 80.A N SER 76.A O no hydrogen 2.999 N/A SER 81.A N VAL 77.A O no hydrogen 2.919 N/A SER 81.A OG VAL 77.A O no hydrogen 2.836 N/A ALA 82.A N THR 78.A O no hydrogen 3.162 N/A GLU 83.A N VAL 79.A O no hydrogen 2.923 N/A LEU 84.A N LEU 80.A O no hydrogen 3.370 N/A ARG 86.A N ALA 82.A O no hydrogen 2.795 N/A ARG 86.A NE GLU 83.A OE1 no hydrogen 3.026 N/A ARG 86.A NH2 GLU 83.A OE1 no hydrogen 2.443 N/A GLU 87.A N GLU 83.A O no hydrogen 3.041 N/A ALA 88.A N LEU 85.A O no hydrogen 3.291 N/A GLU 89.A N ARG 86.A O no hydrogen 3.315 N/A ILE 92.A N GLU 89.A O no hydrogen 3.210 N/A ASP 93.A N GLU 89.A O no hydrogen 3.053 N/A SER 95.A OG LYS 90.A O no hydrogen 2.723 N/A LYS 96.A N ILE 92.A O no hydrogen 2.794 N/A GLN 100.A N HIS 98.A ND1 no hydrogen 3.012 N/A GLN 100.A NE2 GLN 100.A O no hydrogen 3.327 N/A ILE 102.A N HIS 98.A O no hydrogen 3.018 N/A ILE 103.A N PRO 99.A O no hydrogen 2.766 N/A GLU 104.A N GLN 100.A O no hydrogen 2.761 N/A GLY 105.A N THR 101.A O no hydrogen 2.793 N/A TYR 106.A N ILE 102.A O no hydrogen 3.060 N/A TYR 106.A N ILE 103.A O no hydrogen 3.209 N/A ARG 107.A NE GLU 104.A OE1 no hydrogen 3.258 N/A ARG 107.A NH2 GLU 104.A OE1 no hydrogen 3.569 N/A LEU 108.A N GLU 104.A O no hydrogen 3.374 N/A ALA 109.A N GLY 105.A O no hydrogen 3.024 N/A SER 110.A N TYR 106.A O no hydrogen 2.728 N/A ALA 111.A N ARG 107.A O no hydrogen 3.213 N/A ALA 113.A N ALA 109.A O no hydrogen 3.332 N/A LEU 114.A N SER 110.A O no hydrogen 3.095 N/A ASP 115.A N ALA 111.A O no hydrogen 3.299 N/A ALA 116.A N ALA 112.A O no hydrogen 3.106 N/A LEU 117.A N ALA 113.A O no hydrogen 3.423 N/A THR 118.A N LEU 114.A O no hydrogen 3.289 N/A THR 118.A OG1 LEU 114.A O no hydrogen 2.908 N/A THR 118.A OG1 TYR 460.A OH no hydrogen 2.626 N/A LYS 119.A N ASP 115.A O no hydrogen 3.151 N/A ALA 120.A N ALA 116.A O no hydrogen 3.165 N/A ALA 121.A N THR 118.A O no hydrogen 3.348 N/A MET 130.A N ASP 127.A O no hydrogen 2.953 N/A ARG 132.A N LYS 128.A O no hydrogen 3.154 N/A ARG 132.A NE ASN 161.A OD1 no hydrogen 2.853 N/A ARG 132.A NH2 ASN 161.A OD1 no hydrogen 2.684 N/A LEU 135.A N PHE 131.A O no hydrogen 3.300 N/A ILE 136.A N ARG 132.A O no hydrogen 3.146 N/A HIS 137.A N GLU 133.A O no hydrogen 3.085 N/A ILE 138.A N ASP 134.A O no hydrogen 3.084 N/A ALA 139.A N LEU 135.A O no hydrogen 3.000 N/A LYS 140.A N ILE 136.A O no hydrogen 3.167 N/A THR 141.A N ILE 138.A O no hydrogen 3.158 N/A THR 141.A OG1 ILE 138.A O no hydrogen 2.529 N/A THR 142.A N ILE 138.A O no hydrogen 3.189 N/A THR 142.A OG1 ALA 139.A O no hydrogen 2.799 N/A LEU 143.A N ALA 139.A O no hydrogen 3.187 N/A SER 144.A OG THR 141.A O no hydrogen 2.518 N/A SER 145.A OG SER 144.A O no hydrogen 2.359 N/A LYS 146.A NZ ASN 40.A OD1 no hydrogen 2.702 N/A SER 149.A N LYS 146.A O no hydrogen 2.867 N/A SER 149.A OG LYS 146.A O no hydrogen 2.999 N/A PHE 155.A N ASP 151.A O no hydrogen 2.828 N/A ALA 159.A N PHE 155.A O no hydrogen 3.299 N/A THR 160.A N ALA 156.A O no hydrogen 3.170 N/A THR 160.A OG1 ALA 156.A O no hydrogen 2.698 N/A ASN 161.A N GLU 157.A O no hydrogen 3.127 N/A ILE 163.A N ALA 159.A O no hydrogen 3.338 N/A LEU 164.A N THR 160.A O no hydrogen 3.317 N/A ARG 165.A N ALA 162.A O no hydrogen 3.233 N/A LEU 166.A N ILE 163.A O no hydrogen 3.097 N/A GLU 173.A N ASN 171.A OD1 no hydrogen 2.905 N/A ILE 175.A N LEU 172.A O no hydrogen 3.231 N/A ILE 178.A N ILE 336.A O no hydrogen 3.039 N/A LYS 179.A NZ LEU 346.A O no hydrogen 2.846 N/A LYS 179.A NZ GLU 350.A OE1 no hydrogen 2.578 N/A ILE 180.A N LEU 338.A O no hydrogen 3.064 N/A GLY 182.A N GLY 340.A O no hydrogen 3.070 N/A LYS 184.A N ASP 187.A OD2 no hydrogen 3.309 N/A ASP 187.A N LYS 184.A O no hydrogen 3.129 N/A SER 188.A N LEU 185.A O no hydrogen 3.328 N/A SER 188.A OG LEU 185.A O no hydrogen 3.288 N/A ASP 191.A N THR 335.A O no hydrogen 3.184 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.564 N/A GLY 193.A N ASP 191.A OD1 no hydrogen 2.894 N/A LEU 196.A N LEU 323.A O no hydrogen 2.978 N/A ILE 208.A N ILE 312.A O no hydrogen 3.394 N/A ASN 210.A N ASP 310.A O no hydrogen 3.042 N/A ALA 211.A N CYS 309.A O no hydrogen 3.178 N/A ALA 216.A N ILE 254.A O no hydrogen 3.056 N/A THR 218.A N ASN 255.A OD1 no hydrogen 3.172 N/A THR 219.A OG1 GLN 257.A OE1 no hydrogen 2.484 N/A LYS 224.A N ASP 223.A OD1 no hydrogen 2.504 N/A ALA 228.A N ALA 225.A O no hydrogen 3.382 N/A GLU 231.A N LEU 227.A O no hydrogen 3.088 N/A LYS 232.A N ALA 228.A O no hydrogen 3.105 N/A ALA 233.A N GLN 229.A O no hydrogen 3.195 N/A GLU 234.A N LEU 230.A O no hydrogen 3.273 N/A ARG 235.A N GLU 231.A O no hydrogen 3.320 N/A ARG 235.A NH2 TYR 260.A OH no hydrogen 2.598 N/A GLU 236.A N LYS 232.A O no hydrogen 3.162 N/A LYS 237.A N ALA 233.A O no hydrogen 3.108 N/A MET 238.A N GLU 234.A O no hydrogen 3.045 N/A ILE 242.A N MET 238.A O no hydrogen 3.174 N/A ALA 243.A N LYS 239.A O no hydrogen 2.989 N/A LYS 244.A N ASN 240.A O no hydrogen 3.236 N/A ILE 245.A N LYS 241.A O no hydrogen 3.190 N/A SER 246.A N ILE 242.A O no hydrogen 2.924 N/A SER 246.A OG ALA 243.A O no hydrogen 2.589 N/A LYS 247.A N ALA 243.A O no hydrogen 3.263 N/A PHE 248.A N ILE 245.A O no hydrogen 3.071 N/A GLY 249.A N SER 246.A O no hydrogen 3.489 N/A ASN 251.A ND2 ASN 210.A O no hydrogen 2.427 N/A THR 252.A N LYS 212.A O no hydrogen 3.065 N/A PHE 253.A N ASN 273.A O no hydrogen 2.707 N/A ILE 254.A N LEU 214.A O no hydrogen 3.273 N/A ASN 255.A N ILE 275.A O no hydrogen 2.935 N/A ASN 255.A ND2 THR 218.A O no hydrogen 3.216 N/A ASN 255.A ND2 LEU 258.A O no hydrogen 2.848 N/A ILE 259.A N GLU 276.A OE1 no hydrogen 3.333 N/A GLU 264.A N TYR 260.A O no hydrogen 3.144 N/A GLN 265.A N ASP 261.A O no hydrogen 2.668 N/A GLN 265.A NE2 GLN 265.A O no hydrogen 3.366 N/A LEU 266.A N TYR 262.A O no hydrogen 3.187 N/A PHE 267.A N GLU 264.A O no hydrogen 3.276 N/A THR 268.A N GLN 265.A O no hydrogen 3.179 N/A LEU 270.A N LEU 266.A O no hydrogen 3.368 N/A GLY 271.A N THR 268.A O no hydrogen 3.219 N/A ILE 272.A N PHE 267.A O no hydrogen 2.660 N/A ASN 273.A N ASN 251.A O no hydrogen 2.971 N/A ILE 275.A N PHE 253.A O no hydrogen 2.910 N/A GLY 282.A N ASP 279.A OD1 no hydrogen 2.805 N/A VAL 283.A N ASP 279.A O no hydrogen 3.274 N/A GLU 284.A N PHE 280.A O no hydrogen 3.457 N/A ARG 285.A N GLU 281.A O no hydrogen 3.317 N/A ARG 285.A NE GLU 281.A OE2 no hydrogen 3.496 N/A ARG 285.A NH1 ILE 175.A O no hydrogen 2.665 N/A ARG 285.A NH2 ILE 175.A O no hydrogen 3.327 N/A ARG 285.A NH2 GLU 281.A OE2 no hydrogen 3.043 N/A LEU 286.A N GLY 282.A O no hydrogen 2.910 N/A ALA 287.A N VAL 283.A O no hydrogen 3.120 N/A VAL 289.A N ARG 285.A O no hydrogen 3.095 N/A THR 290.A N LEU 286.A O no hydrogen 3.166 N/A THR 290.A OG1 LEU 286.A O no hydrogen 2.241 N/A SER 302.A OG SER 302.A O no hydrogen 2.509 N/A GLY 307.A N ILE 213.A O no hydrogen 3.292 N/A CYS 309.A N ALA 211.A O no hydrogen 2.819 N/A CYS 309.A SG ALA 211.A O no hydrogen 3.183 N/A ASP 310.A N GLY 327.A O no hydrogen 2.604 N/A VAL 311.A N SER 326.A O no hydrogen 2.688 N/A ILE 312.A N ILE 208.A O no hydrogen 3.213 N/A GLU 313.A N LYS 324.A O no hydrogen 2.884 N/A GLU 314.A N LYS 206.A O no hydrogen 3.110 N/A ILE 315.A N PHE 322.A O no hydrogen 3.285 N/A GLN 320.A NE2 ALA 197.A O no hydrogen 3.413 N/A PHE 322.A N ILE 315.A O no hydrogen 2.939 N/A LEU 323.A N LEU 196.A O no hydrogen 2.595 N/A LYS 324.A N GLU 313.A O no hydrogen 2.716 N/A PHE 325.A N GLY 193.A O no hydrogen 2.816 N/A SER 326.A N VAL 311.A O no hydrogen 2.575 N/A CYS 334.A N HIS 174.A O no hydrogen 3.336 N/A CYS 334.A SG GLU 332.A O no hydrogen 3.860 N/A THR 335.A N ASP 191.A O no hydrogen 2.725 N/A ILE 336.A N GLN 176.A O no hydrogen 3.078 N/A LEU 338.A N ILE 178.A O no hydrogen 2.721 N/A ARG 339.A NE ILE 180.A O no hydrogen 3.206 N/A ARG 339.A NE LEU 181.A O no hydrogen 3.365 N/A ARG 339.A NE GLY 182.A O no hydrogen 2.927 N/A ARG 339.A NH2 LEU 181.A O no hydrogen 2.921 N/A GLY 340.A N ILE 180.A O no hydrogen 3.316 N/A LEU 346.A N THR 342.A O no hydrogen 3.120 N/A ASP 347.A N ASP 343.A O no hydrogen 3.212 N/A ALA 349.A N THR 345.A O no hydrogen 3.096 N/A GLU 350.A N LEU 346.A O no hydrogen 2.987 N/A SER 352.A N GLU 348.A O no hydrogen 3.380 N/A SER 352.A OG GLU 348.A O no hydrogen 2.591 N/A LEU 353.A N ALA 349.A O no hydrogen 2.892 N/A HIS 354.A N GLU 350.A O no hydrogen 2.907 N/A ASP 355.A N ARG 351.A O no hydrogen 3.000 N/A ALA 356.A N SER 352.A O no hydrogen 3.085 N/A LEU 357.A N LEU 353.A O no hydrogen 2.969 N/A SER 358.A N HIS 354.A O no hydrogen 3.201 N/A SER 358.A OG HIS 354.A O no hydrogen 2.698 N/A LEU 360.A N ALA 356.A O no hydrogen 3.355 N/A SER 361.A N LEU 357.A O no hydrogen 3.022 N/A SER 361.A OG SER 358.A O no hydrogen 2.495 N/A GLN 362.A N VAL 359.A O no hydrogen 3.192 N/A THR 363.A N LEU 360.A O no hydrogen 3.284 N/A THR 363.A OG1 LEU 360.A O no hydrogen 2.345 N/A THR 364.A OG1 SER 361.A O no hydrogen 2.846 N/A GLU 366.A N GLN 362.A O no hydrogen 3.038 N/A THR 367.A OG1 ASP 123.A OD2 no hydrogen 2.920 N/A ARG 368.A NE GLU 366.A OE2 no hydrogen 2.453 N/A ARG 368.A NH2 GLU 366.A OE2 no hydrogen 2.913 N/A VAL 370.A N GLU 458.A O no hydrogen 2.559 N/A GLU 377.A N GLU 377.A OE1 no hydrogen 2.672 N/A VAL 379.A N CYS 375.A O no hydrogen 3.187 N/A MET 380.A N ALA 376.A O no hydrogen 3.338 N/A SER 381.A N GLU 377.A O no hydrogen 3.215 N/A SER 381.A N MET 378.A O no hydrogen 3.267 N/A SER 381.A OG ALA 403.A O no hydrogen 3.140 N/A ALA 383.A N VAL 379.A O no hydrogen 3.430 N/A VAL 384.A N MET 380.A O no hydrogen 3.410 N/A THR 386.A N LYS 382.A O no hydrogen 2.828 N/A THR 386.A OG1 LYS 382.A O no hydrogen 2.772 N/A GLU 387.A N ALA 383.A O no hydrogen 3.329 N/A ALA 388.A N ASP 385.A O no hydrogen 3.331 N/A VAL 399.A N LYS 395.A O no hydrogen 3.225 N/A GLU 400.A N SER 396.A O no hydrogen 3.062 N/A ALA 401.A N LEU 397.A O no hydrogen 2.998 N/A PHE 402.A N VAL 399.A O no hydrogen 3.128 N/A ALA 403.A N GLU 400.A O no hydrogen 3.290 N/A ALA 405.A N ALA 401.A O no hydrogen 3.247 N/A LEU 406.A N PHE 402.A O no hydrogen 3.357 N/A GLN 408.A N ALA 405.A O no hydrogen 3.304 N/A GLN 408.A NE2 ARG 404.A O no hydrogen 3.543 N/A THR 411.A N ARG 407.A O no hydrogen 3.323 N/A THR 411.A OG1 ARG 407.A O no hydrogen 2.650 N/A ILE 412.A N GLN 408.A O no hydrogen 2.979 N/A LEU 413.A N LEU 409.A O no hydrogen 2.953 N/A ALA 414.A N PRO 410.A O no hydrogen 2.930 N/A ASP 415.A N THR 411.A O no hydrogen 3.113 N/A ASN 416.A N ILE 412.A O no hydrogen 2.939 N/A ASN 416.A ND2 LYS 16.A O no hydrogen 2.568 N/A ASN 416.A ND2 LEU 19.A O no hydrogen 3.623 N/A ALA 417.A N LEU 413.A O no hydrogen 3.167 N/A GLY 418.A N ASP 415.A O no hydrogen 3.366 N/A SER 421.A OG ASP 415.A OD1 no hydrogen 3.160 N/A SER 422.A N ASP 420.A OD1 no hydrogen 3.115 N/A LEU 424.A N ASP 420.A O no hydrogen 3.303 N/A SER 426.A OG SER 422.A O no hydrogen 2.848 N/A LYS 427.A N GLU 423.A O no hydrogen 3.278 N/A LYS 427.A NZ GLU 423.A OE2 no hydrogen 2.844 N/A LEU 428.A N LEU 424.A O no hydrogen 3.078 N/A ARG 429.A N VAL 425.A O no hydrogen 3.301 N/A ARG 429.A N SER 426.A O no hydrogen 3.313 N/A ILE 432.A N LEU 428.A O no hydrogen 3.423 N/A SER 439.A OG ASP 450.A OD1 no hydrogen 2.289 N/A GLY 440.A N ALA 449.A O no hydrogen 2.814 N/A ASN 444.A N ASP 442.A OD1 no hydrogen 3.099 N/A ASN 444.A ND2 ASP 442.A OD1 no hydrogen 3.302 N/A ARG 452.A NH1 ASP 134.A OD1 no hydrogen 3.235 N/A LEU 454.A N ASP 450.A O no hydrogen 3.278 N/A ILE 456.A N MET 451.A O no hydrogen 2.939 N/A GLU 458.A N VAL 370.A O no hydrogen 2.574 N/A TYR 460.A N ARG 368.A O no hydrogen 3.207 N/A TYR 460.A OH THR 118.A OG1 no hydrogen 2.626 N/A LYS 461.A NZ GLN 362.A OE1 no hydrogen 2.691 N/A LYS 463.A N SER 459.A O no hydrogen 3.200 N/A LYS 463.A NZ GLU 377.A OE2 no hydrogen 3.305 N/A ARG 464.A N TYR 460.A O no hydrogen 3.029 N/A ALA 465.A N LYS 461.A O no hydrogen 3.293 N/A VAL 467.A N LYS 463.A O no hydrogen 3.403 N/A SER 468.A N ARG 464.A O no hydrogen 3.044 N/A SER 469.A N ALA 465.A O no hydrogen 3.066 N/A SER 469.A OG GLN 66.A OE1 no hydrogen 3.163 N/A SER 469.A OG ALA 465.A O no hydrogen 2.688 N/A ALA 470.A N VAL 466.A O no hydrogen 3.364 N/A SER 471.A N VAL 467.A O no hydrogen 3.365 N/A SER 471.A OG VAL 467.A O no hydrogen 2.983 N/A SER 471.A OG SER 468.A O no hydrogen 2.597 N/A GLU 472.A N SER 468.A O no hydrogen 3.021 N/A ALA 473.A N SER 469.A O no hydrogen 2.840 N/A ALA 474.A N ALA 470.A O no hydrogen 3.052 N/A VAL 476.A N ALA 473.A O no hydrogen 3.335 N/A LEU 477.A N ALA 473.A O no hydrogen 3.504 N/A LEU 478.A N ALA 474.A O no hydrogen 3.220 N/A ARG 479.A N GLU 475.A O no hydrogen 3.159 N/A ARG 485.A NH2 ASP 52.A O no hydrogen 2.822 N/A